*HEADER    HYDROLASE                               19-JAN-09   2KDV              
*TITLE     SOLUTION STRUCTURE OF RNA PYROPHOSPHOHYDROLASE RPPH FROM              
*TITLE    2 ESCHERICHIA COLI                                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RNA PYROPHOSPHOHYDROLASE;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 1-164;                                            
*COMPND   5 SYNONYM: RPPH, (DI)NUCLEOSIDE POLYPHOSPHATE HYDROLASE, AP5A          
*COMPND   6 PYROPHOSPHATASE;                                                     
*COMPND   7 EC: 3.6.1.-;                                                         
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_TAXID: 83333;                                               
*SOURCE   4 STRAIN: K12;                                                         
*SOURCE   5 GENE: RPPH, NUDH, YGDP, B2830, JW2798;                               
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET21                                      
*KEYWDS    NUDIX FAMILY, HYDROLASE, MAGNESIUM, MANGANESE, ZINC                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    21                                                                    
*AUTHOR    Y.BI, H.LI, C.JIN                                                     
*REVDAT   1   26-JAN-10 2KDV    0                                                


# 2722 atoms read from pdb file rpph_amber.pdb.
# 2 ILE PSI:  (2 ILE N)-(2 ILE CA)-(2 ILE C)-(3 ASP N)  99.0 151.0
 &rst     iat =    20,    22,    37,    39,
	  r1 =  98.0, r2 =  99.0, r3 = 151.0, r4 = 152.0,
	  rk2 =   50.0, rk3 =   50.0,				&end

# 5 ASP PHI:  (4 ASP C)-(5 ASP N)-(5 ASP CA)-(5 ASP C) -109.3 -81.0
 &rst     iat =    61,    63,    65,    73,
	  r1 = -110.3, r2 = -109.3, r3 = -81.0, r4 = -80.0,
	&end

# 5 ASP PSI:  (5 ASP N)-(5 ASP CA)-(5 ASP C)-(6 GLY N) -10.1  16.5
 &rst     iat =    63,    65,    73,    75,
	  r1 = -11.1, r2 = -10.1, r3 =  16.5, r4 =  17.5,
	&end

# 7 TYR PSI:  (7 TYR N)-(7 TYR CA)-(7 TYR C)-(8 ARG N) 100.9 168.3
 &rst     iat =    82,    84,   101,   103,
	  r1 =  99.9, r2 = 100.9, r3 = 168.3, r4 = 169.3,
	&end

# 8 ARG PHI:  (7 TYR C)-(8 ARG N)-(8 ARG CA)-(8 ARG C) -150.4 -89.5
 &rst     iat =   101,   103,   105,   125,
	  r1 = -151.4, r2 = -150.4, r3 = -89.5, r4 = -88.5,
	&end

# 8 ARG PSI:  (8 ARG N)-(8 ARG CA)-(8 ARG C)-(9 PRO N) 102.9 152.1
 &rst     iat =   103,   105,   125,   127,
	  r1 = 101.9, r2 = 102.9, r3 = 152.1, r4 = 153.1,
	&end

# 10 ASN PHI:  (9 PRO C)-(10 ASN N)-(10 ASN CA)-(10 ASN C) -156.7 -112.6
 &rst     iat =   139,   141,   143,   153,
	  r1 = -157.7, r2 = -156.7, r3 = -112.6, r4 = -111.6,
	&end

# 10 ASN PSI:  (10 ASN N)-(10 ASN CA)-(10 ASN C)-(11 VAL N) 135.4 168.4
 &rst     iat =   141,   143,   153,   155,
	  r1 = 134.4, r2 = 135.4, r3 = 168.4, r4 = 169.4,
	&end

# 11 VAL PHI:  (10 ASN C)-(11 VAL N)-(11 VAL CA)-(11 VAL C) -136.7 -100.9
 &rst     iat =   153,   155,   157,   169,
	  r1 = -137.7, r2 = -136.7, r3 = -100.9, r4 = -99.9,
	&end

# 11 VAL PSI:  (11 VAL N)-(11 VAL CA)-(11 VAL C)-(12 GLY N) 136.6 167.1
 &rst     iat =   155,   157,   169,   171,
	  r1 = 135.6, r2 = 136.6, r3 = 167.1, r4 = 168.1,
	&end

# 12 GLY PHI:  (11 VAL C)-(12 GLY N)-(12 GLY CA)-(12 GLY C) -152.6 -110.2
 &rst     iat =   169,   171,   173,   176,
	  r1 = -153.6, r2 = -152.6, r3 = -110.2, r4 = -109.2,
	&end

# 12 GLY PSI:  (12 GLY N)-(12 GLY CA)-(12 GLY C)-(13 ILE N) 125.2 162.9
 &rst     iat =   171,   173,   176,   178,
	  r1 = 124.2, r2 = 125.2, r3 = 162.9, r4 = 163.9,
	&end

# 13 ILE PHI:  (12 GLY C)-(13 ILE N)-(13 ILE CA)-(13 ILE C) -141.2 -101.7
 &rst     iat =   176,   178,   180,   195,
	  r1 = -142.2, r2 = -141.2, r3 = -101.7, r4 = -100.7,
	&end

# 13 ILE PSI:  (13 ILE N)-(13 ILE CA)-(13 ILE C)-(14 VAL N) 114.0 154.5
 &rst     iat =   178,   180,   195,   197,
	  r1 = 113.0, r2 = 114.0, r3 = 154.5, r4 = 155.5,
	&end

# 14 VAL PHI:  (13 ILE C)-(14 VAL N)-(14 VAL CA)-(14 VAL C) -129.7 -91.5
 &rst     iat =   195,   197,   199,   211,
	  r1 = -130.7, r2 = -129.7, r3 = -91.5, r4 = -90.5,
	&end

# 14 VAL PSI:  (14 VAL N)-(14 VAL CA)-(14 VAL C)-(15 ILE N)  98.1 136.8
 &rst     iat =   197,   199,   211,   213,
	  r1 =  97.1, r2 =  98.1, r3 = 136.8, r4 = 137.8,
	&end

# 16 CYS PHI:  (15 ILE C)-(16 CYS N)-(16 CYS CA)-(16 CYS C) -124.1 -96.0
 &rst     iat =   230,   232,   234,   241,
	  r1 = -125.1, r2 = -124.1, r3 = -96.0, r4 = -95.0,
	&end

# 16 CYS PSI:  (16 CYS N)-(16 CYS CA)-(16 CYS C)-(17 ASN N) 129.4 167.8
 &rst     iat =   232,   234,   241,   243,
	  r1 = 128.4, r2 = 129.4, r3 = 167.8, r4 = 168.8,
	&end

# 17 ASN PHI:  (16 CYS C)-(17 ASN N)-(17 ASN CA)-(17 ASN C) -138.9 -88.0
 &rst     iat =   241,   243,   245,   255,
	  r1 = -139.9, r2 = -138.9, r3 = -88.0, r4 = -87.0,
	&end

# 17 ASN PSI:  (17 ASN N)-(17 ASN CA)-(17 ASN C)-(18 ARG N) 139.2 205.3
 &rst     iat =   243,   245,   255,   257,
	  r1 = 138.2, r2 = 139.2, r3 = 205.3, r4 = 206.3,
	&end

# 19 GLN PHI:  (18 ARG C)-(19 GLN N)-(19 GLN CA)-(19 GLN C) -138.9 -66.4
 &rst     iat =   279,   281,   283,   296,
	  r1 = -139.9, r2 = -138.9, r3 = -66.4, r4 = -65.4,
	&end

# 19 GLN PSI:  (19 GLN N)-(19 GLN CA)-(19 GLN C)-(20 GLY N) -14.1   8.6
 &rst     iat =   281,   283,   296,   298,
	  r1 = -15.1, r2 = -14.1, r3 =   8.6, r4 =   9.6,
	&end

# 20 GLY PHI:  (19 GLN C)-(20 GLY N)-(20 GLY CA)-(20 GLY C)  61.0  96.7
 &rst     iat =   296,   298,   300,   303,
	  r1 =  60.0, r2 =  61.0, r3 =  96.7, r4 =  97.7,
	&end

# 20 GLY PSI:  (20 GLY N)-(20 GLY CA)-(20 GLY C)-(21 GLN N)   6.4  36.9
 &rst     iat =   298,   300,   303,   305,
	  r1 =   5.4, r2 =   6.4, r3 =  36.9, r4 =  37.9,
	&end

# 22 VAL PHI:  (21 GLN C)-(22 VAL N)-(22 VAL CA)-(22 VAL C) -158.1 -103.1
 &rst     iat =   320,   322,   324,   336,
	  r1 = -159.1, r2 = -158.1, r3 = -103.1, r4 = -102.1,
	&end

# 22 VAL PSI:  (22 VAL N)-(22 VAL CA)-(22 VAL C)-(23 MET N) 141.6 164.0
 &rst     iat =   322,   324,   336,   338,
	  r1 = 140.6, r2 = 141.6, r3 = 164.0, r4 = 165.0,
	&end

# 25 ALA PHI:  (24 TRP C)-(25 ALA N)-(25 ALA CA)-(25 ALA C) -163.3 -95.0
 &rst     iat =   377,   379,   381,   387,
	  r1 = -164.3, r2 = -163.3, r3 = -95.0, r4 = -94.0,
	&end

# 25 ALA PSI:  (25 ALA N)-(25 ALA CA)-(25 ALA C)-(26 ARG N) 114.3 170.1
 &rst     iat =   379,   381,   387,   389,
	  r1 = 113.3, r2 = 114.3, r3 = 170.1, r4 = 171.1,
	&end

# 28 PHE PHI:  (27 ARG C)-(28 PHE N)-(28 PHE CA)-(28 PHE C) -97.2 -41.7
 &rst     iat =   435,   437,   439,   455,
	  r1 = -98.2, r2 = -97.2, r3 = -41.7, r4 = -40.7,
	&end

# 28 PHE PSI:  (28 PHE N)-(28 PHE CA)-(28 PHE C)-(29 GLY N) 107.7 152.8
 &rst     iat =   437,   439,   455,   457,
	  r1 = 106.7, r2 = 107.7, r3 = 152.8, r4 = 153.8,
	&end

# 32 SER PHI:  (31 HIS C)-(32 SER N)-(32 SER CA)-(32 SER C) -138.6 -70.6
 &rst     iat =   496,   498,   500,   507,
	  r1 = -139.6, r2 = -138.6, r3 = -70.6, r4 = -69.6,
	&end

# 32 SER PSI:  (32 SER N)-(32 SER CA)-(32 SER C)-(33 TRP N) 106.9 179.6
 &rst     iat =   498,   500,   507,   509,
	  r1 = 105.9, r2 = 106.9, r3 = 179.6, r4 = 180.6,
	&end

# 33 TRP PHI:  (32 SER C)-(33 TRP N)-(33 TRP CA)-(33 TRP C) -133.0 -87.8
 &rst     iat =   507,   509,   511,   531,
	  r1 = -134.0, r2 = -133.0, r3 = -87.8, r4 = -86.8,
	&end

# 33 TRP PSI:  (33 TRP N)-(33 TRP CA)-(33 TRP C)-(34 GLN N) 106.4 168.7
 &rst     iat =   509,   511,   531,   533,
	  r1 = 105.4, r2 = 106.4, r3 = 168.7, r4 = 169.7,
	&end

# 35 PHE PHI:  (34 GLN C)-(35 PHE N)-(35 PHE CA)-(35 PHE C) -138.8 -70.7
 &rst     iat =   548,   550,   552,   568,
	  r1 = -139.8, r2 = -138.8, r3 = -70.7, r4 = -69.7,
	&end

# 35 PHE PSI:  (35 PHE N)-(35 PHE CA)-(35 PHE C)-(36 PRO N) 103.7 154.5
 &rst     iat =   550,   552,   568,   570,
	  r1 = 102.7, r2 = 103.7, r3 = 154.5, r4 = 155.5,
	&end

# 37 GLN PHI:  (36 PRO C)-(37 GLN N)-(37 GLN CA)-(37 GLN C) -157.3 -97.2
 &rst     iat =   582,   584,   586,   599,
	  r1 = -158.3, r2 = -157.3, r3 = -97.2, r4 = -96.2,
	&end

# 37 GLN PSI:  (37 GLN N)-(37 GLN CA)-(37 GLN C)-(38 GLY N) 131.2 180.9
 &rst     iat =   584,   586,   599,   601,
	  r1 = 130.2, r2 = 131.2, r3 = 180.9, r4 = 181.9,
	&end

# 40 ILE PHI:  (39 GLY C)-(40 ILE N)-(40 ILE CA)-(40 ILE C) -115.0 -74.9
 &rst     iat =   613,   615,   617,   632,
	  r1 = -116.0, r2 = -115.0, r3 = -74.9, r4 = -73.9,
	&end

# 40 ILE PSI:  (40 ILE N)-(40 ILE CA)-(40 ILE C)-(41 ASN N) 110.5 138.9
 &rst     iat =   615,   617,   632,   634,
	  r1 = 109.5, r2 = 110.5, r3 = 138.9, r4 = 139.9,
	&end

# 44 GLU PHI:  (43 GLY C)-(44 GLU N)-(44 GLU CA)-(44 GLU C) -113.8 -71.1
 &rst     iat =   667,   669,   671,   682,
	  r1 = -114.8, r2 = -113.8, r3 = -71.1, r4 = -70.1,
	&end

# 44 GLU PSI:  (44 GLU N)-(44 GLU CA)-(44 GLU C)-(45 SER N) 131.4 163.8
 &rst     iat =   669,   671,   682,   684,
	  r1 = 130.4, r2 = 131.4, r3 = 163.8, r4 = 164.8,
	&end

# 45 SER PHI:  (44 GLU C)-(45 SER N)-(45 SER CA)-(45 SER C) -117.8 -70.9
 &rst     iat =   682,   684,   686,   693,
	  r1 = -118.8, r2 = -117.8, r3 = -70.9, r4 = -69.9,
	&end

# 45 SER PSI:  (45 SER N)-(45 SER CA)-(45 SER C)-(46 ALA N) 145.2 187.7
 &rst     iat =   684,   686,   693,   695,
	  r1 = 144.2, r2 = 145.2, r3 = 187.7, r4 = 188.7,
	&end

# 46 ALA PHI:  (45 SER C)-(46 ALA N)-(46 ALA CA)-(46 ALA C) -68.8 -55.1
 &rst     iat =   693,   695,   697,   703,
	  r1 = -69.8, r2 = -68.8, r3 = -55.1, r4 = -54.1,
	&end

# 46 ALA PSI:  (46 ALA N)-(46 ALA CA)-(46 ALA C)-(47 GLU N) -43.3 -26.5
 &rst     iat =   695,   697,   703,   705,
	  r1 = -44.3, r2 = -43.3, r3 = -26.5, r4 = -25.5,
	&end

# 47 GLU PHI:  (46 ALA C)-(47 GLU N)-(47 GLU CA)-(47 GLU C) -74.6 -61.6
 &rst     iat =   703,   705,   707,   718,
	  r1 = -75.6, r2 = -74.6, r3 = -61.6, r4 = -60.6,
	&end

# 47 GLU PSI:  (47 GLU N)-(47 GLU CA)-(47 GLU C)-(48 GLN N) -47.0 -38.7
 &rst     iat =   705,   707,   718,   720,
	  r1 = -48.0, r2 = -47.0, r3 = -38.7, r4 = -37.7,
	&end

# 48 GLN PHI:  (47 GLU C)-(48 GLN N)-(48 GLN CA)-(48 GLN C) -73.2 -57.6
 &rst     iat =   718,   720,   722,   735,
	  r1 = -74.2, r2 = -73.2, r3 = -57.6, r4 = -56.6,
	&end

# 48 GLN PSI:  (48 GLN N)-(48 GLN CA)-(48 GLN C)-(49 ALA N) -45.6 -29.6
 &rst     iat =   720,   722,   735,   737,
	  r1 = -46.6, r2 = -45.6, r3 = -29.6, r4 = -28.6,
	&end

# 49 ALA PHI:  (48 GLN C)-(49 ALA N)-(49 ALA CA)-(49 ALA C) -72.1 -61.9
 &rst     iat =   735,   737,   739,   745,
	  r1 = -73.1, r2 = -72.1, r3 = -61.9, r4 = -60.9,
	&end

# 49 ALA PSI:  (49 ALA N)-(49 ALA CA)-(49 ALA C)-(50 MET N) -49.3 -35.5
 &rst     iat =   737,   739,   745,   747,
	  r1 = -50.3, r2 = -49.3, r3 = -35.5, r4 = -34.5,
	&end

# 50 MET PHI:  (49 ALA C)-(50 MET N)-(50 MET CA)-(50 MET C) -73.2 -55.9
 &rst     iat =   745,   747,   749,   762,
	  r1 = -74.2, r2 = -73.2, r3 = -55.9, r4 = -54.9,
	&end

# 50 MET PSI:  (50 MET N)-(50 MET CA)-(50 MET C)-(51 TYR N) -50.6 -32.8
 &rst     iat =   747,   749,   762,   764,
	  r1 = -51.6, r2 = -50.6, r3 = -32.8, r4 = -31.8,
	&end

# 51 TYR PHI:  (50 MET C)-(51 TYR N)-(51 TYR CA)-(51 TYR C) -65.9 -57.1
 &rst     iat =   762,   764,   766,   783,
	  r1 = -66.9, r2 = -65.9, r3 = -57.1, r4 = -56.1,
	&end

# 51 TYR PSI:  (51 TYR N)-(51 TYR CA)-(51 TYR C)-(52 ARG N) -48.7 -31.2
 &rst     iat =   764,   766,   783,   785,
	  r1 = -49.7, r2 = -48.7, r3 = -31.2, r4 = -30.2,
	&end

# 52 ARG PHI:  (51 TYR C)-(52 ARG N)-(52 ARG CA)-(52 ARG C) -73.6 -52.3
 &rst     iat =   783,   785,   787,   807,
	  r1 = -74.6, r2 = -73.6, r3 = -52.3, r4 = -51.3,
	&end

# 52 ARG PSI:  (52 ARG N)-(52 ARG CA)-(52 ARG C)-(53 GLU N) -49.4 -29.2
 &rst     iat =   785,   787,   807,   809,
	  r1 = -50.4, r2 = -49.4, r3 = -29.2, r4 = -28.2,
	&end

# 53 GLU PHI:  (52 ARG C)-(53 GLU N)-(53 GLU CA)-(53 GLU C) -88.0 -64.2
 &rst     iat =   807,   809,   811,   822,
	  r1 = -89.0, r2 = -88.0, r3 = -64.2, r4 = -63.2,
	&end

# 53 GLU PSI:  (53 GLU N)-(53 GLU CA)-(53 GLU C)-(54 LEU N) -43.7 -24.7
 &rst     iat =   809,   811,   822,   824,
	  r1 = -44.7, r2 = -43.7, r3 = -24.7, r4 = -23.7,
	&end

# 54 LEU PHI:  (53 GLU C)-(54 LEU N)-(54 LEU CA)-(54 LEU C) -73.3 -53.7
 &rst     iat =   822,   824,   826,   841,
	  r1 = -74.3, r2 = -73.3, r3 = -53.7, r4 = -52.7,
	&end

# 54 LEU PSI:  (54 LEU N)-(54 LEU CA)-(54 LEU C)-(55 PHE N) -51.4 -37.6
 &rst     iat =   824,   826,   841,   843,
	  r1 = -52.4, r2 = -51.4, r3 = -37.6, r4 = -36.6,
	&end

# 55 PHE PHI:  (54 LEU C)-(55 PHE N)-(55 PHE CA)-(55 PHE C) -70.9 -55.2
 &rst     iat =   841,   843,   845,   861,
	  r1 = -71.9, r2 = -70.9, r3 = -55.2, r4 = -54.2,
	&end

# 55 PHE PSI:  (55 PHE N)-(55 PHE CA)-(55 PHE C)-(56 GLU N) -48.6 -31.3
 &rst     iat =   843,   845,   861,   863,
	  r1 = -49.6, r2 = -48.6, r3 = -31.3, r4 = -30.3,
	&end

# 56 GLU PHI:  (55 PHE C)-(56 GLU N)-(56 GLU CA)-(56 GLU C) -74.9 -54.1
 &rst     iat =   861,   863,   865,   876,
	  r1 = -75.9, r2 = -74.9, r3 = -54.1, r4 = -53.1,
	&end

# 56 GLU PSI:  (56 GLU N)-(56 GLU CA)-(56 GLU C)-(57 GLU N) -40.4  10.6
 &rst     iat =   863,   865,   876,   878,
	  r1 = -41.4, r2 = -40.4, r3 =  10.6, r4 =  11.6,
	&end

# 57 GLU PHI:  (56 GLU C)-(57 GLU N)-(57 GLU CA)-(57 GLU C) -117.2 -55.9
 &rst     iat =   876,   878,   880,   891,
	  r1 = -118.2, r2 = -117.2, r3 = -55.9, r4 = -54.9,
	&end

# 57 GLU PSI:  (57 GLU N)-(57 GLU CA)-(57 GLU C)-(58 VAL N) -61.0  -7.0
 &rst     iat =   878,   880,   891,   893,
	  r1 = -62.0, r2 = -61.0, r3 =  -7.0, r4 =  -6.0,
	&end

# 58 VAL PHI:  (57 GLU C)-(58 VAL N)-(58 VAL CA)-(58 VAL C) -135.8 -99.2
 &rst     iat =   891,   893,   895,   907,
	  r1 = -136.8, r2 = -135.8, r3 = -99.2, r4 = -98.2,
	&end

# 58 VAL PSI:  (58 VAL N)-(58 VAL CA)-(58 VAL C)-(59 GLY N) -35.4  19.1
 &rst     iat =   893,   895,   907,   909,
	  r1 = -36.4, r2 = -35.4, r3 =  19.1, r4 =  20.1,
	&end

# 60 LEU PHI:  (59 GLY C)-(60 LEU N)-(60 LEU CA)-(60 LEU C) -125.4 -69.2
 &rst     iat =   914,   916,   918,   933,
	  r1 = -126.4, r2 = -125.4, r3 = -69.2, r4 = -68.2,
	&end

# 60 LEU PSI:  (60 LEU N)-(60 LEU CA)-(60 LEU C)-(61 SER N) 140.9 166.2
 &rst     iat =   916,   918,   933,   935,
	  r1 = 139.9, r2 = 140.9, r3 = 166.2, r4 = 167.2,
	&end

# 61 SER PHI:  (60 LEU C)-(61 SER N)-(61 SER CA)-(61 SER C) -137.2 -80.1
 &rst     iat =   933,   935,   937,   944,
	  r1 = -138.2, r2 = -137.2, r3 = -80.1, r4 = -79.1,
	&end

# 61 SER PSI:  (61 SER N)-(61 SER CA)-(61 SER C)-(62 ARG N) 145.3 177.9
 &rst     iat =   935,   937,   944,   946,
	  r1 = 144.3, r2 = 145.3, r3 = 177.9, r4 = 178.9,
	&end

# 62 ARG PHI:  (61 SER C)-(62 ARG N)-(62 ARG CA)-(62 ARG C) -75.2 -37.4
 &rst     iat =   944,   946,   948,   968,
	  r1 = -76.2, r2 = -75.2, r3 = -37.4, r4 = -36.4,
	&end

# 62 ARG PSI:  (62 ARG N)-(62 ARG CA)-(62 ARG C)-(63 LYS N) -41.2 -15.2
 &rst     iat =   946,   948,   968,   970,
	  r1 = -42.2, r2 = -41.2, r3 = -15.2, r4 = -14.2,
	&end

# 63 LYS PHI:  (62 ARG C)-(63 LYS N)-(63 LYS CA)-(63 LYS C) -93.9 -60.7
 &rst     iat =   968,   970,   972,   990,
	  r1 = -94.9, r2 = -93.9, r3 = -60.7, r4 = -59.7,
	&end

# 63 LYS PSI:  (63 LYS N)-(63 LYS CA)-(63 LYS C)-(64 ASP N) -33.8   3.0
 &rst     iat =   970,   972,   990,   992,
	  r1 = -34.8, r2 = -33.8, r3 =   3.0, r4 =   4.0,
	&end

# 65 VAL PHI:  (64 ASP C)-(65 VAL N)-(65 VAL CA)-(65 VAL C) -150.5 -123.0
 &rst     iat =  1002,  1004,  1006,  1018,
	  r1 = -151.5, r2 = -150.5, r3 = -123.0, r4 = -122.0,
	&end

# 65 VAL PSI:  (65 VAL N)-(65 VAL CA)-(65 VAL C)-(66 ARG N) 134.6 165.1
 &rst     iat =  1004,  1006,  1018,  1020,
	  r1 = 133.6, r2 = 134.6, r3 = 165.1, r4 = 166.1,
	&end

# 66 ARG PHI:  (65 VAL C)-(66 ARG N)-(66 ARG CA)-(66 ARG C) -141.1 -111.2
 &rst     iat =  1018,  1020,  1022,  1042,
	  r1 = -142.1, r2 = -141.1, r3 = -111.2, r4 = -110.2,
	&end

# 66 ARG PSI:  (66 ARG N)-(66 ARG CA)-(66 ARG C)-(67 ILE N) 116.9 155.2
 &rst     iat =  1020,  1022,  1042,  1044,
	  r1 = 115.9, r2 = 116.9, r3 = 155.2, r4 = 156.2,
	&end

# 70 SER PHI:  (69 ALA C)-(70 SER N)-(70 SER CA)-(70 SER C) -163.3 -93.4
 &rst     iat =  1090,  1092,  1094,  1101,
	  r1 = -164.3, r2 = -163.3, r3 = -93.4, r4 = -92.4,
	&end

# 70 SER PSI:  (70 SER N)-(70 SER CA)-(70 SER C)-(71 THR N) 124.8 154.9
 &rst     iat =  1092,  1094,  1101,  1103,
	  r1 = 123.8, r2 = 124.8, r3 = 154.9, r4 = 155.9,
	&end

# 71 THR PHI:  (70 SER C)-(71 THR N)-(71 THR CA)-(71 THR C) -117.4 -69.7
 &rst     iat =  1101,  1103,  1105,  1115,
	  r1 = -118.4, r2 = -117.4, r3 = -69.7, r4 = -68.7,
	&end

# 71 THR PSI:  (71 THR N)-(71 THR CA)-(71 THR C)-(72 ARG N) 125.3 162.6
 &rst     iat =  1103,  1105,  1115,  1117,
	  r1 = 124.3, r2 = 125.3, r3 = 162.6, r4 = 163.6,
	&end

# 76 ARG PHI:  (75 LEU C)-(76 ARG N)-(76 ARG CA)-(76 ARG C) -148.7 -72.0
 &rst     iat =  1196,  1198,  1200,  1220,
	  r1 = -149.7, r2 = -148.7, r3 = -72.0, r4 = -71.0,
	&end

# 76 ARG PSI:  (76 ARG N)-(76 ARG CA)-(76 ARG C)-(77 TYR N) 131.4 153.1
 &rst     iat =  1198,  1200,  1220,  1222,
	  r1 = 130.4, r2 = 131.4, r3 = 153.1, r4 = 154.1,
	&end

# 78 LYS PHI:  (77 TYR C)-(78 LYS N)-(78 LYS CA)-(78 LYS C) -131.2 -78.0
 &rst     iat =  1241,  1243,  1245,  1263,
	  r1 = -132.2, r2 = -131.2, r3 = -78.0, r4 = -77.0,
	&end

# 78 LYS PSI:  (78 LYS N)-(78 LYS CA)-(78 LYS C)-(79 LEU N) 118.3 146.2
 &rst     iat =  1243,  1245,  1263,  1265,
	  r1 = 117.3, r2 = 118.3, r3 = 146.2, r4 = 147.2,
	&end

# 79 LEU PHI:  (78 LYS C)-(79 LEU N)-(79 LEU CA)-(79 LEU C) -115.6 -66.9
 &rst     iat =  1263,  1265,  1267,  1282,
	  r1 = -116.6, r2 = -115.6, r3 = -66.9, r4 = -65.9,
	&end

# 79 LEU PSI:  (79 LEU N)-(79 LEU CA)-(79 LEU C)-(80 PRO N)  98.9 148.6
 &rst     iat =  1265,  1267,  1282,  1284,
	  r1 =  97.9, r2 =  98.9, r3 = 148.6, r4 = 149.6,
	&end

# 81 LYS PHI:  (80 PRO C)-(81 LYS N)-(81 LYS CA)-(81 LYS C) -70.2 -53.1
 &rst     iat =  1296,  1298,  1300,  1318,
	  r1 = -71.2, r2 = -70.2, r3 = -53.1, r4 = -52.1,
	&end

# 81 LYS PSI:  (81 LYS N)-(81 LYS CA)-(81 LYS C)-(82 ARG N) -37.5  -2.2
 &rst     iat =  1298,  1300,  1318,  1320,
	  r1 = -38.5, r2 = -37.5, r3 =  -2.2, r4 =  -1.2,
	&end

# 82 ARG PHI:  (81 LYS C)-(82 ARG N)-(82 ARG CA)-(82 ARG C) -88.3 -44.3
 &rst     iat =  1318,  1320,  1322,  1342,
	  r1 = -89.3, r2 = -88.3, r3 = -44.3, r4 = -43.3,
	&end

# 82 ARG PSI:  (82 ARG N)-(82 ARG CA)-(82 ARG C)-(83 LEU N) -39.8   1.6
 &rst     iat =  1320,  1322,  1342,  1344,
	  r1 = -40.8, r2 = -39.8, r3 =   1.6, r4 =   2.6,
	&end

# 84 VAL PHI:  (83 LEU C)-(84 VAL N)-(84 VAL CA)-(84 VAL C) -99.3 -65.5
 &rst     iat =  1361,  1363,  1365,  1377,
	  r1 = -100.3, r2 = -99.3, r3 = -65.5, r4 = -64.5,
	&end

# 84 VAL PSI:  (84 VAL N)-(84 VAL CA)-(84 VAL C)-(85 ARG N) 115.9 143.5
 &rst     iat =  1363,  1365,  1377,  1379,
	  r1 = 114.9, r2 = 115.9, r3 = 143.5, r4 = 144.5,
	&end

# 88 THR PHI:  (87 ASP C)-(88 THR N)-(88 THR CA)-(88 THR C) -138.4 -76.1
 &rst     iat =  1437,  1439,  1441,  1451,
	  r1 = -139.4, r2 = -138.4, r3 = -76.1, r4 = -75.1,
	&end

# 88 THR PSI:  (88 THR N)-(88 THR CA)-(88 THR C)-(89 LYS N) 110.9 188.3
 &rst     iat =  1439,  1441,  1451,  1453,
	  r1 = 109.9, r2 = 110.9, r3 = 188.3, r4 = 189.3,
	&end

# 89 LYS PHI:  (88 THR C)-(89 LYS N)-(89 LYS CA)-(89 LYS C) -130.3 -55.1
 &rst     iat =  1451,  1453,  1455,  1473,
	  r1 = -131.3, r2 = -130.3, r3 = -55.1, r4 = -54.1,
	&end

# 89 LYS PSI:  (89 LYS N)-(89 LYS CA)-(89 LYS C)-(90 PRO N)  98.4 174.0
 &rst     iat =  1453,  1455,  1473,  1475,
	  r1 =  97.4, r2 =  98.4, r3 = 174.0, r4 = 175.0,
	&end

# 91 VAL PHI:  (90 PRO C)-(91 VAL N)-(91 VAL CA)-(91 VAL C) -109.1 -63.1
 &rst     iat =  1487,  1489,  1491,  1503,
	  r1 = -110.1, r2 = -109.1, r3 = -63.1, r4 = -62.1,
	&end

# 91 VAL PSI:  (91 VAL N)-(91 VAL CA)-(91 VAL C)-(92 CYS N) 110.5 140.7
 &rst     iat =  1489,  1491,  1503,  1505,
	  r1 = 109.5, r2 = 110.5, r3 = 140.7, r4 = 141.7,
	&end

# 92 CYS PHI:  (91 VAL C)-(92 CYS N)-(92 CYS CA)-(92 CYS C) -110.6 -61.0
 &rst     iat =  1503,  1505,  1507,  1514,
	  r1 = -111.6, r2 = -110.6, r3 = -61.0, r4 = -60.0,
	&end

# 92 CYS PSI:  (92 CYS N)-(92 CYS CA)-(92 CYS C)-(93 ILE N) -209.1 149.5
 &rst     iat =  1505,  1507,  1514,  1516,
	  r1 = -210.1, r2 = -209.1, r3 = 149.5, r4 = 150.5,
	&end

# 95 GLN PHI:  (94 GLY C)-(95 GLN N)-(95 GLN CA)-(95 GLN C) -165.5 -113.6
 &rst     iat =  1540,  1542,  1544,  1557,
	  r1 = -166.5, r2 = -165.5, r3 = -113.6, r4 = -112.6,
	&end

# 95 GLN PSI:  (95 GLN N)-(95 GLN CA)-(95 GLN C)-(96 LYS N) 126.3 175.7
 &rst     iat =  1542,  1544,  1557,  1559,
	  r1 = 125.3, r2 = 126.3, r3 = 175.7, r4 = 176.7,
	&end

# 96 LYS PHI:  (95 GLN C)-(96 LYS N)-(96 LYS CA)-(96 LYS C) -134.3 -86.8
 &rst     iat =  1557,  1559,  1561,  1579,
	  r1 = -135.3, r2 = -134.3, r3 = -86.8, r4 = -85.8,
	&end

# 96 LYS PSI:  (96 LYS N)-(96 LYS CA)-(96 LYS C)-(97 GLN N) 121.3 150.5
 &rst     iat =  1559,  1561,  1579,  1581,
	  r1 = 120.3, r2 = 121.3, r3 = 150.5, r4 = 151.5,
	&end

# 97 GLN PHI:  (96 LYS C)-(97 GLN N)-(97 GLN CA)-(97 GLN C) -131.7 -111.6
 &rst     iat =  1579,  1581,  1583,  1596,
	  r1 = -132.7, r2 = -131.7, r3 = -111.6, r4 = -110.6,
	&end

# 97 GLN PSI:  (97 GLN N)-(97 GLN CA)-(97 GLN C)-(98 LYS N) 118.5 152.9
 &rst     iat =  1581,  1583,  1596,  1598,
	  r1 = 117.5, r2 = 118.5, r3 = 152.9, r4 = 153.9,
	&end

# 98 LYS PHI:  (97 GLN C)-(98 LYS N)-(98 LYS CA)-(98 LYS C) -144.2 -88.5
 &rst     iat =  1596,  1598,  1600,  1618,
	  r1 = -145.2, r2 = -144.2, r3 = -88.5, r4 = -87.5,
	&end

# 98 LYS PSI:  (98 LYS N)-(98 LYS CA)-(98 LYS C)-(99 TRP N) 119.0 153.7
 &rst     iat =  1598,  1600,  1618,  1620,
	  r1 = 118.0, r2 = 119.0, r3 = 153.7, r4 = 154.7,
	&end

# 99 TRP PHI:  (98 LYS C)-(99 TRP N)-(99 TRP CA)-(99 TRP C) -136.0 -86.0
 &rst     iat =  1618,  1620,  1622,  1642,
	  r1 = -137.0, r2 = -136.0, r3 = -86.0, r4 = -85.0,
	&end

# 99 TRP PSI:  (99 TRP N)-(99 TRP CA)-(99 TRP C)-(100 PHE N) 123.1 166.1
 &rst     iat =  1620,  1622,  1642,  1644,
	  r1 = 122.1, r2 = 123.1, r3 = 166.1, r4 = 167.1,
	&end

# 100 PHE PHI:  (99 TRP C)-(100 PHE N)-(100 PHE CA)-(100 PHE C) -151.9 -116.4
 &rst     iat =  1642,  1644,  1646,  1662,
	  r1 = -152.9, r2 = -151.9, r3 = -116.4, r4 = -115.4,
	&end

# 100 PHE PSI:  (100 PHE N)-(100 PHE CA)-(100 PHE C)-(101 LEU N) 125.9 152.1
 &rst     iat =  1644,  1646,  1662,  1664,
	  r1 = 124.9, r2 = 125.9, r3 = 152.1, r4 = 153.1,
	&end

# 101 LEU PHI:  (100 PHE C)-(101 LEU N)-(101 LEU CA)-(101 LEU C) -111.8 -76.5
 &rst     iat =  1662,  1664,  1666,  1681,
	  r1 = -112.8, r2 = -111.8, r3 = -76.5, r4 = -75.5,
	&end

# 101 LEU PSI:  (101 LEU N)-(101 LEU CA)-(101 LEU C)-(102 LEU N) 102.2 133.5
 &rst     iat =  1664,  1666,  1681,  1683,
	  r1 = 101.2, r2 = 102.2, r3 = 133.5, r4 = 134.5,
	&end

# 102 LEU PHI:  (101 LEU C)-(102 LEU N)-(102 LEU CA)-(102 LEU C) -131.7 -97.4
 &rst     iat =  1681,  1683,  1685,  1700,
	  r1 = -132.7, r2 = -131.7, r3 = -97.4, r4 = -96.4,
	&end

# 102 LEU PSI:  (102 LEU N)-(102 LEU CA)-(102 LEU C)-(103 GLN N) 124.9 156.6
 &rst     iat =  1683,  1685,  1700,  1702,
	  r1 = 123.9, r2 = 124.9, r3 = 156.6, r4 = 157.6,
	&end

# 104 LEU PHI:  (103 GLN C)-(104 LEU N)-(104 LEU CA)-(104 LEU C) -111.1 -62.3
 &rst     iat =  1717,  1719,  1721,  1736,
	  r1 = -112.1, r2 = -111.1, r3 = -62.3, r4 = -61.3,
	&end

# 104 LEU PSI:  (104 LEU N)-(104 LEU CA)-(104 LEU C)-(105 VAL N) 109.4 158.4
 &rst     iat =  1719,  1721,  1736,  1738,
	  r1 = 108.4, r2 = 109.4, r3 = 158.4, r4 = 159.4,
	&end

# 108 ASP PHI:  (107 GLY C)-(108 ASP N)-(108 ASP CA)-(108 ASP C) -84.5 -49.5
 &rst     iat =  1770,  1772,  1774,  1782,
	  r1 = -85.5, r2 = -84.5, r3 = -49.5, r4 = -48.5,
	&end

# 108 ASP PSI:  (108 ASP N)-(108 ASP CA)-(108 ASP C)-(109 ALA N) -46.2 -11.8
 &rst     iat =  1772,  1774,  1782,  1784,
	  r1 = -47.2, r2 = -46.2, r3 = -11.8, r4 = -10.8,
	&end

# 118 THR PHI:  (117 SER C)-(118 THR N)-(118 THR CA)-(118 THR C) -116.5 -73.1
 &rst     iat =  1910,  1912,  1914,  1924,
	  r1 = -117.5, r2 = -116.5, r3 = -73.1, r4 = -72.1,
	&end

# 118 THR PSI:  (118 THR N)-(118 THR CA)-(118 THR C)-(119 PRO N) 113.7 159.2
 &rst     iat =  1912,  1914,  1924,  1926,
	  r1 = 112.7, r2 = 113.7, r3 = 159.2, r4 = 160.2,
	&end

# 124 TRP PHI:  (123 GLY C)-(124 TRP N)-(124 TRP CA)-(124 TRP C) -150.4 -75.4
 &rst     iat =  1992,  1994,  1996,  2016,
	  r1 = -151.4, r2 = -150.4, r3 = -75.4, r4 = -74.4,
	&end

# 124 TRP PSI:  (124 TRP N)-(124 TRP CA)-(124 TRP C)-(125 ARG N) 126.8 159.4
 &rst     iat =  1994,  1996,  2016,  2018,
	  r1 = 125.8, r2 = 126.8, r3 = 159.4, r4 = 160.4,
	&end

# 125 ARG PHI:  (124 TRP C)-(125 ARG N)-(125 ARG CA)-(125 ARG C) -151.9 -120.6
 &rst     iat =  2016,  2018,  2020,  2040,
	  r1 = -152.9, r2 = -151.9, r3 = -120.6, r4 = -119.6,
	&end

# 125 ARG PSI:  (125 ARG N)-(125 ARG CA)-(125 ARG C)-(126 TRP N) 116.8 172.7
 &rst     iat =  2018,  2020,  2040,  2042,
	  r1 = 115.8, r2 = 116.8, r3 = 172.7, r4 = 173.7,
	&end

# 126 TRP PHI:  (125 ARG C)-(126 TRP N)-(126 TRP CA)-(126 TRP C) -126.0 -89.6
 &rst     iat =  2040,  2042,  2044,  2064,
	  r1 = -127.0, r2 = -126.0, r3 = -89.6, r4 = -88.6,
	&end

# 126 TRP PSI:  (126 TRP N)-(126 TRP CA)-(126 TRP C)-(127 VAL N) 105.7 154.1
 &rst     iat =  2042,  2044,  2064,  2066,
	  r1 = 104.7, r2 = 105.7, r3 = 154.1, r4 = 155.1,
	&end

# 129 TYR PHI:  (128 SER C)-(129 TYR N)-(129 TYR CA)-(129 TYR C) -82.1 -45.7
 &rst     iat =  2091,  2093,  2095,  2112,
	  r1 = -83.1, r2 = -82.1, r3 = -45.7, r4 = -44.7,
	&end

# 129 TYR PSI:  (129 TYR N)-(129 TYR CA)-(129 TYR C)-(130 TRP N) -47.1 -18.5
 &rst     iat =  2093,  2095,  2112,  2114,
	  r1 = -48.1, r2 = -47.1, r3 = -18.5, r4 = -17.5,
	&end

# 133 VAL PHI:  (132 PRO C)-(133 VAL N)-(133 VAL CA)-(133 VAL C) -78.5 -64.9
 &rst     iat =  2171,  2173,  2175,  2187,
	  r1 = -79.5, r2 = -78.5, r3 = -64.9, r4 = -63.9,
	&end

# 133 VAL PSI:  (133 VAL N)-(133 VAL CA)-(133 VAL C)-(134 ARG N) -49.7 -16.2
 &rst     iat =  2173,  2175,  2187,  2189,
	  r1 = -50.7, r2 = -49.7, r3 = -16.2, r4 = -15.2,
	&end

# 134 ARG PHI:  (133 VAL C)-(134 ARG N)-(134 ARG CA)-(134 ARG C) -90.1 -55.9
 &rst     iat =  2187,  2189,  2191,  2211,
	  r1 = -91.1, r2 = -90.1, r3 = -55.9, r4 = -54.9,
	&end

# 134 ARG PSI:  (134 ARG N)-(134 ARG CA)-(134 ARG C)-(135 GLN N) -42.8 -10.2
 &rst     iat =  2189,  2191,  2211,  2213,
	  r1 = -43.8, r2 = -42.8, r3 = -10.2, r4 =  -9.2,
	&end

# 138 SER PHI:  (137 VAL C)-(138 SER N)-(138 SER CA)-(138 SER C) -76.3 -53.4
 &rst     iat =  2260,  2262,  2264,  2271,
	  r1 = -77.3, r2 = -76.3, r3 = -53.4, r4 = -52.4,
	&end

# 138 SER PSI:  (138 SER N)-(138 SER CA)-(138 SER C)-(139 PHE N) -59.5 -23.3
 &rst     iat =  2262,  2264,  2271,  2273,
	  r1 = -60.5, r2 = -59.5, r3 = -23.3, r4 = -22.3,
	&end

# 139 PHE PHI:  (138 SER C)-(139 PHE N)-(139 PHE CA)-(139 PHE C) -101.2 -59.4
 &rst     iat =  2271,  2273,  2275,  2291,
	  r1 = -102.2, r2 = -101.2, r3 = -59.4, r4 = -58.4,
	&end

# 139 PHE PSI:  (139 PHE N)-(139 PHE CA)-(139 PHE C)-(140 LYS N) -41.1   2.4
 &rst     iat =  2273,  2275,  2291,  2293,
	  r1 = -42.1, r2 = -41.1, r3 =   2.4, r4 =   3.4,
	&end

# 141 ARG PHI:  (140 LYS C)-(141 ARG N)-(141 ARG CA)-(141 ARG C) -75.4 -42.1
 &rst     iat =  2313,  2315,  2317,  2337,
	  r1 = -76.4, r2 = -75.4, r3 = -42.1, r4 = -41.1,
	&end

# 141 ARG PSI:  (141 ARG N)-(141 ARG CA)-(141 ARG C)-(142 ASP N) -45.8 -35.1
 &rst     iat =  2315,  2317,  2337,  2339,
	  r1 = -46.8, r2 = -45.8, r3 = -35.1, r4 = -34.1,
	&end

# 142 ASP PHI:  (141 ARG C)-(142 ASP N)-(142 ASP CA)-(142 ASP C) -72.9 -56.6
 &rst     iat =  2337,  2339,  2341,  2349,
	  r1 = -73.9, r2 = -72.9, r3 = -56.6, r4 = -55.6,
	&end

# 142 ASP PSI:  (142 ASP N)-(142 ASP CA)-(142 ASP C)-(143 VAL N) -49.2 -32.5
 &rst     iat =  2339,  2341,  2349,  2351,
	  r1 = -50.2, r2 = -49.2, r3 = -32.5, r4 = -31.5,
	&end

# 143 VAL PHI:  (142 ASP C)-(143 VAL N)-(143 VAL CA)-(143 VAL C) -73.1 -61.9
 &rst     iat =  2349,  2351,  2353,  2365,
	  r1 = -74.1, r2 = -73.1, r3 = -61.9, r4 = -60.9,
	&end

# 143 VAL PSI:  (143 VAL N)-(143 VAL CA)-(143 VAL C)-(144 TYR N) -49.8 -37.8
 &rst     iat =  2351,  2353,  2365,  2367,
	  r1 = -50.8, r2 = -49.8, r3 = -37.8, r4 = -36.8,
	&end

# 144 TYR PHI:  (143 VAL C)-(144 TYR N)-(144 TYR CA)-(144 TYR C) -69.8 -56.1
 &rst     iat =  2365,  2367,  2369,  2386,
	  r1 = -70.8, r2 = -69.8, r3 = -56.1, r4 = -55.1,
	&end

# 144 TYR PSI:  (144 TYR N)-(144 TYR CA)-(144 TYR C)-(145 ARG N) -49.3 -33.0
 &rst     iat =  2367,  2369,  2386,  2388,
	  r1 = -50.3, r2 = -49.3, r3 = -33.0, r4 = -32.0,
	&end

# 145 ARG PHI:  (144 TYR C)-(145 ARG N)-(145 ARG CA)-(145 ARG C) -71.5 -60.8
 &rst     iat =  2386,  2388,  2390,  2410,
	  r1 = -72.5, r2 = -71.5, r3 = -60.8, r4 = -59.8,
	&end

# 145 ARG PSI:  (145 ARG N)-(145 ARG CA)-(145 ARG C)-(146 ARG N) -53.5 -35.6
 &rst     iat =  2388,  2390,  2410,  2412,
	  r1 = -54.5, r2 = -53.5, r3 = -35.6, r4 = -34.6,
	&end

# 146 ARG PHI:  (145 ARG C)-(146 ARG N)-(146 ARG CA)-(146 ARG C) -74.4 -61.6
 &rst     iat =  2410,  2412,  2414,  2434,
	  r1 = -75.4, r2 = -74.4, r3 = -61.6, r4 = -60.6,
	&end

# 146 ARG PSI:  (146 ARG N)-(146 ARG CA)-(146 ARG C)-(147 VAL N) -49.1 -32.6
 &rst     iat =  2412,  2414,  2434,  2436,
	  r1 = -50.1, r2 = -49.1, r3 = -32.6, r4 = -31.6,
	&end

# 147 VAL PHI:  (146 ARG C)-(147 VAL N)-(147 VAL CA)-(147 VAL C) -71.5 -57.4
 &rst     iat =  2434,  2436,  2438,  2450,
	  r1 = -72.5, r2 = -71.5, r3 = -57.4, r4 = -56.4,
	&end

# 147 VAL PSI:  (147 VAL N)-(147 VAL CA)-(147 VAL C)-(148 MET N) -43.7 -25.3
 &rst     iat =  2436,  2438,  2450,  2452,
	  r1 = -44.7, r2 = -43.7, r3 = -25.3, r4 = -24.3,
	&end

# 149 LYS PHI:  (148 MET C)-(149 LYS N)-(149 LYS CA)-(149 LYS C) -69.9 -56.6
 &rst     iat =  2467,  2469,  2471,  2489,
	  r1 = -70.9, r2 = -69.9, r3 = -56.6, r4 = -55.6,
	&end

# 149 LYS PSI:  (149 LYS N)-(149 LYS CA)-(149 LYS C)-(150 GLU N) -53.2 -34.2
 &rst     iat =  2469,  2471,  2489,  2491,
	  r1 = -54.2, r2 = -53.2, r3 = -34.2, r4 = -33.2,
	&end

# 150 GLU PHI:  (149 LYS C)-(150 GLU N)-(150 GLU CA)-(150 GLU C) -80.3 -58.2
 &rst     iat =  2489,  2491,  2493,  2504,
	  r1 = -81.3, r2 = -80.3, r3 = -58.2, r4 = -57.2,
	&end

# 150 GLU PSI:  (150 GLU N)-(150 GLU CA)-(150 GLU C)-(151 PHE N) -45.4 -28.0
 &rst     iat =  2491,  2493,  2504,  2506,
	  r1 = -46.4, r2 = -45.4, r3 = -28.0, r4 = -27.0,
	&end

# 151 PHE PHI:  (150 GLU C)-(151 PHE N)-(151 PHE CA)-(151 PHE C) -110.7 -65.3
 &rst     iat =  2504,  2506,  2508,  2524,
	  r1 = -111.7, r2 = -110.7, r3 = -65.3, r4 = -64.3,
	&end

# 151 PHE PSI:  (151 PHE N)-(151 PHE CA)-(151 PHE C)-(152 ALA N) -38.7   5.1
 &rst     iat =  2506,  2508,  2524,  2526,
	  r1 = -39.7, r2 = -38.7, r3 =   5.1, r4 =   6.1,
	&end

# 152 ALA PHI:  (151 PHE C)-(152 ALA N)-(152 ALA CA)-(152 ALA C) -69.1 -51.7
 &rst     iat =  2524,  2526,  2528,  2534,
	  r1 = -70.1, r2 = -69.1, r3 = -51.7, r4 = -50.7,
	&end

# 152 ALA PSI:  (152 ALA N)-(152 ALA CA)-(152 ALA C)-(153 SER N) -44.9 -23.6
 &rst     iat =  2526,  2528,  2534,  2536,
	  r1 = -45.9, r2 = -44.9, r3 = -23.6, r4 = -22.6,
	&end

# 153 SER PHI:  (152 ALA C)-(153 SER N)-(153 SER CA)-(153 SER C) -68.2 -59.3
 &rst     iat =  2534,  2536,  2538,  2545,
	  r1 = -69.2, r2 = -68.2, r3 = -59.3, r4 = -58.3,
	&end

# 153 SER PSI:  (153 SER N)-(153 SER CA)-(153 SER C)-(154 VAL N) -43.0 -32.4
 &rst     iat =  2536,  2538,  2545,  2547,
	  r1 = -44.0, r2 = -43.0, r3 = -32.4, r4 = -31.4,
	&end

# 154 VAL PHI:  (153 SER C)-(154 VAL N)-(154 VAL CA)-(154 VAL C) -75.6 -61.7
 &rst     iat =  2545,  2547,  2549,  2561,
	  r1 = -76.6, r2 = -75.6, r3 = -61.7, r4 = -60.7,
	&end

# 154 VAL PSI:  (154 VAL N)-(154 VAL CA)-(154 VAL C)-(155 VAL N) -49.0 -36.0
 &rst     iat =  2547,  2549,  2561,  2563,
	  r1 = -50.0, r2 = -49.0, r3 = -36.0, r4 = -35.0,
	&end

# 155 VAL PHI:  (154 VAL C)-(155 VAL N)-(155 VAL CA)-(155 VAL C) -71.4 -59.3
 &rst     iat =  2561,  2563,  2565,  2577,
	  r1 = -72.4, r2 = -71.4, r3 = -59.3, r4 = -58.3,
	&end

# 155 VAL PSI:  (155 VAL N)-(155 VAL CA)-(155 VAL C)-(156 MET N) -49.2 -35.1
 &rst     iat =  2563,  2565,  2577,  2579,
	  r1 = -50.2, r2 = -49.2, r3 = -35.1, r4 = -34.1,
	&end

# 156 MET PHI:  (155 VAL C)-(156 MET N)-(156 MET CA)-(156 MET C) -74.6 -58.0
 &rst     iat =  2577,  2579,  2581,  2594,
	  r1 = -75.6, r2 = -74.6, r3 = -58.0, r4 = -57.0,
	&end

# 156 MET PSI:  (156 MET N)-(156 MET CA)-(156 MET C)-(157 SER N) -60.4 -28.1
 &rst     iat =  2579,  2581,  2594,  2596,
	  r1 = -61.4, r2 = -60.4, r3 = -28.1, r4 = -27.1,
	&end

# 159 GLN PHI:  (158 LEU C)-(159 GLN N)-(159 GLN CA)-(159 GLN C) -111.9 -58.8
 &rst     iat =  2624,  2626,  2628,  2641,
	  r1 = -112.9, r2 = -111.9, r3 = -58.8, r4 = -57.8,
	&end

# 159 GLN PSI:  (159 GLN N)-(159 GLN CA)-(159 GLN C)-(160 GLU N) -43.7  14.4
 &rst     iat =  2626,  2628,  2641,  2643,
	  r1 = -44.7, r2 = -43.7, r3 =  14.4, r4 =  15.4,
	&end

#
#    0 AMB  20-2:4       51 TYR  HD          4.50    (#      4:20  Single Ambig)
 &rst
  ixpk= 4, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=1,
 igr1= 767, 723,
 igr2= 773, 782,
 &end
#
#   51 TYR  HE           51 TYR  HD          4.50    (#      7:20  Unique         2.46, 3.69 A)
 &rst
  ixpk= 7, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 775, 780,
 igr2= 773, 782,
 &end
#
#    7 TYR  HE            7 TYR  HD          3.50    (#     10:20  Unique         2.46, 3.69 A)
 &rst
  ixpk= 10, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=  93,  98,
 igr2=  91, 100,
 &end
#
#    7 TYR  HB-           7 TYR  HD          5.50    (#     13:20  Unique         2.31, 3.05 A)
 &rst
  ixpk= 13, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  87,  88,
 igr2=  91, 100,
 &end
#
#    7 TYR  HB+           7 TYR  HD          5.50    (#     14:20  Unique         2.31, 3.05 A)
 &rst
  ixpk= 14, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  87,  88,
 igr2=  91, 100,
 &end
#
#    0 AMB  20-2:15       7 TYR  HD          5.50    (#     15:20  Single Ambig)
 &rst
  ixpk= 15, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.07, r4= 8.82,
 igr1=1530,1531,1532,1527,1528,
 igr2=  91, 100,
 &end
#
#    0 AMB  20-2:16       7 TYR  HD          5.50    (#     16:20  Single Ambig)
 &rst
  ixpk= 16, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1547,1548,1251,1252,
 igr2=  91, 100,
 &end
#
#  127 VAL  MGY         131 TYR  HD          4.50    (#     18:20  Unique         1.98, 5.26 A)
 &rst
  ixpk= 18, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2147,2156,
 &end
#
#  127 VAL  MGX         131 TYR  HD          4.50    (#     19:20  Unique         1.98, 5.26 A)
 &rst
  ixpk= 19, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2147,2156,
 &end
#
#  131 TYR  HB+         131 TYR  HD          4.50    (#     20:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 20, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2143,2144,
 igr2=2147,2156,
 &end
#
#  131 TYR  HA          131 TYR  HD          5.50    (#     21:20  Unique         2.06, 3.43 A)
 &rst
  ixpk= 21, nxpk= 20, iat=2141,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2147,2156,
 &end
#
#  127 VAL  HB          131 TYR  HD          5.50    (#     22:20  Unique         1.96, 3.77 A)
 &rst
  ixpk= 22, nxpk= 20, iat=2071,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2147,2156,
 &end
#
#    0 AMB  20-2:27       0 AMB  20-1:27     4.50    (#     27:20  Double Ambig)
 &rst
  ixpk= 27, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.18, r4= 8.93,
 igr1= 442, 443, 555, 556, 871, 872,
 igr2= 446, 454, 559, 567, 852, 860,
 &end
#
#    0 AMB  20-2:28       0 AMB  20-1:28     5.50    (#     28:20  Double Ambig)
 &rst
  ixpk= 28, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 796, 797,1980,1981,
 igr2= 852, 860, 446, 454,
 &end
#
#   28 PHE  HB+          28 PHE  HD          5.50    (#     29:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 29, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 442, 443,
 igr2= 446, 454,
 &end
#
#   28 PHE  HE           28 PHE  HD          2.80    (#     30:20  Unique         2.46, 3.69 A)
 &rst
  ixpk= 30, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 448, 452,
 igr2= 446, 454,
 &end
#
#    0 AMB  20-2:31      28 PHE  HD          5.50    (#     31:20  Single Ambig)
 &rst
  ixpk= 31, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 438,1941,
 igr2= 446, 454,
 &end
#
#    0 AMB  20-2:32     144 TYR  HD          5.50    (#     32:20  Single Ambig)
 &rst
  ixpk= 32, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=2358,2359,2360,2362,2363,2364,2167,2168,
 igr2=2376,2385,
 &end
#
#  144 TYR  HA          144 TYR  HD          5.50    (#     33:20  Unique         1.95, 3.29 A)
 &rst
  ixpk= 33, nxpk= 20, iat=2370,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2376,2385,
 &end
#
#   27 ARG  HB+         121 PHE  HE          5.50    (#     38:20  Unique         2.06, 4.33 A)
 &rst
  ixpk= 38, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 418, 419,
 igr2=1966,1970,
 &end
#
#    0 AMB  20-2:39     121 PHE  HE          5.50    (#     39:20  Single Ambig)
 &rst
  ixpk= 39, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1867,1868, 592, 593,
 igr2=1966,1970,
 &end
#
#   84 VAL  MGX          86 TRP  HD1         5.50    (#     41:20  Unique         4.90, 6.66 A)
 &rst
  ixpk= 41, nxpk= 20, iat=  -1,1412, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   86 TRP  HB-          86 TRP  HD1         4.50    (#     42:20  Unique         2.73, 3.30 A)
 &rst
  ixpk= 42, nxpk= 20, iat=  -1,1412, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1408,1409,
 &end
#
#   86 TRP  HB+          86 TRP  HD1         4.50    (#     43:20  Unique         2.73, 3.30 A)
 &rst
  ixpk= 43, nxpk= 20, iat=  -1,1412, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1408,1409,
 &end
#
#   85 ARG  HA           86 TRP  HD1         5.50    (#     44:20  Unique         3.59, 3.68 A)
 &rst
  ixpk= 44, nxpk= 20, iat=1382,1412, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:45      86 TRP  HD1         5.50    (#     45:20  Single Ambig)
 &rst
  ixpk= 45, nxpk= 20, iat=  -1,1412, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1406,1323,
 &end
#
#   86 TRP  HN           86 TRP  HD1         4.50    (#     46:20  Unique         2.13, 2.19 A)
 &rst
  ixpk= 46, nxpk= 20, iat=1404,1412, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   86 TRP  HE1          86 TRP  HD1         3.50    (#     47:20  Unique         2.57, 2.57 A)
 &rst
  ixpk= 47, nxpk= 20, iat=1414,1412, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  130 TRP  HE1         130 TRP  HD1         3.50    (#     48:20  Unique         2.57, 2.57 A)
 &rst
  ixpk= 48, nxpk= 20, iat=2125,2123, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  126 TRP  HE1         126 TRP  HD1         4.50    (#     51:20  Unique         2.57, 2.57 A)
 &rst
  ixpk= 51, nxpk= 20, iat=2053,2051, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  126 TRP  HB+         126 TRP  HD1         3.50    (#     52:20  Unique         3.25, 3.60 A)
 &rst
  ixpk= 52, nxpk= 20, iat=  -1,2051, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2047,2048,
 &end
#
#  126 TRP  HN          126 TRP  HD1         5.50    (#     53:20  Unique         2.87, 3.32 A)
 &rst
  ixpk= 53, nxpk= 20, iat=2043,2051, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   74 TRP  HN           74 TRP  HD1         4.50    (#     54:20  Unique         1.92, 2.10 A)
 &rst
  ixpk= 54, nxpk= 20, iat=1156,1164, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   74 TRP  HE1          74 TRP  HD1         3.50    (#     55:20  Unique         2.57, 2.57 A)
 &rst
  ixpk= 55, nxpk= 20, iat=1166,1164, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   73 ASN  HA           74 TRP  HD1         5.50    (#     56:20  Unique         2.86, 3.36 A)
 &rst
  ixpk= 56, nxpk= 20, iat=1144,1164, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   74 TRP  HB+          74 TRP  HD1         5.50    (#     57:20  Unique         2.56, 3.34 A)
 &rst
  ixpk= 57, nxpk= 20, iat=  -1,1164, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1160,1161,
 &end
#
#   33 TRP  HE1          33 TRP  HD1         4.50    (#     58:20  Unique         2.57, 2.57 A)
 &rst
  ixpk= 58, nxpk= 20, iat= 520, 518, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   33 TRP  HN           33 TRP  HD1         4.50    (#     59:20  Unique         1.91, 2.54 A)
 &rst
  ixpk= 59, nxpk= 20, iat= 510, 518, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:60      33 TRP  HD1         5.50    (#     60:20  Single Ambig)
 &rst
  ixpk= 60, nxpk= 20, iat=  -1, 518, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 514, 515, 392,
 &end
#
#  127 VAL  MGY          24 TRP  HD1         5.50    (#     61:20  Unique         1.98, 4.29 A)
 &rst
  ixpk= 61, nxpk= 20, iat=  -1, 364, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#   24 TRP  HE1          24 TRP  HD1         5.50    (#     63:20  Unique         2.57, 2.57 A)
 &rst
  ixpk= 63, nxpk= 20, iat= 366, 364, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:64       0 AMB  20-1:64     5.50    (#     64:20  Double Ambig)
 &rst
  ixpk= 64, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1= 629, 630, 631,2180,2181,2182,2184,2185,2186,
 igr2=1171,2130,
 &end
#
#    0 AMB  20-2:65     130 TRP  HH2         4.50    (#     65:20  Single Ambig)
 &rst
  ixpk= 65, nxpk= 20, iat=  -1,2130, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2477,2478,2531,2532,2533,
 &end
#
#    0 AMB  20-2:66       0 AMB  20-1:66     3.50    (#     66:20  Double Ambig)
 &rst
  ixpk= 66, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1169,2128,
 igr2=1171,2130,
 &end
#
#  130 TRP  HD1         129 TYR  HE          4.50    (#     67:20  Unique         2.00, 4.84 A)
 &rst
  ixpk= 67, nxpk= 20, iat=2123,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2104,2109,
 &end
#
#   99 TRP  HB-          99 TRP  HD1         5.50    (#     71:20  Unique         2.55, 3.13 A)
 &rst
  ixpk= 71, nxpk= 20, iat=  -1,1629, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1625,1626,
 &end
#
#   33 TRP  HZ2          33 TRP  HH2         4.50    (#     73:20  Unique         2.46, 2.46 A)
 &rst
  ixpk= 73, nxpk= 20, iat= 523, 525, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   86 TRP  HZ3          86 TRP  HE3         4.50    (#     76:20  Unique         2.46, 2.46 A)
 &rst
  ixpk= 76, nxpk= 20, iat=1421,1423, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   86 TRP  HE3          86 TRP  HZ3         4.50    (#     77:20  Unique         2.46, 2.46 A)
 &rst
  ixpk= 77, nxpk= 20, iat=1423,1421, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:80     139 PHE  HD          4.50    (#     80:20  Single Ambig)
 &rst
  ixpk= 80, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=2282,2290,
 &end
#
#  139 PHE  HB-         139 PHE  HD          4.50    (#     81:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 81, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2278,2279,
 igr2=2282,2290,
 &end
#
#  139 PHE  HN          139 PHE  HD          4.50    (#     82:20  Unique         2.32, 3.61 A)
 &rst
  ixpk= 82, nxpk= 20, iat=2274,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2282,2290,
 &end
#
#   91 VAL  MGX          86 TRP  HE3         5.50    (#     84:20  Unique         2.69, 4.30 A)
 &rst
  ixpk= 84, nxpk= 20, iat=  -1,1423, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   86 TRP  HB-          86 TRP  HE3         5.50    (#     85:20  Unique         2.47, 3.26 A)
 &rst
  ixpk= 85, nxpk= 20, iat=  -1,1423, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1408,1409,
 &end
#
#   86 TRP  HB+          86 TRP  HE3         5.50    (#     86:20  Unique         2.47, 3.26 A)
 &rst
  ixpk= 86, nxpk= 20, iat=  -1,1423, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1408,1409,
 &end
#
#   86 TRP  HA           86 TRP  HE3         5.50    (#     87:20  Unique         3.40, 3.46 A)
 &rst
  ixpk= 87, nxpk= 20, iat=1406,1423, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   31 HIS  HA           31 HIS  HD2         5.50    (#     90:20  Unique         2.19, 3.17 A)
 &rst
  ixpk= 90, nxpk= 20, iat= 484, 495, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   31 HIS  HN           31 HIS  HD2         5.50    (#     92:20  Unique         2.08, 3.67 A)
 &rst
  ixpk= 92, nxpk= 20, iat= 482, 495, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  143 VAL  MGY          77 TYR  HE          4.50    (#     94:20  Unique         3.49, 7.47 A)
 &rst
  ixpk= 94, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2358,2359,2360,2362,2363,2364,
 igr2=1233,1238,
 &end
#
#    0 AMB  20-2:95      77 TYR  HE          4.50    (#     95:20  Single Ambig)
 &rst
  ixpk= 95, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=2301,2302,1275,1276,1277,1279,1280,1281,
 igr2=1233,1238,
 &end
#
#   24 TRP  HE1           0 AMB  20-1:97     5.50    (#     97:20  Single Ambig)
 &rst
  ixpk= 97, nxpk= 20, iat= 366,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 369,2149,2154,
 &end
#
#    0 AMB  20-2:98       0 AMB  20-1:98     5.50    (#     98:20  Double Ambig)
 &rst
  ixpk= 98, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1203,1204,1251,1252,1564,1565,
 igr2=  93,  98,1231,1240,
 &end
#
#    0 AMB  20-2:99       0 AMB  20-1:99     5.50    (#     99:20  Double Ambig)
 &rst
  ixpk= 99, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1203,1204,2304,2305,
 igr2=  93,  98,1231,1240,
 &end
#
#    0 AMB  20-2:100      0 AMB  20-1:100    5.50    (#    100:20  Double Ambig)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1223,1517,
 igr2=1231,1240,  93,  98,
 &end
#
#  135 GLN  HN            0 AMB  20-1:101    5.50    (#    101:20  Single Ambig)
 &rst
  ixpk= 101, nxpk= 20, iat=2214,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=2149,2154, 369,
 &end
#
#    0 AMB  20-2:102     51 TYR  HE          4.50    (#    102:20  Single Ambig)
 &rst
  ixpk= 102, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1=1011,1012,1013,1015,1016,1017,1011,1012,1013,1015,
      1016,1017, 954, 955,
 igr2= 775, 780,
 &end
#
#    0 AMB  20-2:103     51 TYR  HE          5.50    (#    103:20  Single Ambig)
 &rst
  ixpk= 103, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 752, 753, 954, 955, 189, 190,
 igr2= 775, 780,
 &end
#
#   47 GLU  HG+          51 TYR  HE          5.50    (#    104:20  Unique         2.02, 3.84 A)
 &rst
  ixpk= 104, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 713, 714,
 igr2= 775, 780,
 &end
#
#   62 ARG  HA           51 TYR  HE          5.50    (#    105:20  Unique         2.60, 4.71 A)
 &rst
  ixpk= 105, nxpk= 20, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 775, 780,
 &end
#
#   51 TYR  HD           51 TYR  HE          4.50    (#    106:20  Unique         2.46, 3.69 A)
 &rst
  ixpk= 106, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 773, 782,
 igr2= 775, 780,
 &end
#
#  130 TRP  HE1         130 TRP  HZ2         4.50    (#    107:20  Unique         2.82, 2.82 A)
 &rst
  ixpk= 107, nxpk= 20, iat=2125,2128, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  126 TRP  HE1         126 TRP  HZ2         5.50    (#    108:20  Unique         2.82, 2.82 A)
 &rst
  ixpk= 108, nxpk= 20, iat=2053,2056, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  130 TRP  HH2         130 TRP  HZ2         3.50    (#    109:20  Unique         2.46, 2.46 A)
 &rst
  ixpk= 109, nxpk= 20, iat=2130,2128, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:110      0 AMB  20-1:110    5.50    (#    110:20  Double Ambig)
 &rst
  ixpk= 110, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2472, 896,
 igr2=2128,2056,
 &end
#
#    0 AMB  20-2:111    130 TRP  HZ2         4.50    (#    111:20  Single Ambig)
 &rst
  ixpk= 111, nxpk= 20, iat=  -1,2128, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2531,2532,2533,2396,2397,2477,2478,
 &end
#
#    0 AMB  20-2:112      0 AMB  20-1:112    4.50    (#    112:20  Double Ambig)
 &rst
  ixpk= 112, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=1729,1730,1731,1733,1734,1735,2180,2181,2182,2184,
      2185,2186,
 igr2=2056,2128,
 &end
#
#   86 TRP  HE1          86 TRP  HZ2         4.50    (#    113:20  Unique         2.82, 2.82 A)
 &rst
  ixpk= 113, nxpk= 20, iat=1414,1417, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   33 TRP  HE1          33 TRP  HZ2         5.50    (#    120:20  Unique         2.82, 2.82 A)
 &rst
  ixpk= 120, nxpk= 20, iat= 520, 523, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:122      0 AMB  20-1:122    5.50    (#    122:20  Double Ambig)
 &rst
  ixpk= 122, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2058,2104,2109,
 igr2=2056,2128,
 &end
#
#  103 GLN  HA          126 TRP  HH2         5.50    (#    124:20  Unique         7.06, 8.65 A)
 &rst
  ixpk= 124, nxpk= 20, iat=1705,2058, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  130 TRP  HB+         130 TRP  HD1         5.50    (#    125:20  Unique         2.69, 3.42 A)
 &rst
  ixpk= 125, nxpk= 20, iat=  -1,2123, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2119,2120,
 &end
#
#  130 TRP  HN          130 TRP  HD1         5.50    (#    126:20  Unique         2.20, 3.53 A)
 &rst
  ixpk= 126, nxpk= 20, iat=2115,2123, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HE1          99 TRP  HD1         5.50    (#    128:20  Unique         2.57, 2.57 A)
 &rst
  ixpk= 128, nxpk= 20, iat=1631,1629, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   33 TRP  HH2          33 TRP  HZ2         4.50    (#    129:20  Unique         2.46, 2.46 A)
 &rst
  ixpk= 129, nxpk= 20, iat= 525, 523, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:130     35 PHE  HD          5.50    (#    130:20  Single Ambig)
 &rst
  ixpk= 130, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2372,2373, 237, 238,
 igr2= 559, 567,
 &end
#
#   28 PHE  HD           28 PHE  HE          4.50    (#    131:20  Unique         2.46, 3.69 A)
 &rst
  ixpk= 131, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 446, 454,
 igr2= 448, 452,
 &end
#
#   47 GLU  HB+          51 TYR  HD          5.50    (#    132:20  Unique         4.35, 6.07 A)
 &rst
  ixpk= 132, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 710, 711,
 igr2= 773, 782,
 &end
#
#   51 TYR  HB+          51 TYR  HD          5.50    (#    133:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 133, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 769, 770,
 igr2= 773, 782,
 &end
#
#   55 PHE  HB+          55 PHE  HD          5.50    (#    134:20  Unique         2.31, 3.03 A)
 &rst
  ixpk= 134, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 848, 849,
 igr2= 852, 860,
 &end
#
#    0 AMB  20-2:135     51 TYR  HD          5.50    (#    135:20  Single Ambig)
 &rst
  ixpk= 135, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 954, 955,1011,1012,1013,1015,1016,1017,
 igr2= 773, 782,
 &end
#
#  131 TYR  HD            0 AMB  20-1:137    3.50    (#    137:20  Single Ambig)
 &rst
  ixpk= 137, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2147,2156,
 igr2=2149,2154, 369,
 &end
#
#  127 VAL  MGY           0 AMB  20-1:138    5.50    (#    138:20  Single Ambig)
 &rst
  ixpk= 138, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2= 369,2149,2154,
 &end
#
#  139 PHE  HB+         139 PHE  HD          5.50    (#    139:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 139, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2278,2279,
 igr2=2282,2290,
 &end
#
#  126 TRP  HE1         126 TRP  HH2         5.50    (#    143:20  Unique         4.96, 4.97 A)
 &rst
  ixpk= 143, nxpk= 20, iat=2053,2058, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  144 TYR  HN          144 TYR  HD          5.50    (#    144:20  Unique         2.44, 3.94 A)
 &rst
  ixpk= 144, nxpk= 20, iat=2368,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2376,2385,
 &end
#
#  144 TYR  HE          144 TYR  HD          5.50    (#    145:20  Unique         2.46, 3.69 A)
 &rst
  ixpk= 145, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2378,2383,
 igr2=2376,2385,
 &end
#
#  139 PHE  HD           77 TYR  HE          4.50    (#    147:20  Unique         4.42, 9.16 A)
 &rst
  ixpk= 147, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2282,2290,
 igr2=1233,1238,
 &end
#
#   22 VAL  MGY         129 TYR  HD          4.50    (#    148:20  Unique         2.44, 6.68 A)
 &rst
  ixpk= 148, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2102,2111,
 &end
#
#  129 TYR  HN          129 TYR  HD          5.50    (#    149:20  Unique         2.05, 3.45 A)
 &rst
  ixpk= 149, nxpk= 20, iat=2094,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2102,2111,
 &end
#
#    7 TYR  HD            7 TYR  HE          3.50    (#    150:20  Unique         2.46, 3.69 A)
 &rst
  ixpk= 150, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=  91, 100,
 igr2=  93,  98,
 &end
#
#    0 AMB  20-2:152      7 TYR  HD          5.50    (#    152:20  Single Ambig)
 &rst
  ixpk= 152, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  85,  66,
 igr2=  91, 100,
 &end
#
#    0 AMB  20-2:153      0 AMB  20-1:153    5.50    (#    153:20  Double Ambig)
 &rst
  ixpk= 153, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.80, r4=10.55,
 igr1=1203,1204,1251,1252,2304,2305,1251,1252,
 igr2=  93,  98,1231,1240,
 &end
#
#    0 AMB  20-2:154      7 TYR  HE          4.50    (#    154:20  Single Ambig)
 &rst
  ixpk= 154, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1527,1528,1530,1531,1532,
 igr2=  93,  98,
 &end
#
#   99 TRP  HB+          99 TRP  HE3         5.50    (#    156:20  Unique         2.59, 3.51 A)
 &rst
  ixpk= 156, nxpk= 20, iat=  -1,1640, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1625,1626,
 &end
#
#  108 ASP  HB+         126 TRP  HD1         4.50    (#    159:20  Unique         6.36, 7.27 A)
 &rst
  ixpk= 159, nxpk= 20, iat=  -1,2051, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1777,1778,
 &end
#
#    0 AMB  20-2:160    126 TRP  HZ2         5.50    (#    160:20  Single Ambig)
 &rst
  ixpk= 160, nxpk= 20, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1777,1778, 248, 249,
 &end
#
#  125 ARG  HD-          33 TRP  HH2         5.50    (#    162:20  Unique         2.03, 3.48 A)
 &rst
  ixpk= 162, nxpk= 20, iat=  -1, 525, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2029,2030,
 &end
#
#    0 AMB  20-2:163    130 TRP  HH2         5.50    (#    163:20  Single Ambig)
 &rst
  ixpk= 163, nxpk= 20, iat=  -1,2130, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2472,2085,
 &end
#
#   46 ALA  MB           74 TRP  HZ2         5.50    (#    165:20  Unique         3.38, 4.87 A)
 &rst
  ixpk= 165, nxpk= 20, iat=  -1,1169, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 700, 701, 702,
 &end
#
#    0 AMB  20-2:166     74 TRP  HZ2         5.50    (#    166:20  Single Ambig)
 &rst
  ixpk= 166, nxpk= 20, iat=  -1,1169, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 629, 630, 631,1110,1111,1112,
 &end
#
#   74 TRP  HH2          74 TRP  HZ2         3.50    (#    169:20  Unique         2.46, 2.46 A)
 &rst
  ixpk= 169, nxpk= 20, iat=1171,1169, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   74 TRP  HE1          74 TRP  HZ2         4.50    (#    170:20  Unique         2.82, 2.82 A)
 &rst
  ixpk= 170, nxpk= 20, iat=1166,1169, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  125 ARG  HG-          33 TRP  HH2         5.50    (#    171:20  Unique         2.77, 5.00 A)
 &rst
  ixpk= 171, nxpk= 20, iat=  -1, 525, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2026,2027,
 &end
#
#  130 TRP  HE1         129 TYR  HE          5.50    (#    173:20  Unique         2.60, 5.98 A)
 &rst
  ixpk= 173, nxpk= 20, iat=2125,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2104,2109,
 &end
#
#   55 PHE  HE           55 PHE  HD          3.50    (#    176:20  Unique         2.46, 3.69 A)
 &rst
  ixpk= 176, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 854, 858,
 igr2= 852, 860,
 &end
#
#  chirality for residue 1 atoms:  CA CG HB2 HB3
 &rst iat=5,10,8,9, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 150., rk3=150.,  &end
#
#  chirality for residue 1 atoms:  CB SD HG2 HG3
 &rst iat=7,13,11,12, &end
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,18,6,7, &end
#
#  chirality for residue 2 atoms:  CA CG2 CG1 HB
 &rst iat=22,26,30,25, &end
#
#  chirality for residue 2 atoms:  CB CD1 HG12 HG13
 &rst iat=24,33,31,32, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,37,23,24, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=41,46,44,45, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=39,49,42,43, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=53,58,56,57, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=51,61,54,55, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=65,70,68,69, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=63,73,66,67, &end
#
#  chirality for residue 6 atoms:  N C HA2 HA3
 &rst iat=75,80,78,79, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=84,89,87,88, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=82,101,85,86, &end
#
#  chirality for residue 8 atoms:  CA CG HB2 HB3
 &rst iat=105,110,108,109, &end
#
#  chirality for residue 8 atoms:  CB CD HG2 HG3
 &rst iat=107,113,111,112, &end
#
#  chirality for residue 8 atoms:  CG NE HD2 HD3
 &rst iat=110,116,114,115, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=103,125,106,107, &end
#
#  chirality for residue 9 atoms:  CA CG HB2 HB3
 &rst iat=137,131,135,136, &end
#
#  chirality for residue 9 atoms:  CB CD HG2 HG3
 &rst iat=134,128,132,133, &end
#
#  chirality for residue 9 atoms:  CG N HD2 HD3
 &rst iat=131,127,129,130, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=127,139,138,134, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=143,148,146,147, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=141,153,144,145, &end
#
#  chirality for residue 11 atoms:  CA CG1 CG2 HB
 &rst iat=157,161,165,160, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=155,169,158,159, &end
#
#  chirality for residue 12 atoms:  N C HA2 HA3
 &rst iat=171,176,174,175, &end
#
#  chirality for residue 13 atoms:  CA CG2 CG1 HB
 &rst iat=180,184,188,183, &end
#
#  chirality for residue 13 atoms:  CB CD1 HG12 HG13
 &rst iat=182,191,189,190, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=178,195,181,182, &end
#
#  chirality for residue 14 atoms:  CA CG1 CG2 HB
 &rst iat=199,203,207,202, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=197,211,200,201, &end
#
#  chirality for residue 15 atoms:  CA CG2 CG1 HB
 &rst iat=215,219,223,218, &end
#
#  chirality for residue 15 atoms:  CB CD1 HG12 HG13
 &rst iat=217,226,224,225, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=213,230,216,217, &end
#
#  chirality for residue 16 atoms:  CA SG HB2 HB3
 &rst iat=234,239,237,238, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=232,241,235,236, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=245,250,248,249, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=243,255,246,247, &end
#
#  chirality for residue 18 atoms:  CA CG HB2 HB3
 &rst iat=259,264,262,263, &end
#
#  chirality for residue 18 atoms:  CB CD HG2 HG3
 &rst iat=261,267,265,266, &end
#
#  chirality for residue 18 atoms:  CG NE HD2 HD3
 &rst iat=264,270,268,269, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=257,279,260,261, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=283,288,286,287, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=285,291,289,290, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=281,296,284,285, &end
#
#  chirality for residue 20 atoms:  N C HA2 HA3
 &rst iat=298,303,301,302, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=307,312,310,311, &end
#
#  chirality for residue 21 atoms:  CB CD HG2 HG3
 &rst iat=309,315,313,314, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=305,320,308,309, &end
#
#  chirality for residue 22 atoms:  CA CG1 CG2 HB
 &rst iat=324,328,332,327, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=322,336,325,326, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=340,345,343,344, &end
#
#  chirality for residue 23 atoms:  CB SD HG2 HG3
 &rst iat=342,348,346,347, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=338,353,341,342, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=357,362,360,361, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=355,377,358,359, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=379,387,382,383, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=391,396,394,395, &end
#
#  chirality for residue 26 atoms:  CB CD HG2 HG3
 &rst iat=393,399,397,398, &end
#
#  chirality for residue 26 atoms:  CG NE HD2 HD3
 &rst iat=396,402,400,401, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=389,411,392,393, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=415,420,418,419, &end
#
#  chirality for residue 27 atoms:  CB CD HG2 HG3
 &rst iat=417,423,421,422, &end
#
#  chirality for residue 27 atoms:  CG NE HD2 HD3
 &rst iat=420,426,424,425, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=413,435,416,417, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=439,444,442,443, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=437,455,440,441, &end
#
#  chirality for residue 29 atoms:  N C HA2 HA3
 &rst iat=457,462,460,461, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=466,471,469,470, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=468,474,472,473, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=464,479,467,468, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=483,488,486,487, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=481,496,484,485, &end
#
#  chirality for residue 32 atoms:  CA OG HB2 HB3
 &rst iat=500,505,503,504, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=498,507,501,502, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=511,516,514,515, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=509,531,512,513, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=535,540,538,539, &end
#
#  chirality for residue 34 atoms:  CB CD HG2 HG3
 &rst iat=537,543,541,542, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=533,548,536,537, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=552,557,555,556, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=550,568,553,554, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=580,574,578,579, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=577,571,575,576, &end
#
#  chirality for residue 36 atoms:  CG N HD2 HD3
 &rst iat=574,570,572,573, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=570,582,581,577, &end
#
#  chirality for residue 37 atoms:  CA CG HB2 HB3
 &rst iat=586,591,589,590, &end
#
#  chirality for residue 37 atoms:  CB CD HG2 HG3
 &rst iat=588,594,592,593, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=584,599,587,588, &end
#
#  chirality for residue 38 atoms:  N C HA2 HA3
 &rst iat=601,606,604,605, &end
#
#  chirality for residue 39 atoms:  N C HA2 HA3
 &rst iat=608,613,611,612, &end
#
#  chirality for residue 40 atoms:  CA CG2 CG1 HB
 &rst iat=617,621,625,620, &end
#
#  chirality for residue 40 atoms:  CB CD1 HG12 HG13
 &rst iat=619,628,626,627, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=615,632,618,619, &end
#
#  chirality for residue 41 atoms:  CA CG HB2 HB3
 &rst iat=636,641,639,640, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=634,646,637,638, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=658,652,656,657, &end
#
#  chirality for residue 42 atoms:  CB CD HG2 HG3
 &rst iat=655,649,653,654, &end
#
#  chirality for residue 42 atoms:  CG N HD2 HD3
 &rst iat=652,648,650,651, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=648,660,659,655, &end
#
#  chirality for residue 43 atoms:  N C HA2 HA3
 &rst iat=662,667,665,666, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=671,676,674,675, &end
#
#  chirality for residue 44 atoms:  CB CD HG2 HG3
 &rst iat=673,679,677,678, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=669,682,672,673, &end
#
#  chirality for residue 45 atoms:  CA OG HB2 HB3
 &rst iat=686,691,689,690, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=684,693,687,688, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=695,703,698,699, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=707,712,710,711, &end
#
#  chirality for residue 47 atoms:  CB CD HG2 HG3
 &rst iat=709,715,713,714, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=705,718,708,709, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=722,727,725,726, &end
#
#  chirality for residue 48 atoms:  CB CD HG2 HG3
 &rst iat=724,730,728,729, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=720,735,723,724, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=737,745,740,741, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=749,754,752,753, &end
#
#  chirality for residue 50 atoms:  CB SD HG2 HG3
 &rst iat=751,757,755,756, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=747,762,750,751, &end
#
#  chirality for residue 51 atoms:  CA CG HB2 HB3
 &rst iat=766,771,769,770, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=764,783,767,768, &end
#
#  chirality for residue 52 atoms:  CA CG HB2 HB3
 &rst iat=787,792,790,791, &end
#
#  chirality for residue 52 atoms:  CB CD HG2 HG3
 &rst iat=789,795,793,794, &end
#
#  chirality for residue 52 atoms:  CG NE HD2 HD3
 &rst iat=792,798,796,797, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=785,807,788,789, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=811,816,814,815, &end
#
#  chirality for residue 53 atoms:  CB CD HG2 HG3
 &rst iat=813,819,817,818, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=809,822,812,813, &end
#
#  chirality for residue 54 atoms:  CA CG HB2 HB3
 &rst iat=826,831,829,830, &end
#
#  chirality for residue 54 atoms:  CB CD1 CD2 HG
 &rst iat=828,833,837,832, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=824,841,827,828, &end
#
#  chirality for residue 55 atoms:  CA CG HB2 HB3
 &rst iat=845,850,848,849, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=843,861,846,847, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=865,870,868,869, &end
#
#  chirality for residue 56 atoms:  CB CD HG2 HG3
 &rst iat=867,873,871,872, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=863,876,866,867, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=880,885,883,884, &end
#
#  chirality for residue 57 atoms:  CB CD HG2 HG3
 &rst iat=882,888,886,887, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=878,891,881,882, &end
#
#  chirality for residue 58 atoms:  CA CG1 CG2 HB
 &rst iat=895,899,903,898, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=893,907,896,897, &end
#
#  chirality for residue 59 atoms:  N C HA2 HA3
 &rst iat=909,914,912,913, &end
#
#  chirality for residue 60 atoms:  CA CG HB2 HB3
 &rst iat=918,923,921,922, &end
#
#  chirality for residue 60 atoms:  CB CD1 CD2 HG
 &rst iat=920,925,929,924, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=916,933,919,920, &end
#
#  chirality for residue 61 atoms:  CA OG HB2 HB3
 &rst iat=937,942,940,941, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=935,944,938,939, &end
#
#  chirality for residue 62 atoms:  CA CG HB2 HB3
 &rst iat=948,953,951,952, &end
#
#  chirality for residue 62 atoms:  CB CD HG2 HG3
 &rst iat=950,956,954,955, &end
#
#  chirality for residue 62 atoms:  CG NE HD2 HD3
 &rst iat=953,959,957,958, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=946,968,949,950, &end
#
#  chirality for residue 63 atoms:  CA CG HB2 HB3
 &rst iat=972,977,975,976, &end
#
#  chirality for residue 63 atoms:  CB CD HG2 HG3
 &rst iat=974,980,978,979, &end
#
#  chirality for residue 63 atoms:  CD NZ HE2 HE3
 &rst iat=980,986,984,985, &end
#
#  chirality for residue 63 atoms:  CG CE HD2 HD3
 &rst iat=977,983,981,982, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=970,990,973,974, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=994,999,997,998, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=992,1002,995,996, &end
#
#  chirality for residue 65 atoms:  CA CG1 CG2 HB
 &rst iat=1006,1010,1014,1009, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=1004,1018,1007,1008, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=1022,1027,1025,1026, &end
#
#  chirality for residue 66 atoms:  CB CD HG2 HG3
 &rst iat=1024,1030,1028,1029, &end
#
#  chirality for residue 66 atoms:  CG NE HD2 HD3
 &rst iat=1027,1033,1031,1032, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1020,1042,1023,1024, &end
#
#  chirality for residue 67 atoms:  CA CG2 CG1 HB
 &rst iat=1046,1050,1054,1049, &end
#
#  chirality for residue 67 atoms:  CB CD1 HG12 HG13
 &rst iat=1048,1057,1055,1056, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1044,1061,1047,1048, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1065,1070,1068,1069, &end
#
#  chirality for residue 68 atoms:  CB CD1 CD2 HG
 &rst iat=1067,1072,1076,1071, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1063,1080,1066,1067, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1082,1090,1085,1086, &end
#
#  chirality for residue 70 atoms:  CA OG HB2 HB3
 &rst iat=1094,1099,1097,1098, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1092,1101,1095,1096, &end
#
#  chirality for residue 71 atoms:  CA CG2 OG1 HB
 &rst iat=1105,1109,1113,1108, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1103,1115,1106,1107, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1119,1124,1122,1123, &end
#
#  chirality for residue 72 atoms:  CB CD HG2 HG3
 &rst iat=1121,1127,1125,1126, &end
#
#  chirality for residue 72 atoms:  CG NE HD2 HD3
 &rst iat=1124,1130,1128,1129, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1117,1139,1120,1121, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1143,1148,1146,1147, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1141,1153,1144,1145, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1157,1162,1160,1161, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1155,1177,1158,1159, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1181,1186,1184,1185, &end
#
#  chirality for residue 75 atoms:  CB CD1 CD2 HG
 &rst iat=1183,1188,1192,1187, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1179,1196,1182,1183, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1200,1205,1203,1204, &end
#
#  chirality for residue 76 atoms:  CB CD HG2 HG3
 &rst iat=1202,1208,1206,1207, &end
#
#  chirality for residue 76 atoms:  CG NE HD2 HD3
 &rst iat=1205,1211,1209,1210, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1198,1220,1201,1202, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1224,1229,1227,1228, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1222,1241,1225,1226, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1245,1250,1248,1249, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=1247,1253,1251,1252, &end
#
#  chirality for residue 78 atoms:  CD NZ HE2 HE3
 &rst iat=1253,1259,1257,1258, &end
#
#  chirality for residue 78 atoms:  CG CE HD2 HD3
 &rst iat=1250,1256,1254,1255, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1243,1263,1246,1247, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1267,1272,1270,1271, &end
#
#  chirality for residue 79 atoms:  CB CD1 CD2 HG
 &rst iat=1269,1274,1278,1273, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1265,1282,1268,1269, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1294,1288,1292,1293, &end
#
#  chirality for residue 80 atoms:  CB CD HG2 HG3
 &rst iat=1291,1285,1289,1290, &end
#
#  chirality for residue 80 atoms:  CG N HD2 HD3
 &rst iat=1288,1284,1286,1287, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1284,1296,1295,1291, &end
#
#  chirality for residue 81 atoms:  CA CG HB2 HB3
 &rst iat=1300,1305,1303,1304, &end
#
#  chirality for residue 81 atoms:  CB CD HG2 HG3
 &rst iat=1302,1308,1306,1307, &end
#
#  chirality for residue 81 atoms:  CD NZ HE2 HE3
 &rst iat=1308,1314,1312,1313, &end
#
#  chirality for residue 81 atoms:  CG CE HD2 HD3
 &rst iat=1305,1311,1309,1310, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1298,1318,1301,1302, &end
#
#  chirality for residue 82 atoms:  CA CG HB2 HB3
 &rst iat=1322,1327,1325,1326, &end
#
#  chirality for residue 82 atoms:  CB CD HG2 HG3
 &rst iat=1324,1330,1328,1329, &end
#
#  chirality for residue 82 atoms:  CG NE HD2 HD3
 &rst iat=1327,1333,1331,1332, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1320,1342,1323,1324, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1346,1351,1349,1350, &end
#
#  chirality for residue 83 atoms:  CB CD1 CD2 HG
 &rst iat=1348,1353,1357,1352, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1344,1361,1347,1348, &end
#
#  chirality for residue 84 atoms:  CA CG1 CG2 HB
 &rst iat=1365,1369,1373,1368, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1363,1377,1366,1367, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1381,1386,1384,1385, &end
#
#  chirality for residue 85 atoms:  CB CD HG2 HG3
 &rst iat=1383,1389,1387,1388, &end
#
#  chirality for residue 85 atoms:  CG NE HD2 HD3
 &rst iat=1386,1392,1390,1391, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1379,1401,1382,1383, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=1405,1410,1408,1409, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1403,1425,1406,1407, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1429,1434,1432,1433, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1427,1437,1430,1431, &end
#
#  chirality for residue 88 atoms:  CA CG2 OG1 HB
 &rst iat=1441,1445,1449,1444, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1439,1451,1442,1443, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=1455,1460,1458,1459, &end
#
#  chirality for residue 89 atoms:  CB CD HG2 HG3
 &rst iat=1457,1463,1461,1462, &end
#
#  chirality for residue 89 atoms:  CD NZ HE2 HE3
 &rst iat=1463,1469,1467,1468, &end
#
#  chirality for residue 89 atoms:  CG CE HD2 HD3
 &rst iat=1460,1466,1464,1465, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1453,1473,1456,1457, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1485,1479,1483,1484, &end
#
#  chirality for residue 90 atoms:  CB CD HG2 HG3
 &rst iat=1482,1476,1480,1481, &end
#
#  chirality for residue 90 atoms:  CG N HD2 HD3
 &rst iat=1479,1475,1477,1478, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1475,1487,1486,1482, &end
#
#  chirality for residue 91 atoms:  CA CG1 CG2 HB
 &rst iat=1491,1495,1499,1494, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1489,1503,1492,1493, &end
#
#  chirality for residue 92 atoms:  CA SG HB2 HB3
 &rst iat=1507,1512,1510,1511, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1505,1514,1508,1509, &end
#
#  chirality for residue 93 atoms:  CA CG2 CG1 HB
 &rst iat=1518,1522,1526,1521, &end
#
#  chirality for residue 93 atoms:  CB CD1 HG12 HG13
 &rst iat=1520,1529,1527,1528, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1516,1533,1519,1520, &end
#
#  chirality for residue 94 atoms:  N C HA2 HA3
 &rst iat=1535,1540,1538,1539, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1544,1549,1547,1548, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1546,1552,1550,1551, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1542,1557,1545,1546, &end
#
#  chirality for residue 96 atoms:  CA CG HB2 HB3
 &rst iat=1561,1566,1564,1565, &end
#
#  chirality for residue 96 atoms:  CB CD HG2 HG3
 &rst iat=1563,1569,1567,1568, &end
#
#  chirality for residue 96 atoms:  CD NZ HE2 HE3
 &rst iat=1569,1575,1573,1574, &end
#
#  chirality for residue 96 atoms:  CG CE HD2 HD3
 &rst iat=1566,1572,1570,1571, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1559,1579,1562,1563, &end
#
#  chirality for residue 97 atoms:  CA CG HB2 HB3
 &rst iat=1583,1588,1586,1587, &end
#
#  chirality for residue 97 atoms:  CB CD HG2 HG3
 &rst iat=1585,1591,1589,1590, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1581,1596,1584,1585, &end
#
#  chirality for residue 98 atoms:  CA CG HB2 HB3
 &rst iat=1600,1605,1603,1604, &end
#
#  chirality for residue 98 atoms:  CB CD HG2 HG3
 &rst iat=1602,1608,1606,1607, &end
#
#  chirality for residue 98 atoms:  CD NZ HE2 HE3
 &rst iat=1608,1614,1612,1613, &end
#
#  chirality for residue 98 atoms:  CG CE HD2 HD3
 &rst iat=1605,1611,1609,1610, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1598,1618,1601,1602, &end
#
#  chirality for residue 99 atoms:  CA CG HB2 HB3
 &rst iat=1622,1627,1625,1626, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1620,1642,1623,1624, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1646,1651,1649,1650, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1644,1662,1647,1648, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1666,1671,1669,1670, &end
#
#  chirality for residue 101 atoms:  CB CD1 CD2 HG
 &rst iat=1668,1673,1677,1672, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1664,1681,1667,1668, &end
#
#  chirality for residue 102 atoms:  CA CG HB2 HB3
 &rst iat=1685,1690,1688,1689, &end
#
#  chirality for residue 102 atoms:  CB CD1 CD2 HG
 &rst iat=1687,1692,1696,1691, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1683,1700,1686,1687, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=1704,1709,1707,1708, &end
#
#  chirality for residue 103 atoms:  CB CD HG2 HG3
 &rst iat=1706,1712,1710,1711, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1702,1717,1705,1706, &end
#
#  chirality for residue 104 atoms:  CA CG HB2 HB3
 &rst iat=1721,1726,1724,1725, &end
#
#  chirality for residue 104 atoms:  CB CD1 CD2 HG
 &rst iat=1723,1728,1732,1727, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1719,1736,1722,1723, &end
#
#  chirality for residue 105 atoms:  CA CG1 CG2 HB
 &rst iat=1740,1744,1748,1743, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1738,1752,1741,1742, &end
#
#  chirality for residue 106 atoms:  CA OG HB2 HB3
 &rst iat=1756,1761,1759,1760, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1754,1763,1757,1758, &end
#
#  chirality for residue 107 atoms:  N C HA2 HA3
 &rst iat=1765,1770,1768,1769, &end
#
#  chirality for residue 108 atoms:  CA CG HB2 HB3
 &rst iat=1774,1779,1777,1778, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=1772,1782,1775,1776, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1784,1792,1787,1788, &end
#
#  chirality for residue 110 atoms:  CA CG HB2 HB3
 &rst iat=1796,1801,1799,1800, &end
#
#  chirality for residue 110 atoms:  CB CD HG2 HG3
 &rst iat=1798,1804,1802,1803, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1794,1807,1797,1798, &end
#
#  chirality for residue 111 atoms:  CA CG2 CG1 HB
 &rst iat=1811,1815,1819,1814, &end
#
#  chirality for residue 111 atoms:  CB CD1 HG12 HG13
 &rst iat=1813,1822,1820,1821, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=1809,1826,1812,1813, &end
#
#  chirality for residue 112 atoms:  CA CG HB2 HB3
 &rst iat=1830,1835,1833,1834, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1828,1840,1831,1832, &end
#
#  chirality for residue 113 atoms:  CA CG HB2 HB3
 &rst iat=1844,1849,1847,1848, &end
#
#  chirality for residue 113 atoms:  CB SD HG2 HG3
 &rst iat=1846,1852,1850,1851, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=1842,1857,1845,1846, &end
#
#  chirality for residue 114 atoms:  CA CG HB2 HB3
 &rst iat=1861,1866,1864,1865, &end
#
#  chirality for residue 114 atoms:  CB CD HG2 HG3
 &rst iat=1863,1869,1867,1868, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1859,1874,1862,1863, &end
#
#  chirality for residue 115 atoms:  CA CG2 OG1 HB
 &rst iat=1878,1882,1886,1881, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=1876,1888,1879,1880, &end
#
#  chirality for residue 116 atoms:  CA OG HB2 HB3
 &rst iat=1892,1897,1895,1896, &end
#
#  chirality for residue 116 atoms:  N C HA CB
 &rst iat=1890,1899,1893,1894, &end
#
#  chirality for residue 117 atoms:  CA OG HB2 HB3
 &rst iat=1903,1908,1906,1907, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=1901,1910,1904,1905, &end
#
#  chirality for residue 118 atoms:  CA CG2 OG1 HB
 &rst iat=1914,1918,1922,1917, &end
#
#  chirality for residue 118 atoms:  N C HA CB
 &rst iat=1912,1924,1915,1916, &end
#
#  chirality for residue 119 atoms:  CA CG HB2 HB3
 &rst iat=1936,1930,1934,1935, &end
#
#  chirality for residue 119 atoms:  CB CD HG2 HG3
 &rst iat=1933,1927,1931,1932, &end
#
#  chirality for residue 119 atoms:  CG N HD2 HD3
 &rst iat=1930,1926,1928,1929, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=1926,1938,1937,1933, &end
#
#  chirality for residue 120 atoms:  CA CG HB2 HB3
 &rst iat=1942,1947,1945,1946, &end
#
#  chirality for residue 120 atoms:  CB CD HG2 HG3
 &rst iat=1944,1950,1948,1949, &end
#
#  chirality for residue 120 atoms:  N C HA CB
 &rst iat=1940,1953,1943,1944, &end
#
#  chirality for residue 121 atoms:  CA CG HB2 HB3
 &rst iat=1957,1962,1960,1961, &end
#
#  chirality for residue 121 atoms:  N C HA CB
 &rst iat=1955,1973,1958,1959, &end
#
#  chirality for residue 122 atoms:  CA CG HB2 HB3
 &rst iat=1977,1982,1980,1981, &end
#
#  chirality for residue 122 atoms:  N C HA CB
 &rst iat=1975,1985,1978,1979, &end
#
#  chirality for residue 123 atoms:  N C HA2 HA3
 &rst iat=1987,1992,1990,1991, &end
#
#  chirality for residue 124 atoms:  CA CG HB2 HB3
 &rst iat=1996,2001,1999,2000, &end
#
#  chirality for residue 124 atoms:  N C HA CB
 &rst iat=1994,2016,1997,1998, &end
#
#  chirality for residue 125 atoms:  CA CG HB2 HB3
 &rst iat=2020,2025,2023,2024, &end
#
#  chirality for residue 125 atoms:  CB CD HG2 HG3
 &rst iat=2022,2028,2026,2027, &end
#
#  chirality for residue 125 atoms:  CG NE HD2 HD3
 &rst iat=2025,2031,2029,2030, &end
#
#  chirality for residue 125 atoms:  N C HA CB
 &rst iat=2018,2040,2021,2022, &end
#
#  chirality for residue 126 atoms:  CA CG HB2 HB3
 &rst iat=2044,2049,2047,2048, &end
#
#  chirality for residue 126 atoms:  N C HA CB
 &rst iat=2042,2064,2045,2046, &end
#
#  chirality for residue 127 atoms:  CA CG1 CG2 HB
 &rst iat=2068,2072,2076,2071, &end
#
#  chirality for residue 127 atoms:  N C HA CB
 &rst iat=2066,2080,2069,2070, &end
#
#  chirality for residue 128 atoms:  CA OG HB2 HB3
 &rst iat=2084,2089,2087,2088, &end
#
#  chirality for residue 128 atoms:  N C HA CB
 &rst iat=2082,2091,2085,2086, &end
#
#  chirality for residue 129 atoms:  CA CG HB2 HB3
 &rst iat=2095,2100,2098,2099, &end
#
#  chirality for residue 129 atoms:  N C HA CB
 &rst iat=2093,2112,2096,2097, &end
#
#  chirality for residue 130 atoms:  CA CG HB2 HB3
 &rst iat=2116,2121,2119,2120, &end
#
#  chirality for residue 130 atoms:  N C HA CB
 &rst iat=2114,2136,2117,2118, &end
#
#  chirality for residue 131 atoms:  CA CG HB2 HB3
 &rst iat=2140,2145,2143,2144, &end
#
#  chirality for residue 131 atoms:  N C HA CB
 &rst iat=2138,2157,2141,2142, &end
#
#  chirality for residue 132 atoms:  CA CG HB2 HB3
 &rst iat=2169,2163,2167,2168, &end
#
#  chirality for residue 132 atoms:  CB CD HG2 HG3
 &rst iat=2166,2160,2164,2165, &end
#
#  chirality for residue 132 atoms:  CG N HD2 HD3
 &rst iat=2163,2159,2161,2162, &end
#
#  chirality for residue 132 atoms:  N C HA CB
 &rst iat=2159,2171,2170,2166, &end
#
#  chirality for residue 133 atoms:  CA CG1 CG2 HB
 &rst iat=2175,2179,2183,2178, &end
#
#  chirality for residue 133 atoms:  N C HA CB
 &rst iat=2173,2187,2176,2177, &end
#
#  chirality for residue 134 atoms:  CA CG HB2 HB3
 &rst iat=2191,2196,2194,2195, &end
#
#  chirality for residue 134 atoms:  CB CD HG2 HG3
 &rst iat=2193,2199,2197,2198, &end
#
#  chirality for residue 134 atoms:  CG NE HD2 HD3
 &rst iat=2196,2202,2200,2201, &end
#
#  chirality for residue 134 atoms:  N C HA CB
 &rst iat=2189,2211,2192,2193, &end
#
#  chirality for residue 135 atoms:  CA CG HB2 HB3
 &rst iat=2215,2220,2218,2219, &end
#
#  chirality for residue 135 atoms:  CB CD HG2 HG3
 &rst iat=2217,2223,2221,2222, &end
#
#  chirality for residue 135 atoms:  N C HA CB
 &rst iat=2213,2228,2216,2217, &end
#
#  chirality for residue 136 atoms:  CA CG1 CG2 HB
 &rst iat=2232,2236,2240,2235, &end
#
#  chirality for residue 136 atoms:  N C HA CB
 &rst iat=2230,2244,2233,2234, &end
#
#  chirality for residue 137 atoms:  CA CG1 CG2 HB
 &rst iat=2248,2252,2256,2251, &end
#
#  chirality for residue 137 atoms:  N C HA CB
 &rst iat=2246,2260,2249,2250, &end
#
#  chirality for residue 138 atoms:  CA OG HB2 HB3
 &rst iat=2264,2269,2267,2268, &end
#
#  chirality for residue 138 atoms:  N C HA CB
 &rst iat=2262,2271,2265,2266, &end
#
#  chirality for residue 139 atoms:  CA CG HB2 HB3
 &rst iat=2275,2280,2278,2279, &end
#
#  chirality for residue 139 atoms:  N C HA CB
 &rst iat=2273,2291,2276,2277, &end
#
#  chirality for residue 140 atoms:  CA CG HB2 HB3
 &rst iat=2295,2300,2298,2299, &end
#
#  chirality for residue 140 atoms:  CB CD HG2 HG3
 &rst iat=2297,2303,2301,2302, &end
#
#  chirality for residue 140 atoms:  CD NZ HE2 HE3
 &rst iat=2303,2309,2307,2308, &end
#
#  chirality for residue 140 atoms:  CG CE HD2 HD3
 &rst iat=2300,2306,2304,2305, &end
#
#  chirality for residue 140 atoms:  N C HA CB
 &rst iat=2293,2313,2296,2297, &end
#
#  chirality for residue 141 atoms:  CA CG HB2 HB3
 &rst iat=2317,2322,2320,2321, &end
#
#  chirality for residue 141 atoms:  CB CD HG2 HG3
 &rst iat=2319,2325,2323,2324, &end
#
#  chirality for residue 141 atoms:  CG NE HD2 HD3
 &rst iat=2322,2328,2326,2327, &end
#
#  chirality for residue 141 atoms:  N C HA CB
 &rst iat=2315,2337,2318,2319, &end
#
#  chirality for residue 142 atoms:  CA CG HB2 HB3
 &rst iat=2341,2346,2344,2345, &end
#
#  chirality for residue 142 atoms:  N C HA CB
 &rst iat=2339,2349,2342,2343, &end
#
#  chirality for residue 143 atoms:  CA CG1 CG2 HB
 &rst iat=2353,2357,2361,2356, &end
#
#  chirality for residue 143 atoms:  N C HA CB
 &rst iat=2351,2365,2354,2355, &end
#
#  chirality for residue 144 atoms:  CA CG HB2 HB3
 &rst iat=2369,2374,2372,2373, &end
#
#  chirality for residue 144 atoms:  N C HA CB
 &rst iat=2367,2386,2370,2371, &end
#
#  chirality for residue 145 atoms:  CA CG HB2 HB3
 &rst iat=2390,2395,2393,2394, &end
#
#  chirality for residue 145 atoms:  CB CD HG2 HG3
 &rst iat=2392,2398,2396,2397, &end
#
#  chirality for residue 145 atoms:  CG NE HD2 HD3
 &rst iat=2395,2401,2399,2400, &end
#
#  chirality for residue 145 atoms:  N C HA CB
 &rst iat=2388,2410,2391,2392, &end
#
#  chirality for residue 146 atoms:  CA CG HB2 HB3
 &rst iat=2414,2419,2417,2418, &end
#
#  chirality for residue 146 atoms:  CB CD HG2 HG3
 &rst iat=2416,2422,2420,2421, &end
#
#  chirality for residue 146 atoms:  CG NE HD2 HD3
 &rst iat=2419,2425,2423,2424, &end
#
#  chirality for residue 146 atoms:  N C HA CB
 &rst iat=2412,2434,2415,2416, &end
#
#  chirality for residue 147 atoms:  CA CG1 CG2 HB
 &rst iat=2438,2442,2446,2441, &end
#
#  chirality for residue 147 atoms:  N C HA CB
 &rst iat=2436,2450,2439,2440, &end
#
#  chirality for residue 148 atoms:  CA CG HB2 HB3
 &rst iat=2454,2459,2457,2458, &end
#
#  chirality for residue 148 atoms:  CB SD HG2 HG3
 &rst iat=2456,2462,2460,2461, &end
#
#  chirality for residue 148 atoms:  N C HA CB
 &rst iat=2452,2467,2455,2456, &end
#
#  chirality for residue 149 atoms:  CA CG HB2 HB3
 &rst iat=2471,2476,2474,2475, &end
#
#  chirality for residue 149 atoms:  CB CD HG2 HG3
 &rst iat=2473,2479,2477,2478, &end
#
#  chirality for residue 149 atoms:  CD NZ HE2 HE3
 &rst iat=2479,2485,2483,2484, &end
#
#  chirality for residue 149 atoms:  CG CE HD2 HD3
 &rst iat=2476,2482,2480,2481, &end
#
#  chirality for residue 149 atoms:  N C HA CB
 &rst iat=2469,2489,2472,2473, &end
#
#  chirality for residue 150 atoms:  CA CG HB2 HB3
 &rst iat=2493,2498,2496,2497, &end
#
#  chirality for residue 150 atoms:  CB CD HG2 HG3
 &rst iat=2495,2501,2499,2500, &end
#
#  chirality for residue 150 atoms:  N C HA CB
 &rst iat=2491,2504,2494,2495, &end
#
#  chirality for residue 151 atoms:  CA CG HB2 HB3
 &rst iat=2508,2513,2511,2512, &end
#
#  chirality for residue 151 atoms:  N C HA CB
 &rst iat=2506,2524,2509,2510, &end
#
#  chirality for residue 152 atoms:  N C HA CB
 &rst iat=2526,2534,2529,2530, &end
#
#  chirality for residue 153 atoms:  CA OG HB2 HB3
 &rst iat=2538,2543,2541,2542, &end
#
#  chirality for residue 153 atoms:  N C HA CB
 &rst iat=2536,2545,2539,2540, &end
#
#  chirality for residue 154 atoms:  CA CG1 CG2 HB
 &rst iat=2549,2553,2557,2552, &end
#
#  chirality for residue 154 atoms:  N C HA CB
 &rst iat=2547,2561,2550,2551, &end
#
#  chirality for residue 155 atoms:  CA CG1 CG2 HB
 &rst iat=2565,2569,2573,2568, &end
#
#  chirality for residue 155 atoms:  N C HA CB
 &rst iat=2563,2577,2566,2567, &end
#
#  chirality for residue 156 atoms:  CA CG HB2 HB3
 &rst iat=2581,2586,2584,2585, &end
#
#  chirality for residue 156 atoms:  CB SD HG2 HG3
 &rst iat=2583,2589,2587,2588, &end
#
#  chirality for residue 156 atoms:  N C HA CB
 &rst iat=2579,2594,2582,2583, &end
#
#  chirality for residue 157 atoms:  CA OG HB2 HB3
 &rst iat=2598,2603,2601,2602, &end
#
#  chirality for residue 157 atoms:  N C HA CB
 &rst iat=2596,2605,2599,2600, &end
#
#  chirality for residue 158 atoms:  CA CG HB2 HB3
 &rst iat=2609,2614,2612,2613, &end
#
#  chirality for residue 158 atoms:  CB CD1 CD2 HG
 &rst iat=2611,2616,2620,2615, &end
#
#  chirality for residue 158 atoms:  N C HA CB
 &rst iat=2607,2624,2610,2611, &end
#
#  chirality for residue 159 atoms:  CA CG HB2 HB3
 &rst iat=2628,2633,2631,2632, &end
#
#  chirality for residue 159 atoms:  CB CD HG2 HG3
 &rst iat=2630,2636,2634,2635, &end
#
#  chirality for residue 159 atoms:  N C HA CB
 &rst iat=2626,2641,2629,2630, &end
#
#  chirality for residue 160 atoms:  CA CG HB2 HB3
 &rst iat=2645,2650,2648,2649, &end
#
#  chirality for residue 160 atoms:  CB CD HG2 HG3
 &rst iat=2647,2653,2651,2652, &end
#
#  chirality for residue 160 atoms:  N C HA CB
 &rst iat=2643,2656,2646,2647, &end
#
#  chirality for residue 161 atoms:  CA CG HB2 HB3
 &rst iat=2660,2665,2663,2664, &end
#
#  chirality for residue 161 atoms:  N C HA CB
 &rst iat=2658,2670,2661,2662, &end
#
#  chirality for residue 162 atoms:  CA CG2 OG1 HB
 &rst iat=2674,2678,2682,2677, &end
#
#  chirality for residue 162 atoms:  N C HA CB
 &rst iat=2672,2684,2675,2676, &end
#
#  chirality for residue 163 atoms:  CA CG HB2 HB3
 &rst iat=2696,2690,2694,2695, &end
#
#  chirality for residue 163 atoms:  CB CD HG2 HG3
 &rst iat=2693,2687,2691,2692, &end
#
#  chirality for residue 163 atoms:  CG N HD2 HD3
 &rst iat=2690,2686,2688,2689, &end
#
#  chirality for residue 163 atoms:  N C HA CB
 &rst iat=2686,2698,2697,2693, &end
#
#  chirality for residue 164 atoms:  CA CG HB2 HB3
 &rst iat=2702,2707,2705,2706, &end
#
#  chirality for residue 164 atoms:  CB CD HG2 HG3
 &rst iat=2704,2710,2708,2709, &end
#
#  chirality for residue 164 atoms:  CD NZ HE2 HE3
 &rst iat=2710,2716,2714,2715, &end
#
#  chirality for residue 164 atoms:  CG CE HD2 HD3
 &rst iat=2707,2713,2711,2712, &end
#
#  chirality for residue 164 atoms:  N C HA CB
 &rst iat=2700,2720,2703,2704, &end
#
#  trans-omega constraint for residue 2
 &rst iat=22,20,18,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 150., rk3=150.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=41,39,37,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=53,51,49,41, &end
#
#  trans-omega constraint for residue 5
 &rst iat=65,63,61,53, &end
#
#  trans-omega constraint for residue 6
 &rst iat=77,75,73,65, &end
#
#  trans-omega constraint for residue 7
 &rst iat=84,82,80,77, &end
#
#  trans-omega constraint for residue 8
 &rst iat=105,103,101,84, &end
#
#  trans-omega constraint for residue 9
 &rst iat=137,127,125,105, &end
#
#  trans-omega constraint for residue 10
 &rst iat=143,141,139,137, &end
#
#  trans-omega constraint for residue 11
 &rst iat=157,155,153,143, &end
#
#  trans-omega constraint for residue 12
 &rst iat=173,171,169,157, &end
#
#  trans-omega constraint for residue 13
 &rst iat=180,178,176,173, &end
#
#  trans-omega constraint for residue 14
 &rst iat=199,197,195,180, &end
#
#  trans-omega constraint for residue 15
 &rst iat=215,213,211,199, &end
#
#  trans-omega constraint for residue 16
 &rst iat=234,232,230,215, &end
#
#  trans-omega constraint for residue 17
 &rst iat=245,243,241,234, &end
#
#  trans-omega constraint for residue 18
 &rst iat=259,257,255,245, &end
#
#  trans-omega constraint for residue 19
 &rst iat=283,281,279,259, &end
#
#  trans-omega constraint for residue 20
 &rst iat=300,298,296,283, &end
#
#  trans-omega constraint for residue 21
 &rst iat=307,305,303,300, &end
#
#  trans-omega constraint for residue 22
 &rst iat=324,322,320,307, &end
#
#  trans-omega constraint for residue 23
 &rst iat=340,338,336,324, &end
#
#  trans-omega constraint for residue 24
 &rst iat=357,355,353,340, &end
#
#  trans-omega constraint for residue 25
 &rst iat=381,379,377,357, &end
#
#  trans-omega constraint for residue 26
 &rst iat=391,389,387,381, &end
#
#  trans-omega constraint for residue 27
 &rst iat=415,413,411,391, &end
#
#  trans-omega constraint for residue 28
 &rst iat=439,437,435,415, &end
#
#  trans-omega constraint for residue 29
 &rst iat=459,457,455,439, &end
#
#  trans-omega constraint for residue 30
 &rst iat=466,464,462,459, &end
#
#  trans-omega constraint for residue 31
 &rst iat=483,481,479,466, &end
#
#  trans-omega constraint for residue 32
 &rst iat=500,498,496,483, &end
#
#  trans-omega constraint for residue 33
 &rst iat=511,509,507,500, &end
#
#  trans-omega constraint for residue 34
 &rst iat=535,533,531,511, &end
#
#  trans-omega constraint for residue 35
 &rst iat=552,550,548,535, &end
#
#  trans-omega constraint for residue 36
 &rst iat=580,570,568,552, &end
#
#  trans-omega constraint for residue 37
 &rst iat=586,584,582,580, &end
#
#  trans-omega constraint for residue 38
 &rst iat=603,601,599,586, &end
#
#  trans-omega constraint for residue 39
 &rst iat=610,608,606,603, &end
#
#  trans-omega constraint for residue 40
 &rst iat=617,615,613,610, &end
#
#  trans-omega constraint for residue 41
 &rst iat=636,634,632,617, &end
#
#  trans-omega constraint for residue 42
 &rst iat=658,648,646,636, &end
#
#  trans-omega constraint for residue 43
 &rst iat=664,662,660,658, &end
#
#  trans-omega constraint for residue 44
 &rst iat=671,669,667,664, &end
#
#  trans-omega constraint for residue 45
 &rst iat=686,684,682,671, &end
#
#  trans-omega constraint for residue 46
 &rst iat=697,695,693,686, &end
#
#  trans-omega constraint for residue 47
 &rst iat=707,705,703,697, &end
#
#  trans-omega constraint for residue 48
 &rst iat=722,720,718,707, &end
#
#  trans-omega constraint for residue 49
 &rst iat=739,737,735,722, &end
#
#  trans-omega constraint for residue 50
 &rst iat=749,747,745,739, &end
#
#  trans-omega constraint for residue 51
 &rst iat=766,764,762,749, &end
#
#  trans-omega constraint for residue 52
 &rst iat=787,785,783,766, &end
#
#  trans-omega constraint for residue 53
 &rst iat=811,809,807,787, &end
#
#  trans-omega constraint for residue 54
 &rst iat=826,824,822,811, &end
#
#  trans-omega constraint for residue 55
 &rst iat=845,843,841,826, &end
#
#  trans-omega constraint for residue 56
 &rst iat=865,863,861,845, &end
#
#  trans-omega constraint for residue 57
 &rst iat=880,878,876,865, &end
#
#  trans-omega constraint for residue 58
 &rst iat=895,893,891,880, &end
#
#  trans-omega constraint for residue 59
 &rst iat=911,909,907,895, &end
#
#  trans-omega constraint for residue 60
 &rst iat=918,916,914,911, &end
#
#  trans-omega constraint for residue 61
 &rst iat=937,935,933,918, &end
#
#  trans-omega constraint for residue 62
 &rst iat=948,946,944,937, &end
#
#  trans-omega constraint for residue 63
 &rst iat=972,970,968,948, &end
#
#  trans-omega constraint for residue 64
 &rst iat=994,992,990,972, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1006,1004,1002,994, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1022,1020,1018,1006, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1046,1044,1042,1022, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1065,1063,1061,1046, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1084,1082,1080,1065, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1094,1092,1090,1084, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1105,1103,1101,1094, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1119,1117,1115,1105, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1143,1141,1139,1119, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1157,1155,1153,1143, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1181,1179,1177,1157, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1200,1198,1196,1181, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1224,1222,1220,1200, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1245,1243,1241,1224, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1267,1265,1263,1245, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1294,1284,1282,1267, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1300,1298,1296,1294, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1322,1320,1318,1300, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1346,1344,1342,1322, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1365,1363,1361,1346, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1381,1379,1377,1365, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1405,1403,1401,1381, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1429,1427,1425,1405, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1441,1439,1437,1429, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1455,1453,1451,1441, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1491,1489,1487,1485, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1507,1505,1503,1491, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1518,1516,1514,1507, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1537,1535,1533,1518, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1544,1542,1540,1537, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1561,1559,1557,1544, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1583,1581,1579,1561, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1600,1598,1596,1583, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1622,1620,1618,1600, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1646,1644,1642,1622, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1666,1664,1662,1646, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1685,1683,1681,1666, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1704,1702,1700,1685, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1721,1719,1717,1704, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1740,1738,1736,1721, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1756,1754,1752,1740, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1767,1765,1763,1756, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1774,1772,1770,1767, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1786,1784,1782,1774, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1796,1794,1792,1786, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1811,1809,1807,1796, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1830,1828,1826,1811, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1844,1842,1840,1830, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1861,1859,1857,1844, &end
#
#  trans-omega constraint for residue 115
 &rst iat=1878,1876,1874,1861, &end
#
#  trans-omega constraint for residue 116
 &rst iat=1892,1890,1888,1878, &end
#
#  trans-omega constraint for residue 117
 &rst iat=1903,1901,1899,1892, &end
#
#  trans-omega constraint for residue 118
 &rst iat=1914,1912,1910,1903, &end
#
#  trans-omega constraint for residue 119
 &rst iat=1936,1926,1924,1914, &end
#
#  trans-omega constraint for residue 120
 &rst iat=1942,1940,1938,1936, &end
#
#  trans-omega constraint for residue 121
 &rst iat=1957,1955,1953,1942, &end
#
#  trans-omega constraint for residue 122
 &rst iat=1977,1975,1973,1957, &end
#
#  trans-omega constraint for residue 123
 &rst iat=1989,1987,1985,1977, &end
#
#  trans-omega constraint for residue 124
 &rst iat=1996,1994,1992,1989, &end
#
#  trans-omega constraint for residue 125
 &rst iat=2020,2018,2016,1996, &end
#
#  trans-omega constraint for residue 126
 &rst iat=2044,2042,2040,2020, &end
#
#  trans-omega constraint for residue 127
 &rst iat=2068,2066,2064,2044, &end
#
#  trans-omega constraint for residue 128
 &rst iat=2084,2082,2080,2068, &end
#
#  trans-omega constraint for residue 129
 &rst iat=2095,2093,2091,2084, &end
#
#  trans-omega constraint for residue 130
 &rst iat=2116,2114,2112,2095, &end
#
#  trans-omega constraint for residue 131
 &rst iat=2140,2138,2136,2116, &end
#
#  trans-omega constraint for residue 132
 &rst iat=2169,2159,2157,2140, &end
#
#  trans-omega constraint for residue 133
 &rst iat=2175,2173,2171,2169, &end
#
#  trans-omega constraint for residue 134
 &rst iat=2191,2189,2187,2175, &end
#
#  trans-omega constraint for residue 135
 &rst iat=2215,2213,2211,2191, &end
#
#  trans-omega constraint for residue 136
 &rst iat=2232,2230,2228,2215, &end
#
#  trans-omega constraint for residue 137
 &rst iat=2248,2246,2244,2232, &end
#
#  trans-omega constraint for residue 138
 &rst iat=2264,2262,2260,2248, &end
#
#  trans-omega constraint for residue 139
 &rst iat=2275,2273,2271,2264, &end
#
#  trans-omega constraint for residue 140
 &rst iat=2295,2293,2291,2275, &end
#
#  trans-omega constraint for residue 141
 &rst iat=2317,2315,2313,2295, &end
#
#  trans-omega constraint for residue 142
 &rst iat=2341,2339,2337,2317, &end
#
#  trans-omega constraint for residue 143
 &rst iat=2353,2351,2349,2341, &end
#
#  trans-omega constraint for residue 144
 &rst iat=2369,2367,2365,2353, &end
#
#  trans-omega constraint for residue 145
 &rst iat=2390,2388,2386,2369, &end
#
#  trans-omega constraint for residue 146
 &rst iat=2414,2412,2410,2390, &end
#
#  trans-omega constraint for residue 147
 &rst iat=2438,2436,2434,2414, &end
#
#  trans-omega constraint for residue 148
 &rst iat=2454,2452,2450,2438, &end
#
#  trans-omega constraint for residue 149
 &rst iat=2471,2469,2467,2454, &end
#
#  trans-omega constraint for residue 150
 &rst iat=2493,2491,2489,2471, &end
#
#  trans-omega constraint for residue 151
 &rst iat=2508,2506,2504,2493, &end
#
#  trans-omega constraint for residue 152
 &rst iat=2528,2526,2524,2508, &end
#
#  trans-omega constraint for residue 153
 &rst iat=2538,2536,2534,2528, &end
#
#  trans-omega constraint for residue 154
 &rst iat=2549,2547,2545,2538, &end
#
#  trans-omega constraint for residue 155
 &rst iat=2565,2563,2561,2549, &end
#
#  trans-omega constraint for residue 156
 &rst iat=2581,2579,2577,2565, &end
#
#  trans-omega constraint for residue 157
 &rst iat=2598,2596,2594,2581, &end
#
#  trans-omega constraint for residue 158
 &rst iat=2609,2607,2605,2598, &end
#
#  trans-omega constraint for residue 159
 &rst iat=2628,2626,2624,2609, &end
#
#  trans-omega constraint for residue 160
 &rst iat=2645,2643,2641,2628, &end
#
#  trans-omega constraint for residue 161
 &rst iat=2660,2658,2656,2645, &end
#
#  trans-omega constraint for residue 162
 &rst iat=2674,2672,2670,2660, &end
#
#  trans-omega constraint for residue 163
 &rst iat=2696,2686,2684,2674, &end
#
#  trans-omega constraint for residue 164
 &rst iat=2702,2700,2698,2696, &end
#
#  cis-omega constraint for residue 90
 &rst iat=1485,1475,1473,1455, 
   r1=-30., r2=-10., r3=10., r4=30., rk2 = 150., rk3=150.,  &end
 
#
#    1 MET  HB+           1 MET  HA          2.60    (#      0:20  Unique         2.34, 2.63 A)
 &rst
  ixpk= 0, nxpk= 20, iat=  -1,   6, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=1,
 igr1=   8,   9,
 &end
#
#    1 MET  HG-           1 MET  HA          5.50    (#      1:20  Unique         2.62, 3.57 A)
 &rst
  ixpk= 1, nxpk= 20, iat=  -1,   6, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  11,  12,
 &end
#
#    1 MET  HG+           1 MET  HA          5.50    (#      2:20  Unique         2.62, 3.57 A)
 &rst
  ixpk= 2, nxpk= 20, iat=  -1,   6, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  11,  12,
 &end
#
#   22 VAL  MGX          24 TRP  HA          4.40    (#      3:20  Unique         4.36, 6.83 A)
 &rst
  ixpk= 3, nxpk= 20, iat=  -1, 358, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#    2 ILE  HN            1 MET  HA          4.40    (#      5:20  Unique         2.14, 2.29 A)
 &rst
  ixpk= 5, nxpk= 20, iat=  21,   6, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    1 MET  HG-           1 MET  HB+         2.60    (#      6:20  Unique         2.21, 2.61 A)
 &rst
  ixpk= 6, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=  11,  12,
 igr2=   8,   9,
 &end
#
#    1 MET  HG+           1 MET  HB+         2.60    (#      7:20  Unique         2.21, 2.61 A)
 &rst
  ixpk= 7, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=  11,  12,
 igr2=   8,   9,
 &end
#
#    1 MET  HA            1 MET  HB+         2.60    (#      8:20  Unique         2.34, 2.63 A)
 &rst
  ixpk= 8, nxpk= 20, iat=   6,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=   8,   9,
 &end
#
#    0 AMB  20-2:10       0 AMB  20-1:10     5.50    (#     10:20  Double Ambig)
 &rst
  ixpk= 10, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 644, 645,2214,
 igr2=   8,   9,2460,2461,
 &end
#
#    0 AMB  20-2:11       1 MET  HG-         5.50    (#     11:20  Single Ambig)
 &rst
  ixpk= 11, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 132, 133, 108, 109, 108, 109,
 igr2=  11,  12,
 &end
#
#    0 AMB  20-2:12       0 AMB  20-1:12     4.40    (#     12:20  Double Ambig)
 &rst
  ixpk= 12, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 132, 133, 111, 112, 108, 109,
 igr2=  11,  12,  11,  12,  11,  12,
 &end
#
#    1 MET  ME            1 MET  HG+         3.50    (#     13:20  Unique         2.08, 3.43 A)
 &rst
  ixpk= 13, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  15,  16,  17,
 igr2=  11,  12,
 &end
#
#    1 MET  ME            1 MET  HG-         3.50    (#     14:20  Unique         2.08, 3.43 A)
 &rst
  ixpk= 14, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  15,  16,  17,
 igr2=  11,  12,
 &end
#
#    0 AMB  20-2:15       0 AMB  20-1:15     2.60    (#     15:20  Double Ambig)
 &rst
  ixpk= 15, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=   8,   9, 653, 654,
 igr2=  11,  12,  11,  12,
 &end
#
#    0 AMB  20-2:16       1 MET  HG-         2.60    (#     16:20  Single Ambig)
 &rst
  ixpk= 16, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=   8,   9, 653, 654,
 igr2=  11,  12,
 &end
#
#    9 PRO  HD+           1 MET  HG+         4.40    (#     17:20  Unique         2.38, 4.70 A)
 &rst
  ixpk= 17, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 129, 130,
 igr2=  11,  12,
 &end
#
#    0 AMB  20-2:18       0 AMB  20-1:18     4.40    (#     18:20  Double Ambig)
 &rst
  ixpk= 18, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=   6,  23,
 igr2=  11,  12,  11,  12,
 &end
#
#    9 PRO  HD+           1 MET  HG-         4.40    (#     19:20  Unique         2.38, 4.70 A)
 &rst
  ixpk= 19, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 129, 130,
 igr2=  11,  12,
 &end
#
#    0 AMB  20-2:20       1 MET  HG-         4.40    (#     20:20  Single Ambig)
 &rst
  ixpk= 20, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=   6,  23,
 igr2=  11,  12,
 &end
#
#    3 ASP  HN            2 ILE  HA          2.60    (#     21:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 21, nxpk= 20, iat=  40,  23, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    8 ARG  HA            2 ILE  HA          3.50    (#     22:20  Unique         2.44, 2.64 A)
 &rst
  ixpk= 22, nxpk= 20, iat= 106,  23, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    9 PRO  HD+           2 ILE  HA          4.40    (#     24:20  Unique         3.40, 3.80 A)
 &rst
  ixpk= 24, nxpk= 20, iat=  -1,  23, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 129, 130,
 &end
#
#    2 ILE  HN            2 ILE  HA          5.50    (#     25:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 25, nxpk= 20, iat=  21,  23, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    3 ASP  HB+           2 ILE  HA          5.50    (#     26:20  Unique         4.21, 4.94 A)
 &rst
  ixpk= 26, nxpk= 20, iat=  -1,  23, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  44,  45,
 &end
#
#    2 ILE  HB            2 ILE  HA          3.50    (#     27:20  Unique         2.92, 2.98 A)
 &rst
  ixpk= 27, nxpk= 20, iat=  25,  23, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:28       2 ILE  HA          3.50    (#     28:20  Single Ambig)
 &rst
  ixpk= 28, nxpk= 20, iat=  -1,  23, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 108, 109, 108, 109, 111, 112,
 &end
#
#    2 ILE  HG1-          2 ILE  HA          4.40    (#     29:20  Unique         1.99, 2.60 A)
 &rst
  ixpk= 29, nxpk= 20, iat=  -1,  23, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=  31,  32,
 &end
#
#    2 ILE  HG1+          2 ILE  HA          3.50    (#     30:20  Unique         1.99, 2.60 A)
 &rst
  ixpk= 30, nxpk= 20, iat=  -1,  23, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  31,  32,
 &end
#
#    2 ILE  QD1           2 ILE  HA          3.50    (#     31:20  Unique         3.64, 4.36 A)
 &rst
  ixpk= 31, nxpk= 20, iat=  -1,  23, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=  34,  35,  36,
 &end
#
#    2 ILE  QG2           2 ILE  HA          2.60    (#     32:20  Unique         2.58, 3.35 A)
 &rst
  ixpk= 32, nxpk= 20, iat=  -1,  23, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=  27,  28,  29,
 &end
#
#    2 ILE  QG2           2 ILE  HB          2.60    (#     33:20  Unique         2.32, 2.63 A)
 &rst
  ixpk= 33, nxpk= 20, iat=  -1,  25, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=  27,  28,  29,
 &end
#
#    2 ILE  HG1+          2 ILE  HB          3.50    (#     34:20  Unique         2.69, 2.85 A)
 &rst
  ixpk= 34, nxpk= 20, iat=  -1,  25, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  31,  32,
 &end
#
#    2 ILE  HG1-          2 ILE  HB          3.50    (#     35:20  Unique         2.69, 2.85 A)
 &rst
  ixpk= 35, nxpk= 20, iat=  -1,  25, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  31,  32,
 &end
#
#    0 AMB  20-2:36       2 ILE  HB          3.50    (#     36:20  Single Ambig)
 &rst
  ixpk= 36, nxpk= 20, iat=  -1,  25, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=  23,  78,  79,   6,
 &end
#
#    2 ILE  HN            2 ILE  HB          5.50    (#     38:20  Unique         2.36, 2.48 A)
 &rst
  ixpk= 38, nxpk= 20, iat=  21,  25, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:39       2 ILE  HB          5.50    (#     39:20  Single Ambig)
 &rst
  ixpk= 39, nxpk= 20, iat=  -1,  25, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  40, 104,
 &end
#
#    0 AMB  20-2:40      66 ARG  HG-         3.50    (#     40:20  Single Ambig)
 &rst
  ixpk= 40, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1703,1045,
 igr2=1028,1029,
 &end
#
#   66 ARG  HN           66 ARG  HG-         4.40    (#     41:20  Unique         2.68, 3.70 A)
 &rst
  ixpk= 41, nxpk= 20, iat=1021,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1028,1029,
 &end
#
#   83 LEU  HN           83 LEU  HG          3.50    (#     42:20  Unique         2.13, 2.96 A)
 &rst
  ixpk= 42, nxpk= 20, iat=1345,1352, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:43       0 AMB  20-1:43     4.40    (#     43:20  Double Ambig)
 &rst
  ixpk= 43, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1034,1364,
 igr2=1028,1029,1352,
 &end
#
#   83 LEU  HA           83 LEU  HG          3.50    (#     44:20  Unique         2.20, 3.04 A)
 &rst
  ixpk= 44, nxpk= 20, iat=1347,1352, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:47       2 ILE  HG1-        3.50    (#     47:20  Single Ambig)
 &rst
  ixpk= 47, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  23,  78,  79,
 igr2=  31,  32,
 &end
#
#    0 AMB  20-2:48       0 AMB  20-1:48     3.50    (#     48:20  Double Ambig)
 &rst
  ixpk= 48, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=  23,  78,  79,
 igr2=  31,  32,  31,  32,
 &end
#
#   66 ARG  HD+          66 ARG  HG-         2.60    (#     49:20  Unique         2.22, 2.65 A)
 &rst
  ixpk= 49, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1031,1032,
 igr2=1028,1029,
 &end
#
#   92 CYS  HB+           2 ILE  HG1+        5.50    (#     50:20  Unique         1.94, 2.90 A)
 &rst
  ixpk= 50, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1510,1511,
 igr2=  31,  32,
 &end
#
#    8 ARG  HB+           2 ILE  HG1-        2.60    (#     51:20  Unique         1.94, 3.44 A)
 &rst
  ixpk= 51, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 108, 109,
 igr2=  31,  32,
 &end
#
#    8 ARG  HB+           2 ILE  HG1+        5.50    (#     52:20  Unique         1.94, 3.44 A)
 &rst
  ixpk= 52, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 108, 109,
 igr2=  31,  32,
 &end
#
#    8 ARG  HB-           2 ILE  HG1+        4.40    (#     53:20  Unique         1.94, 3.44 A)
 &rst
  ixpk= 53, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 108, 109,
 igr2=  31,  32,
 &end
#
#    0 AMB  20-2:54       0 AMB  20-1:54     2.60    (#     54:20  Double Ambig)
 &rst
  ixpk= 54, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.45, r4= 5.20,
 igr1=1025,1026,1349,1350,  25,
 igr2=1028,1029,1352,  31,  32,
 &end
#
#    2 ILE  HB            2 ILE  HG1+        2.60    (#     55:20  Unique         2.69, 2.85 A)
 &rst
  ixpk= 55, nxpk= 20, iat=  25,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=  31,  32,
 &end
#
#    0 AMB  20-2:56       0 AMB  20-1:56     2.60    (#     56:20  Double Ambig)
 &rst
  ixpk= 56, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.90, r4= 5.65,
 igr1=  27,  28,  29,1354,1355,1356,1358,1359,1360,1354,
      1355,1356,1358,1359,1360,
 igr2=  31,  32,1352,
 &end
#
#    2 ILE  QG2           2 ILE  HG1+        2.60    (#     57:20  Unique         2.21, 3.26 A)
 &rst
  ixpk= 57, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=  27,  28,  29,
 igr2=  31,  32,
 &end
#
#   68 LEU  MDY          66 ARG  HG-         2.60    (#     58:20  Unique         1.96, 4.29 A)
 &rst
  ixpk= 58, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1073,1074,1075,1077,1078,1079,
 igr2=1028,1029,
 &end
#
#    2 ILE  QG2           2 ILE  QD1         2.60    (#     59:20  Unique         2.96, 4.30 A)
 &rst
  ixpk= 59, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1=  27,  28,  29,
 igr2=  34,  35,  36,
 &end
#
#    2 ILE  HG1+          2 ILE  QD1         2.60    (#     60:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 60, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=  31,  32,
 igr2=  34,  35,  36,
 &end
#
#    2 ILE  HG1-          2 ILE  QD1         2.60    (#     61:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 61, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=  31,  32,
 igr2=  34,  35,  36,
 &end
#
#    2 ILE  HB            2 ILE  QD1         3.50    (#     62:20  Unique         2.04, 2.86 A)
 &rst
  ixpk= 62, nxpk= 20, iat=  25,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=  34,  35,  36,
 &end
#
#    8 ARG  HB-           2 ILE  QD1         2.90    (#     63:20  Unique         3.16, 4.79 A)
 &rst
  ixpk= 63, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.91, r4= 4.66,
 igr1= 108, 109,
 igr2=  34,  35,  36,
 &end
#
#   90 PRO  HB+           2 ILE  QD1         5.50    (#     64:20  Unique         2.45, 4.65 A)
 &rst
  ixpk= 64, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1483,1484,
 igr2=  34,  35,  36,
 &end
#
#   92 CYS  HB+           2 ILE  QD1         2.60    (#     65:20  Unique         2.24, 3.99 A)
 &rst
  ixpk= 65, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1510,1511,
 igr2=  34,  35,  36,
 &end
#
#    0 AMB  20-2:66       0 AMB  20-1:66     5.50    (#     66:20  Double Ambig)
 &rst
  ixpk= 66, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1= 114, 115, 708,
 igr2=  34,  35,  36,1058,1059,1060,
 &end
#
#    0 AMB  20-2:67       2 ILE  QD1         5.50    (#     67:20  Single Ambig)
 &rst
  ixpk= 67, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=1477,1478,1366,
 igr2=  34,  35,  36,
 &end
#
#    6 GLY  HA-           2 ILE  QD1         4.40    (#     68:20  Unique         3.82, 6.03 A)
 &rst
  ixpk= 68, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  78,  79,
 igr2=  34,  35,  36,
 &end
#
#    0 AMB  20-2:69       2 ILE  QD1         3.50    (#     69:20  Single Ambig)
 &rst
  ixpk= 69, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=   6,  23,  78,  79,
 igr2=  34,  35,  36,
 &end
#
#    0 AMB  20-2:70       0 AMB  20-1:70     5.50    (#     70:20  Double Ambig)
 &rst
  ixpk= 70, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.70, r4=10.45,
 igr1= 129, 130, 723, 689, 690,
 igr2=  34,  35,  36,1058,1059,1060,
 &end
#
#    8 ARG  HA            2 ILE  QD1         5.50    (#     72:20  Unique         5.10, 5.82 A)
 &rst
  ixpk= 72, nxpk= 20, iat= 106,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=  34,  35,  36,
 &end
#
#    0 AMB  20-2:73       2 ILE  QD1         3.50    (#     73:20  Single Ambig)
 &rst
  ixpk= 73, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1506,1490,
 igr2=  34,  35,  36,
 &end
#
#   93 ILE  HN            2 ILE  QD1         5.50    (#     74:20  Unique         5.22, 6.56 A)
 &rst
  ixpk= 74, nxpk= 20, iat=1517,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=  34,  35,  36,
 &end
#
#    2 ILE  HG1+          2 ILE  QG2         2.60    (#     76:20  Unique         2.21, 3.26 A)
 &rst
  ixpk= 76, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=  31,  32,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:77       0 AMB  20-1:77     2.60    (#     77:20  Double Ambig)
 &rst
  ixpk= 77, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,
 igr1=  31,  32, 924,
 igr2=  27,  28,  29,1011,1012,1013,1015,1016,1017,
 &end
#
#    2 ILE  HB            2 ILE  QG2         2.60    (#     78:20  Unique         2.32, 2.63 A)
 &rst
  ixpk= 78, nxpk= 20, iat=  25,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=  27,  28,  29,
 &end
#
#   65 VAL  HB           65 VAL  MGX         2.60    (#     79:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 79, nxpk= 20, iat=1009,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#   90 PRO  HB+           2 ILE  QG2         4.40    (#     80:20  Unique         3.51, 5.35 A)
 &rst
  ixpk= 80, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1483,1484,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:81       0 AMB  20-1:81     3.50    (#     81:20  Double Ambig)
 &rst
  ixpk= 81, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=1510,1511,  56,  57, 769, 770, 957, 958,
 igr2=  27,  28,  29,1011,1012,1013,1015,1016,1017,
 &end
#
#   64 ASP  HB+          65 VAL  MGX         4.40    (#     82:20  Unique         2.82, 6.03 A)
 &rst
  ixpk= 82, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 997, 998,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:83       0 AMB  20-1:83     5.50    (#     83:20  Double Ambig)
 &rst
  ixpk= 83, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.53, r4=10.28,
 igr1=1477,1478,1812,
 igr2=  27,  28,  29,1011,1012,1013,1015,1016,1017,
 &end
#
#    6 GLY  HA-           2 ILE  QG2         3.50    (#     84:20  Unique         1.96, 3.39 A)
 &rst
  ixpk= 84, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  78,  79,
 igr2=  27,  28,  29,
 &end
#
#   62 ARG  HA           65 VAL  MGX         3.50    (#     85:20  Unique         2.07, 5.07 A)
 &rst
  ixpk= 85, nxpk= 20, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:86      65 VAL  MGX         4.40    (#     86:20  Single Ambig)
 &rst
  ixpk= 86, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=1047, 767,1759,1760,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:87       2 ILE  QG2         2.60    (#     87:20  Single Ambig)
 &rst
  ixpk= 87, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1=  78,  79,  23,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:90       0 AMB  20-1:90     4.40    (#     90:20  Double Ambig)
 &rst
  ixpk= 90, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1= 106,1667,
 igr2=  27,  28,  29,1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:91       2 ILE  QG2         2.60    (#     91:20  Single Ambig)
 &rst
  ixpk= 91, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=  40,  52,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:92       0 AMB  20-1:92     5.50    (#     92:20  Double Ambig)
 &rst
  ixpk= 92, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1720,1517,
 igr2=1011,1012,1013,1015,1016,1017,  27,  28,  29,
 &end
#
#   65 VAL  HA           65 VAL  MGX         3.50    (#     93:20  Unique         1.94, 3.36 A)
 &rst
  ixpk= 93, nxpk= 20, iat=1007,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#   51 TYR  HE           65 VAL  MGX         2.60    (#     94:20  Unique         3.72, 6.66 A)
 &rst
  ixpk= 94, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 775, 780,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:95      65 VAL  MGX         5.50    (#     95:20  Single Ambig)
 &rst
  ixpk= 95, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.25, r4=11.00,
 igr1= 773, 782,1034,1653,1661, 852, 860,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#   65 VAL  HN           65 VAL  MGX         2.60    (#     96:20  Unique         2.34, 4.15 A)
 &rst
  ixpk= 96, nxpk= 20, iat=1005,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#   64 ASP  HN           65 VAL  MGX         3.50    (#     97:20  Unique         3.34, 5.76 A)
 &rst
  ixpk= 97, nxpk= 20, iat= 993,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:99      60 LEU  HA          3.50    (#     99:20  Single Ambig)
 &rst
  ixpk= 99, nxpk= 20, iat=  -1, 919, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#    1 MET  ME            3 ASP  HA          3.50    (#    100:20  Unique         2.07, 3.24 A)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,  42, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=  15,  16,  17,
 &end
#
#    3 ASP  HB+           3 ASP  HA          2.60    (#    101:20  Unique         2.34, 2.69 A)
 &rst
  ixpk= 101, nxpk= 20, iat=  -1,  42, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=  44,  45,
 &end
#
#    0 AMB  20-2:102      3 ASP  HA          5.50    (#    102:20  Single Ambig)
 &rst
  ixpk= 102, nxpk= 20, iat=  -1,  42, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  23, 665, 666,   6,
 &end
#
#    0 AMB  20-2:104      3 ASP  HA          2.60    (#    104:20  Single Ambig)
 &rst
  ixpk= 104, nxpk= 20, iat=  -1,  42, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=  52,  40,
 &end
#
#   61 SER  HN           60 LEU  HA          4.40    (#    105:20  Unique         2.26, 2.31 A)
 &rst
  ixpk= 105, nxpk= 20, iat= 936, 919, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:107      0 AMB  20-1:107    2.60    (#    107:20  Double Ambig)
 &rst
  ixpk= 107, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=  52,  40,
 igr2=  44,  45,  44,  45,
 &end
#
#    5 ASP  HN            3 ASP  HB+         5.50    (#    108:20  Unique         2.14, 3.39 A)
 &rst
  ixpk= 108, nxpk= 20, iat=  64,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=  44,  45,
 &end
#
#    3 ASP  HA            3 ASP  HB+         2.60    (#    109:20  Unique         2.34, 2.69 A)
 &rst
  ixpk= 109, nxpk= 20, iat=  42,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=  44,  45,
 &end
#
#    0 AMB  20-2:110      0 AMB  20-1:110    3.50    (#    110:20  Double Ambig)
 &rst
  ixpk= 110, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=  56,  57,  11,  12,
 igr2=  44,  45,  44,  45,
 &end
#
#    4 ASP  HB-           4 ASP  HA          2.60    (#    111:20  Unique         2.39, 2.79 A)
 &rst
  ixpk= 111, nxpk= 20, iat=  -1,  54, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=  56,  57,
 &end
#
#    4 ASP  HB+           4 ASP  HA          2.60    (#    112:20  Unique         2.39, 2.79 A)
 &rst
  ixpk= 112, nxpk= 20, iat=  -1,  54, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=  56,  57,
 &end
#
#    3 ASP  HB+           4 ASP  HA          4.40    (#    113:20  Unique         3.93, 5.03 A)
 &rst
  ixpk= 113, nxpk= 20, iat=  -1,  54, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=  44,  45,
 &end
#
#    5 ASP  HN            4 ASP  HA          3.50    (#    114:20  Unique         3.17, 3.28 A)
 &rst
  ixpk= 114, nxpk= 20, iat=  64,  54, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    6 GLY  HN            4 ASP  HA          4.40    (#    115:20  Unique         3.53, 3.83 A)
 &rst
  ixpk= 115, nxpk= 20, iat=  76,  54, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    4 ASP  HN            4 ASP  HA          3.50    (#    116:20  Unique         2.79, 2.88 A)
 &rst
  ixpk= 116, nxpk= 20, iat=  52,  54, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    4 ASP  HN            4 ASP  HB+         3.50    (#    117:20  Unique         2.25, 2.68 A)
 &rst
  ixpk= 117, nxpk= 20, iat=  52,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  56,  57,
 &end
#
#    4 ASP  HN            4 ASP  HB-         3.50    (#    118:20  Unique         2.25, 2.68 A)
 &rst
  ixpk= 118, nxpk= 20, iat=  52,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  56,  57,
 &end
#
#    5 ASP  HN            4 ASP  HB-         5.50    (#    119:20  Unique         1.74, 3.78 A)
 &rst
  ixpk= 119, nxpk= 20, iat=  64,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=  56,  57,
 &end
#
#    5 ASP  HN            4 ASP  HB+         4.40    (#    120:20  Unique         1.74, 3.78 A)
 &rst
  ixpk= 120, nxpk= 20, iat=  64,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=  56,  57,
 &end
#
#    4 ASP  HA            4 ASP  HB+         2.60    (#    121:20  Unique         2.39, 2.79 A)
 &rst
  ixpk= 121, nxpk= 20, iat=  54,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=  56,  57,
 &end
#
#    4 ASP  HA            4 ASP  HB-         2.60    (#    122:20  Unique         2.39, 2.79 A)
 &rst
  ixpk= 122, nxpk= 20, iat=  54,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=  56,  57,
 &end
#
#   35 PHE  HA           35 PHE  HB-         3.50    (#    123:20  Unique         2.36, 2.78 A)
 &rst
  ixpk= 123, nxpk= 20, iat= 553,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 555, 556,
 &end
#
#    5 ASP  HA            4 ASP  HB+         4.40    (#    124:20  Unique         4.08, 5.07 A)
 &rst
  ixpk= 124, nxpk= 20, iat=  66,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=  56,  57,
 &end
#
#    0 AMB  20-2:127      0 AMB  20-1:127    2.60    (#    127:20  Double Ambig)
 &rst
  ixpk= 127, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1432,1433, 555, 556,
 igr2=1430, 553,
 &end
#
#    0 AMB  20-2:128      0 AMB  20-1:128    2.60    (#    128:20  Double Ambig)
 &rst
  ixpk= 128, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1432,1433,  68,  69,
 igr2=1430,  66,
 &end
#
#    5 ASP  HB+           5 ASP  HA          2.60    (#    129:20  Unique         2.32, 2.82 A)
 &rst
  ixpk= 129, nxpk= 20, iat=  -1,  66, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=  68,  69,
 &end
#
#    0 AMB  20-2:130     87 ASP  HA          4.40    (#    130:20  Single Ambig)
 &rst
  ixpk= 130, nxpk= 20, iat=  -1,1430, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1442,1406,
 &end
#
#   88 THR  HN           87 ASP  HA          3.50    (#    131:20  Unique         3.07, 3.10 A)
 &rst
  ixpk= 131, nxpk= 20, iat=1440,1430, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:132      0 AMB  20-1:132    3.50    (#    132:20  Double Ambig)
 &rst
  ixpk= 132, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=  64, 534,1404,
 igr2=  66, 553,1430,
 &end
#
#    6 GLY  HN            5 ASP  HA          3.50    (#    133:20  Unique         3.08, 3.34 A)
 &rst
  ixpk= 133, nxpk= 20, iat=  76,  66, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   87 ASP  HN           87 ASP  HA          3.50    (#    134:20  Unique         2.82, 2.88 A)
 &rst
  ixpk= 134, nxpk= 20, iat=1428,1430, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 ILE  QD1         108 ASP  HB+         5.50    (#    135:20  Unique         1.93, 3.50 A)
 &rst
  ixpk= 135, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1823,1824,1825,
 igr2=1777,1778,
 &end
#
#  143 VAL  MGX         142 ASP  HB+         4.40    (#    136:20  Unique         3.82, 6.33 A)
 &rst
  ixpk= 136, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2358,2359,2360,2362,2363,2364,
 igr2=2344,2345,
 &end
#
#    0 AMB  20-2:137      0 AMB  20-1:137    4.40    (#    137:20  Double Ambig)
 &rst
  ixpk= 137, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2356,2235,
 igr2=2344,2345,2344,2345,
 &end
#
#  142 ASP  HA          142 ASP  HB+         2.60    (#    138:20  Unique         2.31, 2.72 A)
 &rst
  ixpk= 138, nxpk= 20, iat=2342,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2344,2345,
 &end
#
#    5 ASP  HA            5 ASP  HB+         2.60    (#    139:20  Unique         2.32, 2.82 A)
 &rst
  ixpk= 139, nxpk= 20, iat=  66,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=  68,  69,
 &end
#
#    5 ASP  HA            5 ASP  HB-         2.60    (#    140:20  Unique         2.32, 2.82 A)
 &rst
  ixpk= 140, nxpk= 20, iat=  66,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=  68,  69,
 &end
#
#    7 TYR  HD            5 ASP  HB+         5.50    (#    141:20  Unique         2.73, 5.40 A)
 &rst
  ixpk= 141, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  91, 100,
 igr2=  68,  69,
 &end
#
#   73 ASN  HD2-         73 ASN  HB+         3.50    (#    142:20  Unique         2.21, 3.39 A)
 &rst
  ixpk= 142, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1151,1152,
 igr2=1146,1147,
 &end
#
#    5 ASP  HN            5 ASP  HB+         3.50    (#    144:20  Unique         2.11, 2.79 A)
 &rst
  ixpk= 144, nxpk= 20, iat=  64,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  68,  69,
 &end
#
#    0 AMB  20-2:145      0 AMB  20-1:145    2.60    (#    145:20  Double Ambig)
 &rst
  ixpk= 145, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2340,  76,
 igr2=2344,2345,  68,  69,
 &end
#
#    0 AMB  20-2:146      0 AMB  20-1:146    3.50    (#    146:20  Double Ambig)
 &rst
  ixpk= 146, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=  76,1785,
 igr2=  68,  69,1777,1778,
 &end
#
#    0 AMB  20-2:147      0 AMB  20-1:147    2.60    (#    147:20  Double Ambig)
 &rst
  ixpk= 147, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1773,1766,
 igr2=1768,1769,1768,1769,
 &end
#
#    0 AMB  20-2:148      0 AMB  20-1:148    2.60    (#    148:20  Double Ambig)
 &rst
  ixpk= 148, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 663,1517,
 igr2= 665, 666,  78,  79,
 &end
#
#   43 GLY  HN           43 GLY  HA+         2.60    (#    149:20  Unique         2.37, 2.71 A)
 &rst
  ixpk= 149, nxpk= 20, iat= 663,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 665, 666,
 &end
#
#    7 TYR  HN            6 GLY  HA+         3.50    (#    150:20  Unique         2.95, 3.25 A)
 &rst
  ixpk= 150, nxpk= 20, iat=  83,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  78,  79,
 &end
#
#    6 GLY  HN            6 GLY  HA-         3.50    (#    151:20  Unique         2.30, 2.65 A)
 &rst
  ixpk= 151, nxpk= 20, iat=  76,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  78,  79,
 &end
#
#    6 GLY  HN            6 GLY  HA+         2.60    (#    152:20  Unique         2.30, 2.65 A)
 &rst
  ixpk= 152, nxpk= 20, iat=  76,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=  78,  79,
 &end
#
#   44 GLU  HN           43 GLY  HA+         3.50    (#    153:20  Unique         2.90, 3.25 A)
 &rst
  ixpk= 153, nxpk= 20, iat= 670,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 665, 666,
 &end
#
#   44 GLU  HN           43 GLY  HA-         3.50    (#    154:20  Unique         2.90, 3.25 A)
 &rst
  ixpk= 154, nxpk= 20, iat= 670,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 665, 666,
 &end
#
#    2 ILE  QG2           6 GLY  HA-         2.60    (#    157:20  Unique         1.96, 3.39 A)
 &rst
  ixpk= 157, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=  27,  28,  29,
 igr2=  78,  79,
 &end
#
#   93 ILE  QD1           6 GLY  HA-         3.50    (#    158:20  Unique         1.98, 3.26 A)
 &rst
  ixpk= 158, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1530,1531,1532,
 igr2=  78,  79,
 &end
#
#   75 LEU  HN           74 TRP  HA          2.60    (#    159:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 159, nxpk= 20, iat=1180,1158, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    0 AMB  20-2:160      0 AMB  20-1:160    2.60    (#    160:20  Double Ambig)
 &rst
  ixpk= 160, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 104,1156,
 igr2=  85,1158,
 &end
#
#  130 TRP  HN          130 TRP  HA          3.50    (#    161:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 161, nxpk= 20, iat=2115,2117, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  130 TRP  HB+         130 TRP  HA          3.50    (#    163:20  Unique         2.23, 2.75 A)
 &rst
  ixpk= 163, nxpk= 20, iat=  -1,2117, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2119,2120,
 &end
#
#  130 TRP  HB-         130 TRP  HA          3.50    (#    164:20  Unique         2.23, 2.75 A)
 &rst
  ixpk= 164, nxpk= 20, iat=  -1,2117, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2119,2120,
 &end
#
#    7 TYR  HB+           7 TYR  HA          3.50    (#    165:20  Unique         2.63, 2.83 A)
 &rst
  ixpk= 165, nxpk= 20, iat=  -1,  85, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  87,  88,
 &end
#
#    0 AMB  20-2:166      0 AMB  20-1:166    4.40    (#    166:20  Double Ambig)
 &rst
  ixpk= 166, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1= 108, 109, 108, 109,2393,2394,2591,2592,2593,
 igr2=  85,2117,
 &end
#
#  133 VAL  MGY         130 TRP  HA          5.50    (#    167:20  Unique         1.99, 3.76 A)
 &rst
  ixpk= 167, nxpk= 20, iat=  -1,2117, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2180,2181,2182,2184,2185,2186,
 &end
#
#    7 TYR  HA            7 TYR  HB+         5.50    (#    168:20  Unique         2.63, 2.83 A)
 &rst
  ixpk= 168, nxpk= 20, iat=  85,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=  87,  88,
 &end
#
#    7 TYR  HD            7 TYR  HB-         5.50    (#    169:20  Unique         2.31, 3.05 A)
 &rst
  ixpk= 169, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  91, 100,
 igr2=  87,  88,
 &end
#
#    7 TYR  HD            7 TYR  HB+         4.40    (#    170:20  Unique         2.31, 3.05 A)
 &rst
  ixpk= 170, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=  91, 100,
 igr2=  87,  88,
 &end
#
#    7 TYR  HN            7 TYR  HB+         5.50    (#    171:20  Unique         2.12, 2.95 A)
 &rst
  ixpk= 171, nxpk= 20, iat=  83,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=  87,  88,
 &end
#
#    7 TYR  HN            7 TYR  HB-         5.50    (#    172:20  Unique         2.12, 2.95 A)
 &rst
  ixpk= 172, nxpk= 20, iat=  83,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=  87,  88,
 &end
#
#    0 AMB  20-2:174      0 AMB  20-1:174    2.60    (#    174:20  Double Ambig)
 &rst
  ixpk= 174, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=1710,1711,  15,  16,  17,
 igr2=1705, 106,
 &end
#
#    0 AMB  20-2:175      8 ARG  HA          2.60    (#    175:20  Single Ambig)
 &rst
  ixpk= 175, nxpk= 20, iat=  -1, 106, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 108, 109, 111, 112,
 &end
#
#    9 PRO  HD+           8 ARG  HA          2.60    (#    176:20  Unique         1.91, 2.22 A)
 &rst
  ixpk= 176, nxpk= 20, iat=  -1, 106, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 129, 130,
 &end
#
#  103 GLN  HB-         103 GLN  HA          3.50    (#    177:20  Unique         2.24, 2.62 A)
 &rst
  ixpk= 177, nxpk= 20, iat=  -1,1705, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1707,1708,
 &end
#
#    0 AMB  20-2:178      8 ARG  HA          4.40    (#    178:20  Single Ambig)
 &rst
  ixpk= 178, nxpk= 20, iat=  -1, 106, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 104,  40,
 &end
#
#  104 LEU  HN          103 GLN  HA          3.50    (#    179:20  Unique         2.14, 2.21 A)
 &rst
  ixpk= 179, nxpk= 20, iat=1720,1705, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  104 LEU  HN          103 GLN  HA          2.60    (#    180:20  Unique         2.14, 2.21 A)
 &rst
  ixpk= 180, nxpk= 20, iat=1720,1705, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  102 LEU  HN          103 GLN  HA          5.50    (#    181:20  Unique         4.71, 4.82 A)
 &rst
  ixpk= 181, nxpk= 20, iat=1684,1705, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    8 ARG  HN            0 AMB  20-1:182    3.50    (#    182:20  Single Ambig)
 &rst
  ixpk= 182, nxpk= 20, iat= 104,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 108, 109, 108, 109,
 &end
#
#    8 ARG  HN            8 ARG  HB+         3.50    (#    183:20  Unique         2.34, 2.74 A)
 &rst
  ixpk= 183, nxpk= 20, iat= 104,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 108, 109,
 &end
#
#  154 VAL  HN          154 VAL  HB          3.50    (#    184:20  Unique         2.39, 2.78 A)
 &rst
  ixpk= 184, nxpk= 20, iat=2548,2552, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  154 VAL  HN          154 VAL  HB          2.60    (#    185:20  Unique         2.39, 2.78 A)
 &rst
  ixpk= 185, nxpk= 20, iat=2548,2552, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    8 ARG  HA            8 ARG  HB+         4.40    (#    186:20  Unique         2.33, 2.69 A)
 &rst
  ixpk= 186, nxpk= 20, iat= 106,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 108, 109,
 &end
#
#    8 ARG  HA            0 AMB  20-1:187    5.50    (#    187:20  Single Ambig)
 &rst
  ixpk= 187, nxpk= 20, iat= 106,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr2= 108, 109, 108, 109,
 &end
#
#  163 PRO  HA          163 PRO  HB-         2.60    (#    188:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 188, nxpk= 20, iat=2697,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2694,2695,
 &end
#
#  154 VAL  HA          154 VAL  HB          3.50    (#    189:20  Unique         2.55, 2.97 A)
 &rst
  ixpk= 189, nxpk= 20, iat=2550,2552, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  163 PRO  HD-         163 PRO  HB-         3.50    (#    190:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 190, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2688,2689,
 igr2=2694,2695,
 &end
#
#    0 AMB  20-2:191      0 AMB  20-1:191    3.50    (#    191:20  Double Ambig)
 &rst
  ixpk= 191, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 114, 115, 114, 115,
 igr2= 108, 109, 108, 109,
 &end
#
#    0 AMB  20-2:192      0 AMB  20-1:192    3.50    (#    192:20  Double Ambig)
 &rst
  ixpk= 192, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 114, 115, 114, 115,
 igr2= 108, 109, 108, 109,
 &end
#
#  154 VAL  MGX         154 VAL  HB          2.60    (#    194:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 194, nxpk= 20, iat=  -1,2552, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:195      0 AMB  20-1:195    2.60    (#    195:20  Double Ambig)
 &rst
  ixpk= 195, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.90, r4= 5.65,
 igr1=2554,2555,2556,2558,2559,2560,  34,  35,  36,
 igr2=2552, 108, 109, 108, 109,
 &end
#
#  101 LEU  MDY         154 VAL  HB          2.60    (#    196:20  Unique         1.92, 4.16 A)
 &rst
  ixpk= 196, nxpk= 20, iat=  -1,2552, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:197      0 AMB  20-1:197    5.50    (#    197:20  Double Ambig)
 &rst
  ixpk= 197, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.69, r4=11.44,
 igr1=  27,  28,  29,1275,1276,1277,1279,1280,1281,
 igr2= 111, 112, 132, 133, 111, 112,
 &end
#
#   95 GLN  HB-           8 ARG  HG+         2.60    (#    198:20  Unique         3.00, 4.58 A)
 &rst
  ixpk= 198, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1547,1548,
 igr2= 111, 112,
 &end
#
#    8 ARG  HD-           8 ARG  HG+         3.50    (#    200:20  Unique         2.22, 2.73 A)
 &rst
  ixpk= 200, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 114, 115,
 igr2= 111, 112,
 &end
#
#    8 ARG  HD+           8 ARG  HG+         3.50    (#    201:20  Unique         2.22, 2.73 A)
 &rst
  ixpk= 201, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 114, 115,
 igr2= 111, 112,
 &end
#
#    0 AMB  20-2:203      0 AMB  20-1:203    5.50    (#    203:20  Double Ambig)
 &rst
  ixpk= 203, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 104,  40,
 igr2= 111, 112, 111, 112,
 &end
#
#   10 ASN  HN            8 ARG  HG+         5.50    (#    204:20  Unique         4.80, 5.57 A)
 &rst
  ixpk= 204, nxpk= 20, iat= 142,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 111, 112,
 &end
#
#    0 AMB  20-2:205      0 AMB  20-1:205    5.50    (#    205:20  Double Ambig)
 &rst
  ixpk= 205, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 104,1506,
 igr2= 114, 115, 114, 115,
 &end
#
#    0 AMB  20-2:206      0 AMB  20-1:206    5.50    (#    206:20  Double Ambig)
 &rst
  ixpk= 206, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 104,1506,  40,2470,
 igr2= 114, 115,2399,2400,
 &end
#
#    0 AMB  20-2:207      0 AMB  20-1:207    3.50    (#    207:20  Double Ambig)
 &rst
  ixpk= 207, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2128,2413,
 igr2=2399,2400,2399,2400,
 &end
#
#    0 AMB  20-2:208      0 AMB  20-1:208    5.50    (#    208:20  Double Ambig)
 &rst
  ixpk= 208, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2316, 616,2123,
 igr2=2399,2400, 114, 115,2399,2400,
 &end
#
#    0 AMB  20-2:210      0 AMB  20-1:210    5.50    (#    210:20  Double Ambig)
 &rst
  ixpk= 210, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 151, 152,1555,1556,
 igr2= 114, 115, 114, 115,
 &end
#
#    0 AMB  20-2:211      8 ARG  HD-         5.50    (#    211:20  Single Ambig)
 &rst
  ixpk= 211, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 151, 152,1555,1556,
 igr2= 114, 115,
 &end
#
#   95 GLN  HE2+          8 ARG  HD+         5.50    (#    212:20  Unique         3.72, 6.33 A)
 &rst
  ixpk= 212, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1555,1556,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:214      0 AMB  20-1:214    3.50    (#    214:20  Double Ambig)
 &rst
  ixpk= 214, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2192,  23,
 igr2=2399,2400, 114, 115,
 &end
#
#    0 AMB  20-2:215      0 AMB  20-1:215    4.40    (#    215:20  Double Ambig)
 &rst
  ixpk= 215, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2391,2265,
 igr2=2399,2400,2399,2400,
 &end
#
#    0 AMB  20-2:216      0 AMB  20-1:216    5.50    (#    216:20  Double Ambig)
 &rst
  ixpk= 216, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=   6,  23,
 igr2= 114, 115, 114, 115,
 &end
#
#    0 AMB  20-2:217      0 AMB  20-1:217    4.40    (#    217:20  Double Ambig)
 &rst
  ixpk= 217, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1106,1519, 659,
 igr2=1128,1129, 114, 115,
 &end
#
#    9 PRO  HD+           8 ARG  HD+         5.50    (#    218:20  Unique         5.20, 6.36 A)
 &rst
  ixpk= 218, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 129, 130,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:219      0 AMB  20-1:219    2.60    (#    219:20  Double Ambig)
 &rst
  ixpk= 219, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 111, 112, 108, 109,
 igr2= 114, 115, 114, 115,
 &end
#
#    0 AMB  20-2:220      0 AMB  20-1:220    2.60    (#    220:20  Double Ambig)
 &rst
  ixpk= 220, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2393,2394, 111, 112, 108, 109,
 igr2=2399,2400, 114, 115,
 &end
#
#   95 GLN  HB-           8 ARG  HD+         3.50    (#    221:20  Unique         3.84, 4.79 A)
 &rst
  ixpk= 221, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1547,1548,
 igr2= 114, 115,
 &end
#
#    2 ILE  QD1           8 ARG  HD+         4.40    (#    222:20  Unique         3.10, 5.26 A)
 &rst
  ixpk= 222, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  34,  35,  36,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:223      8 ARG  HD-         3.50    (#    223:20  Single Ambig)
 &rst
  ixpk= 223, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1=  27,  28,  29,1275,1276,1277,1279,1280,1281,1567,
      1568,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:224      0 AMB  20-1:224    2.60    (#    224:20  Double Ambig)
 &rst
  ixpk= 224, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 igr2=2399,2400,2399,2400,
 &end
#
#    0 AMB  20-2:225      0 AMB  20-1:225    2.60    (#    225:20  Double Ambig)
 &rst
  ixpk= 225, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2396,2397,2197,2198,
 igr2=2399,2400,2399,2400,
 &end
#
#    0 AMB  20-2:226      0 AMB  20-1:226    2.60    (#    226:20  Double Ambig)
 &rst
  ixpk= 226, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2396,2397,2323,2324,
 igr2=2399,2400,2399,2400,
 &end
#
#   96 LYS  HG+           9 PRO  HA          5.50    (#    227:20  Unique         1.98, 3.80 A)
 &rst
  ixpk= 227, nxpk= 20, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1567,1568,
 &end
#
#    9 PRO  HB-           9 PRO  HA          3.50    (#    228:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 228, nxpk= 20, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 135, 136,
 &end
#
#    0 AMB  20-2:229      9 PRO  HA          4.40    (#    229:20  Single Ambig)
 &rst
  ixpk= 229, nxpk= 20, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 135, 136,1573,1574,
 &end
#
#    0 AMB  20-2:230      9 PRO  HA          4.40    (#    230:20  Single Ambig)
 &rst
  ixpk= 230, nxpk= 20, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 132, 133,1612,1613, 108, 109, 108, 109,
 &end
#
#   10 ASN  HN            9 PRO  HA          3.50    (#    231:20  Unique         2.15, 2.19 A)
 &rst
  ixpk= 231, nxpk= 20, iat= 142, 138, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   96 LYS  HN            9 PRO  HA          5.50    (#    232:20  Unique         2.38, 2.64 A)
 &rst
  ixpk= 232, nxpk= 20, iat=1560, 138, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   40 ILE  HN            9 PRO  HA          5.50    (#    233:20  Unique         4.77, 4.98 A)
 &rst
  ixpk= 233, nxpk= 20, iat= 616, 138, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:234     81 LYS  HB-         2.60    (#    234:20  Single Ambig)
 &rst
  ixpk= 234, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1306,1307,1368,
 igr2=1303,1304,
 &end
#
#   81 LYS  HD+          81 LYS  HB-         2.60    (#    235:20  Unique         2.20, 3.42 A)
 &rst
  ixpk= 235, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1309,1310,
 igr2=1303,1304,
 &end
#
#    0 AMB  20-2:237      0 AMB  20-1:237    2.60    (#    237:20  Double Ambig)
 &rst
  ixpk= 237, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 592, 593, 132, 133,
 igr2= 589, 590, 135, 136,
 &end
#
#   81 LYS  HA           81 LYS  HB-         2.60    (#    238:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 238, nxpk= 20, iat=1301,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1303,1304,
 &end
#
#    0 AMB  20-2:239      0 AMB  20-1:239    3.50    (#    239:20  Double Ambig)
 &rst
  ixpk= 239, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 151, 152,1171, 151, 152,
 igr2= 135, 136, 135, 136, 589, 590,
 &end
#
#    9 PRO  HA            9 PRO  HG-         5.50    (#    244:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 244, nxpk= 20, iat= 138,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 132, 133,
 &end
#
#    9 PRO  HA            9 PRO  HG+         5.50    (#    245:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 245, nxpk= 20, iat= 138,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 132, 133,
 &end
#
#  163 PRO  HA          163 PRO  HG-         4.40    (#    246:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 246, nxpk= 20, iat=2697,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2691,2692,
 &end
#
#    9 PRO  HD+           9 PRO  HG-         2.60    (#    247:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 247, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 129, 130,
 igr2= 132, 133,
 &end
#
#    9 PRO  HD+           9 PRO  HG+         3.50    (#    248:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 248, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 129, 130,
 igr2= 132, 133,
 &end
#
#  163 PRO  HD+         163 PRO  HG-         2.60    (#    249:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 249, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2688,2689,
 igr2=2691,2692,
 &end
#
#  163 PRO  HD-         163 PRO  HG-         3.50    (#    250:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 250, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2688,2689,
 igr2=2691,2692,
 &end
#
#    9 PRO  HB+           9 PRO  HG+         3.50    (#    251:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 251, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 135, 136,
 igr2= 132, 133,
 &end
#
#   40 ILE  HB            9 PRO  HG+         5.50    (#    253:20  Unique         2.00, 2.90 A)
 &rst
  ixpk= 253, nxpk= 20, iat= 620,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 132, 133,
 &end
#
#    0 AMB  20-2:254      9 PRO  HG-         4.40    (#    254:20  Single Ambig)
 &rst
  ixpk= 254, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 622, 623, 624, 629, 630, 631,
 igr2= 132, 133,
 &end
#
#   40 ILE  QD1           9 PRO  HG+         4.40    (#    255:20  Unique         3.88, 5.24 A)
 &rst
  ixpk= 255, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 629, 630, 631,
 igr2= 132, 133,
 &end
#
#    0 AMB  20-2:256      0 AMB  20-1:256    2.60    (#    256:20  Double Ambig)
 &rst
  ixpk= 256, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 132, 133, 108, 109,
 igr2= 129, 130, 129, 130,
 &end
#
#    0 AMB  20-2:257      0 AMB  20-1:257    3.50    (#    257:20  Double Ambig)
 &rst
  ixpk= 257, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 135, 136,  87,  88,1573,1574,
 igr2= 129, 130, 129, 130, 129, 130,
 &end
#
#    9 PRO  HG+           9 PRO  HD+         3.50    (#    258:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 258, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 132, 133,
 igr2= 129, 130,
 &end
#
#    0 AMB  20-2:259      0 AMB  20-1:259    4.40    (#    259:20  Double Ambig)
 &rst
  ixpk= 259, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=  23,   6,
 igr2= 129, 130, 129, 130,
 &end
#
#    8 ARG  HA            9 PRO  HD+         2.60    (#    261:20  Unique         1.91, 2.22 A)
 &rst
  ixpk= 261, nxpk= 20, iat= 106,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 129, 130,
 &end
#
#    0 AMB  20-2:262      0 AMB  20-1:262    4.40    (#    262:20  Double Ambig)
 &rst
  ixpk= 262, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=  40,  52, 104,
 igr2= 129, 130, 129, 130, 129, 130,
 &end
#
#   11 VAL  HN           10 ASN  HA          2.60    (#    263:20  Unique         2.20, 2.30 A)
 &rst
  ixpk= 263, nxpk= 20, iat= 156, 144, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   40 ILE  HN           10 ASN  HA          3.50    (#    264:20  Unique         1.97, 2.66 A)
 &rst
  ixpk= 264, nxpk= 20, iat= 616, 144, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   10 ASN  HD2+         10 ASN  HA          4.40    (#    265:20  Unique         2.20, 3.07 A)
 &rst
  ixpk= 265, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 151, 152,
 &end
#
#   39 GLY  HA+          10 ASN  HA          3.50    (#    266:20  Unique         1.82, 2.70 A)
 &rst
  ixpk= 266, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 611, 612,
 &end
#
#   39 GLY  HA-          10 ASN  HA          4.40    (#    267:20  Unique         1.82, 2.70 A)
 &rst
  ixpk= 267, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 611, 612,
 &end
#
#   10 ASN  HB-          10 ASN  HA          3.50    (#    268:20  Unique         2.67, 2.84 A)
 &rst
  ixpk= 268, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 146, 147,
 &end
#
#   10 ASN  HB+          10 ASN  HA          4.40    (#    269:20  Unique         2.67, 2.84 A)
 &rst
  ixpk= 269, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 146, 147,
 &end
#
#   40 ILE  HG1-         10 ASN  HA          3.50    (#    270:20  Unique         2.59, 4.06 A)
 &rst
  ixpk= 270, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 626, 627,
 &end
#
#   40 ILE  QD1          10 ASN  HA          5.50    (#    271:20  Unique         3.95, 5.23 A)
 &rst
  ixpk= 271, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 629, 630, 631,
 &end
#
#   40 ILE  HG1+         10 ASN  HA          5.50    (#    272:20  Unique         2.59, 4.06 A)
 &rst
  ixpk= 272, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 626, 627,
 &end
#
#   11 VAL  MGX          10 ASN  HA          5.50    (#    273:20  Unique         3.20, 5.07 A)
 &rst
  ixpk= 273, nxpk= 20, iat=  -1, 144, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGY          10 ASN  HB-         5.50    (#    274:20  Unique         4.85, 6.53 A)
 &rst
  ixpk= 274, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 146, 147,
 &end
#
#   97 GLN  HG+          10 ASN  HB-         3.50    (#    275:20  Unique         1.98, 3.58 A)
 &rst
  ixpk= 275, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1589,1590,
 igr2= 146, 147,
 &end
#
#    0 AMB  20-2:276     10 ASN  HB-         3.50    (#    276:20  Single Ambig)
 &rst
  ixpk= 276, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1589,1590,1550,1551,
 igr2= 146, 147,
 &end
#
#    0 AMB  20-2:277      0 AMB  20-1:277    3.50    (#    277:20  Double Ambig)
 &rst
  ixpk= 277, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1589,1590,1550,1551,
 igr2= 146, 147, 146, 147,
 &end
#
#   97 GLN  HG+          10 ASN  HB+         3.50    (#    278:20  Unique         1.98, 3.58 A)
 &rst
  ixpk= 278, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1589,1590,
 igr2= 146, 147,
 &end
#
#    0 AMB  20-2:279      0 AMB  20-1:279    5.50    (#    279:20  Double Ambig)
 &rst
  ixpk= 279, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1586,1587, 135, 136,
 igr2= 146, 147, 146, 147,
 &end
#
#   10 ASN  HA           10 ASN  HB+         3.50    (#    281:20  Unique         2.67, 2.84 A)
 &rst
  ixpk= 281, nxpk= 20, iat= 144,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 146, 147,
 &end
#
#   10 ASN  HA           10 ASN  HB-         3.50    (#    282:20  Unique         2.67, 2.84 A)
 &rst
  ixpk= 282, nxpk= 20, iat= 144,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 146, 147,
 &end
#
#   10 ASN  HD2-         10 ASN  HB-         5.50    (#    283:20  Unique         2.46, 3.47 A)
 &rst
  ixpk= 283, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 151, 152,
 igr2= 146, 147,
 &end
#
#   10 ASN  HD2-         10 ASN  HB+         5.50    (#    284:20  Unique         2.46, 3.47 A)
 &rst
  ixpk= 284, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 151, 152,
 igr2= 146, 147,
 &end
#
#   10 ASN  HD2+         10 ASN  HB-         5.50    (#    285:20  Unique         2.46, 3.47 A)
 &rst
  ixpk= 285, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 151, 152,
 igr2= 146, 147,
 &end
#
#   10 ASN  HD2+         10 ASN  HB+         4.40    (#    286:20  Unique         2.46, 3.47 A)
 &rst
  ixpk= 286, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 151, 152,
 igr2= 146, 147,
 &end
#
#    0 AMB  20-2:287     10 ASN  HB-         5.50    (#    287:20  Single Ambig)
 &rst
  ixpk= 287, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1560, 602,
 igr2= 146, 147,
 &end
#
#   11 VAL  HN           10 ASN  HB-         3.50    (#    288:20  Unique         2.67, 3.49 A)
 &rst
  ixpk= 288, nxpk= 20, iat= 156,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 146, 147,
 &end
#
#   11 VAL  HN           10 ASN  HB+         4.40    (#    289:20  Unique         2.67, 3.49 A)
 &rst
  ixpk= 289, nxpk= 20, iat= 156,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 146, 147,
 &end
#
#   10 ASN  HN           10 ASN  HB+         5.50    (#    290:20  Unique         2.43, 3.06 A)
 &rst
  ixpk= 290, nxpk= 20, iat= 142,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 146, 147,
 &end
#
#   10 ASN  HN           10 ASN  HB-         5.50    (#    291:20  Unique         2.43, 3.06 A)
 &rst
  ixpk= 291, nxpk= 20, iat= 142,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 146, 147,
 &end
#
#   11 VAL  HN           11 VAL  HA          4.40    (#    292:20  Unique         2.93, 2.94 A)
 &rst
  ixpk= 292, nxpk= 20, iat= 156, 158, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   98 LYS  HN           11 VAL  HA          3.50    (#    293:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 293, nxpk= 20, iat=1599, 158, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   12 GLY  HN           11 VAL  HA          2.60    (#    294:20  Unique         2.19, 2.25 A)
 &rst
  ixpk= 294, nxpk= 20, iat= 172, 158, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    0 AMB  20-2:295     11 VAL  HA          5.50    (#    295:20  Single Ambig)
 &rst
  ixpk= 295, nxpk= 20, iat=  -1, 158, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1653,1661,1171,
 &end
#
#   97 GLN  HA           11 VAL  HA          5.50    (#    296:20  Unique         3.95, 4.30 A)
 &rst
  ixpk= 296, nxpk= 20, iat=1584, 158, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   11 VAL  HB           11 VAL  HA          3.50    (#    297:20  Unique         2.61, 2.74 A)
 &rst
  ixpk= 297, nxpk= 20, iat= 160, 158, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:298     11 VAL  HA          5.50    (#    298:20  Single Ambig)
 &rst
  ixpk= 298, nxpk= 20, iat=  -1, 158, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 626, 627, 700, 701, 702, 742, 743, 744,
 &end
#
#   11 VAL  MGY          11 VAL  HA          2.60    (#    299:20  Unique         2.05, 3.29 A)
 &rst
  ixpk= 299, nxpk= 20, iat=  -1, 158, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HB+          11 VAL  HA          5.50    (#    300:20  Unique         1.94, 2.99 A)
 &rst
  ixpk= 300, nxpk= 20, iat=  -1, 158, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1603,1604,
 &end
#
#   11 VAL  MGX          11 VAL  HA          3.50    (#    301:20  Unique         2.05, 3.29 A)
 &rst
  ixpk= 301, nxpk= 20, iat=  -1, 158, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGX          11 VAL  HB          2.60    (#    302:20  Unique         2.26, 2.63 A)
 &rst
  ixpk= 302, nxpk= 20, iat=  -1, 160, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGY          11 VAL  HB          2.60    (#    303:20  Unique         2.26, 2.63 A)
 &rst
  ixpk= 303, nxpk= 20, iat=  -1, 160, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:304     11 VAL  HB          5.50    (#    304:20  Single Ambig)
 &rst
  ixpk= 304, nxpk= 20, iat=  -1, 160, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1= 192, 193, 194,1606,1607, 189, 190,
 &end
#
#   98 LYS  HB+          11 VAL  HB          3.50    (#    305:20  Unique         3.64, 4.71 A)
 &rst
  ixpk= 305, nxpk= 20, iat=  -1, 160, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1603,1604,
 &end
#
#    0 AMB  20-2:306     11 VAL  HB          3.50    (#    306:20  Single Ambig)
 &rst
  ixpk= 306, nxpk= 20, iat=  -1, 160, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 626, 627, 742, 743, 744,
 &end
#
#   11 VAL  HA           11 VAL  HB          2.60    (#    307:20  Unique         2.61, 2.74 A)
 &rst
  ixpk= 307, nxpk= 20, iat= 158, 160, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    0 AMB  20-2:308     11 VAL  HB          3.50    (#    308:20  Single Ambig)
 &rst
  ixpk= 308, nxpk= 20, iat=  -1, 160, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1653,1661, 773, 782,
 &end
#
#   12 GLY  HN           11 VAL  HB          3.50    (#    309:20  Unique         2.63, 3.29 A)
 &rst
  ixpk= 309, nxpk= 20, iat= 172, 160, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   11 VAL  HN           11 VAL  HB          5.50    (#    310:20  Unique         2.53, 3.36 A)
 &rst
  ixpk= 310, nxpk= 20, iat= 156, 160, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   50 MET  HA           11 VAL  MGX         3.50    (#    312:20  Unique         1.95, 4.16 A)
 &rst
  ixpk= 312, nxpk= 20, iat= 750,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:313     11 VAL  MGX         4.40    (#    313:20  Single Ambig)
 &rst
  ixpk= 313, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 158, 144,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:314     11 VAL  MGX         3.50    (#    314:20  Single Ambig)
 &rst
  ixpk= 314, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1653,1661, 773, 782,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   12 GLY  HN           11 VAL  MGX         4.40    (#    315:20  Unique         2.38, 4.33 A)
 &rst
  ixpk= 315, nxpk= 20, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HN           11 VAL  MGY         3.50    (#    316:20  Unique         2.21, 3.81 A)
 &rst
  ixpk= 316, nxpk= 20, iat= 156,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   38 GLY  HN           11 VAL  MGY         4.40    (#    317:20  Unique         1.98, 5.33 A)
 &rst
  ixpk= 317, nxpk= 20, iat= 602,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   50 MET  HN           11 VAL  MGY         3.50    (#    318:20  Unique         2.97, 4.60 A)
 &rst
  ixpk= 318, nxpk= 20, iat= 748,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   49 ALA  HN           11 VAL  MGY         3.50    (#    319:20  Unique         4.29, 6.10 A)
 &rst
  ixpk= 319, nxpk= 20, iat= 738,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   12 GLY  HN           11 VAL  MGY         3.50    (#    320:20  Unique         2.38, 4.33 A)
 &rst
  ixpk= 320, nxpk= 20, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:321     11 VAL  MGY         3.50    (#    321:20  Single Ambig)
 &rst
  ixpk= 321, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1653,1661,1171,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#  100 PHE  HE           11 VAL  MGY         3.50    (#    322:20  Unique         4.37, 8.76 A)
 &rst
  ixpk= 322, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1655,1659,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HA           11 VAL  MGY         2.60    (#    323:20  Unique         2.05, 3.29 A)
 &rst
  ixpk= 323, nxpk= 20, iat= 158,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:325     11 VAL  MGY         3.50    (#    325:20  Single Ambig)
 &rst
  ixpk= 325, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 611, 612, 604, 605,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   46 ALA  HA           11 VAL  MGY         2.60    (#    326:20  Unique         2.69, 4.54 A)
 &rst
  ixpk= 326, nxpk= 20, iat= 698,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   50 MET  HA           11 VAL  MGY         4.40    (#    327:20  Unique         1.95, 4.16 A)
 &rst
  ixpk= 327, nxpk= 20, iat= 750,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:328     11 VAL  MGY         4.40    (#    328:20  Single Ambig)
 &rst
  ixpk= 328, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1= 674, 675,1589,1590, 883, 884,1586,1587,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HG+          11 VAL  MGY         3.50    (#    330:20  Unique         1.96, 5.21 A)
 &rst
  ixpk= 330, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1606,1607,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HB-          11 VAL  MGY         4.40    (#    331:20  Unique         1.97, 4.54 A)
 &rst
  ixpk= 331, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1603,1604,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HB           11 VAL  MGY         2.60    (#    332:20  Unique         2.26, 2.63 A)
 &rst
  ixpk= 332, nxpk= 20, iat= 160,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:333     11 VAL  MGY         2.60    (#    333:20  Single Ambig)
 &rst
  ixpk= 333, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 626, 627, 742, 743, 744,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:334      0 AMB  20-1:334    4.40    (#    334:20  Double Ambig)
 &rst
  ixpk= 334, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.42, r4=10.17,
 igr1= 185, 186, 187, 227, 228, 229, 834, 835, 836, 838,
       839, 840,
 igr2= 174, 175, 174, 175, 174, 175, 174, 175,
 &end
#
#   37 GLN  HA            0 AMB  20-1:335    5.50    (#    335:20  Single Ambig)
 &rst
  ixpk= 335, nxpk= 20, iat= 587,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr2= 174, 175, 174, 175,
 &end
#
#   13 ILE  HN           13 ILE  HB          4.40    (#    341:20  Unique         2.50, 2.79 A)
 &rst
  ixpk= 341, nxpk= 20, iat= 179, 183, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:343     13 ILE  HB          2.60    (#    343:20  Single Ambig)
 &rst
  ixpk= 343, nxpk= 20, iat=  -1, 183, r1= 0.00, r2= 1.80, r3= 3.88, r4= 4.63,
 igr1= 185, 186, 187, 834, 835, 836, 838, 839, 840, 224,
       225,
 &end
#
#    0 AMB  20-2:344     13 ILE  HB          3.50    (#    344:20  Single Ambig)
 &rst
  ixpk= 344, nxpk= 20, iat=  -1, 183, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 192, 193, 194, 189, 190,
 &end
#
#    0 AMB  20-2:345     13 ILE  HG1-        3.50    (#    345:20  Single Ambig)
 &rst
  ixpk= 345, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 185, 186, 187, 834, 835, 836, 838, 839, 840,
 igr2= 189, 190,
 &end
#
#    0 AMB  20-2:346      0 AMB  20-1:346    2.60    (#    346:20  Double Ambig)
 &rst
  ixpk= 346, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 185, 186, 187, 834, 835, 836, 838, 839, 840, 834,
       835, 836, 838, 839, 840,
 igr2= 189, 190, 189, 190, 189, 190,
 &end
#
#   13 ILE  HN           13 ILE  HG1-        5.50    (#    347:20  Unique         1.85, 3.22 A)
 &rst
  ixpk= 347, nxpk= 20, iat= 179,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 189, 190,
 &end
#
#   54 LEU  HN           13 ILE  QD1         4.40    (#    348:20  Unique         3.34, 4.66 A)
 &rst
  ixpk= 348, nxpk= 20, iat= 825,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:349     13 ILE  QD1         4.40    (#    349:20  Single Ambig)
 &rst
  ixpk= 349, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 602, 879,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:350     13 ILE  QD1         5.50    (#    350:20  Single Ambig)
 &rst
  ixpk= 350, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 748, 786,
 igr2= 192, 193, 194,
 &end
#
#   13 ILE  HN           13 ILE  QD1         4.40    (#    351:20  Unique         1.99, 3.51 A)
 &rst
  ixpk= 351, nxpk= 20, iat= 179,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 192, 193, 194,
 &end
#
#    7 TYR  HE           93 ILE  QD1         3.50    (#    353:20  Unique         3.00, 5.84 A)
 &rst
  ixpk= 353, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  93,  98,
 igr2=1530,1531,1532,
 &end
#
#    7 TYR  HD           93 ILE  QD1         4.40    (#    354:20  Unique         2.56, 5.56 A)
 &rst
  ixpk= 354, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  91, 100,
 igr2=1530,1531,1532,
 &end
#
#   50 MET  HA           13 ILE  QD1         4.40    (#    356:20  Unique         2.80, 3.69 A)
 &rst
  ixpk= 356, nxpk= 20, iat= 750,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:357      0 AMB  20-1:357    3.50    (#    357:20  Double Ambig)
 &rst
  ixpk= 357, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=  78,  79, 827,
 igr2=1530,1531,1532, 192, 193, 194,
 &end
#
#   57 GLU  HG+          13 ILE  QD1         4.40    (#    358:20  Unique         2.28, 4.94 A)
 &rst
  ixpk= 358, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 886, 887,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:359     13 ILE  QD1         2.60    (#    359:20  Single Ambig)
 &rst
  ixpk= 359, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.08, r4= 4.83,
 igr1= 755, 756, 183, 829, 830,
 igr2= 192, 193, 194,
 &end
#
#   54 LEU  HB+          13 ILE  QD1         2.60    (#    360:20  Unique         2.52, 4.85 A)
 &rst
  ixpk= 360, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 829, 830,
 igr2= 192, 193, 194,
 &end
#
#   13 ILE  HG1-         13 ILE  QD1         2.60    (#    362:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 362, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 189, 190,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:364     13 ILE  QG2         2.60    (#    364:20  Single Ambig)
 &rst
  ixpk= 364, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.08, r4= 4.83,
 igr1= 192, 193, 194, 189, 190,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:365     13 ILE  QG2         2.60    (#    365:20  Single Ambig)
 &rst
  ixpk= 365, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.08, r4= 4.83,
 igr1= 189, 190, 350, 351, 352,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:366     13 ILE  QG2         3.50    (#    366:20  Single Ambig)
 &rst
  ixpk= 366, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 829, 830, 755, 756, 183,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:367      0 AMB  20-1:367    3.50    (#    367:20  Double Ambig)
 &rst
  ixpk= 367, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 578, 579, 975, 976,1707,1708, 160,1799,1800,
 igr2= 185, 186, 187,1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:368     13 ILE  QG2         3.50    (#    368:20  Single Ambig)
 &rst
  ixpk= 368, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 829, 830, 817, 818,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:369      0 AMB  20-1:369    2.60    (#    369:20  Double Ambig)
 &rst
  ixpk= 369, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,
 igr1=1743, 575, 576,
 igr2=1745,1746,1747,1749,1750,1751, 185, 186, 187,
 &end
#
#    0 AMB  20-2:370     13 ILE  QG2         5.50    (#    370:20  Single Ambig)
 &rst
  ixpk= 370, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1= 886, 887, 898,
 igr2= 185, 186, 187,
 &end
#
#  100 PHE  HB+          13 ILE  QG2         5.50    (#    371:20  Unique         4.58, 6.40 A)
 &rst
  ixpk= 371, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1649,1650,
 igr2= 185, 186, 187,
 &end
#
#   66 ARG  HD+         105 VAL  MGX         4.40    (#    372:20  Unique         2.00, 4.95 A)
 &rst
  ixpk= 372, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1031,1032,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#   50 MET  HA           11 VAL  MGX         2.60    (#    373:20  Unique         1.95, 4.16 A)
 &rst
  ixpk= 373, nxpk= 20, iat= 750,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#  106 SER  HB-         105 VAL  MGX         5.50    (#    374:20  Unique         3.01, 6.05 A)
 &rst
  ixpk= 374, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1759,1760,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#  106 SER  HB+         105 VAL  MGX         4.40    (#    375:20  Unique         3.01, 6.05 A)
 &rst
  ixpk= 375, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1759,1760,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:376      0 AMB  20-1:376    4.40    (#    376:20  Double Ambig)
 &rst
  ixpk= 376, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.55, r4= 9.30,
 igr1= 973, 174, 175, 358,1768,1769,
 igr2=1745,1746,1747,1749,1750,1751, 185, 186, 187,
 &end
#
#  105 VAL  HA          105 VAL  MGX         2.60    (#    377:20  Unique         2.26, 3.31 A)
 &rst
  ixpk= 377, nxpk= 20, iat=1741,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#   65 VAL  HA          105 VAL  MGX         2.60    (#    379:20  Unique         2.01, 4.50 A)
 &rst
  ixpk= 379, nxpk= 20, iat=1007,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:380     11 VAL  MGX         3.50    (#    380:20  Single Ambig)
 &rst
  ixpk= 380, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 158, 144,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:381      0 AMB  20-1:381    4.40    (#    381:20  Double Ambig)
 &rst
  ixpk= 381, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1623, 138,
 igr2= 162, 163, 164, 166, 167, 168, 185, 186, 187,
 &end
#
#    0 AMB  20-2:382      0 AMB  20-1:382    3.50    (#    382:20  Double Ambig)
 &rst
  ixpk= 382, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1653,1661, 773, 782,
 igr2= 162, 163, 164, 166, 167, 168, 185, 186, 187,
 &end
#
#   65 VAL  HN          105 VAL  MGX         3.50    (#    383:20  Unique         2.91, 5.09 A)
 &rst
  ixpk= 383, nxpk= 20, iat=1005,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#  106 SER  HN          105 VAL  MGX         3.50    (#    384:20  Unique         1.97, 4.04 A)
 &rst
  ixpk= 384, nxpk= 20, iat=1755,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:385      0 AMB  20-1:385    3.50    (#    385:20  Double Ambig)
 &rst
  ixpk= 385, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 179, 993,
 igr2= 185, 186, 187,1745,1746,1747,1749,1750,1751,
 &end
#
#   50 MET  HN           11 VAL  MGX         3.50    (#    386:20  Unique         2.97, 4.60 A)
 &rst
  ixpk= 386, nxpk= 20, iat= 748,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:387    105 VAL  MGX         3.50    (#    387:20  Single Ambig)
 &rst
  ixpk= 387, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1021,1766,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#   38 GLY  HN           11 VAL  MGX         3.50    (#    388:20  Unique         1.98, 5.33 A)
 &rst
  ixpk= 388, nxpk= 20, iat= 602,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#  105 VAL  HN          105 VAL  MGX         2.60    (#    389:20  Unique         1.95, 3.67 A)
 &rst
  ixpk= 389, nxpk= 20, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#   14 VAL  HN           13 ILE  QG2         2.60    (#    390:20  Unique         2.79, 3.90 A)
 &rst
  ixpk= 390, nxpk= 20, iat= 198,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:391      0 AMB  20-1:391    2.60    (#    391:20  Double Ambig)
 &rst
  ixpk= 391, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 156, 214,
 igr2= 162, 163, 164, 166, 167, 168, 185, 186, 187,
 &end
#
#   15 ILE  HN           14 VAL  HA          3.50    (#    392:20  Unique         2.16, 2.20 A)
 &rst
  ixpk= 392, nxpk= 20, iat= 214, 200, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  138 SER  HN          138 SER  HA          4.40    (#    393:20  Unique         2.76, 2.82 A)
 &rst
  ixpk= 393, nxpk= 20, iat=2263,2265, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   14 VAL  HB           14 VAL  HA          5.50    (#    394:20  Unique         3.00, 3.01 A)
 &rst
  ixpk= 394, nxpk= 20, iat= 202, 200, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   14 VAL  MGY          14 VAL  HA          3.50    (#    395:20  Unique         2.16, 3.12 A)
 &rst
  ixpk= 395, nxpk= 20, iat=  -1, 200, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  MGX          14 VAL  HA          3.50    (#    396:20  Unique         2.16, 3.12 A)
 &rst
  ixpk= 396, nxpk= 20, iat=  -1, 200, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  MGX          14 VAL  HB          3.50    (#    397:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 397, nxpk= 20, iat=  -1, 202, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  MGY          14 VAL  HB          2.60    (#    398:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 398, nxpk= 20, iat=  -1, 202, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:399      0 AMB  20-1:399    4.40    (#    399:20  Double Ambig)
 &rst
  ixpk= 399, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.91, r4= 7.66,
 igr1=  25,2457,2458,2496,2497,
 igr2= 108, 109, 202,
 &end
#
#    0 AMB  20-2:400      0 AMB  20-1:400    3.50    (#    400:20  Double Ambig)
 &rst
  ixpk= 400, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 812,1538,1539,
 igr2= 817, 818,1547,1548,
 &end
#
#  101 LEU  HA           14 VAL  HB          3.50    (#    401:20  Unique         1.97, 2.48 A)
 &rst
  ixpk= 401, nxpk= 20, iat=1667, 202, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   95 GLN  HA            0 AMB  20-1:402    5.50    (#    402:20  Single Ambig)
 &rst
  ixpk= 402, nxpk= 20, iat=1545,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr2=1547,1548, 108, 109,
 &end
#
#    0 AMB  20-2:403      0 AMB  20-1:403    3.50    (#    403:20  Double Ambig)
 &rst
  ixpk= 403, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2515,2523,1872,1873,
 igr2= 202,1934,1935,
 &end
#
#   86 TRP  HZ2          81 LYS  HB+         5.50    (#    404:20  Unique         1.85, 3.46 A)
 &rst
  ixpk= 404, nxpk= 20, iat=1417,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1303,1304,
 &end
#
#    0 AMB  20-2:405      0 AMB  20-1:405    3.50    (#    405:20  Double Ambig)
 &rst
  ixpk= 405, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1941, 104,
 igr2=1934,1935,1547,1548,
 &end
#
#   14 VAL  HN           14 VAL  HB          3.50    (#    406:20  Unique         2.69, 2.80 A)
 &rst
  ixpk= 406, nxpk= 20, iat= 198, 202, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:407      0 AMB  20-1:407    2.60    (#    407:20  Double Ambig)
 &rst
  ixpk= 407, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.10, r4= 7.85,
 igr1= 329, 330, 331, 333, 334, 335,1370,1371,1372,1374,
      1375,1376,1275,1276,1277,1279,1280,1281,1567,1568,
      1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2= 202,1303,1304,1547,1548,1547,1548,1303,1304,1303,
      1304,1303,1304,
 &end
#
#    0 AMB  20-2:408      0 AMB  20-1:408    3.50    (#    408:20  Double Ambig)
 &rst
  ixpk= 408, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.76, r4= 8.51,
 igr1=1669,1670,1073,1074,1075,1077,1078,1079,1496,1497,
      1498,1500,1501,1502,1919,1920,1921,
 igr2= 202,1303,1304,1303,1304,1934,1935,
 &end
#
#   22 VAL  MGY          14 VAL  MGY         2.60    (#    409:20  Unique         2.00, 5.55 A)
 &rst
  ixpk= 409, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  148 MET  ME           14 VAL  MGY         3.50    (#    410:20  Unique         2.91, 5.57 A)
 &rst
  ixpk= 410, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2464,2465,2466,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HB           14 VAL  MGY         2.60    (#    412:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 412, nxpk= 20, iat= 202,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  HB           14 VAL  MGY         3.50    (#    413:20  Unique         2.54, 5.72 A)
 &rst
  ixpk= 413, nxpk= 20, iat= 327,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:414     14 VAL  MGY         5.50    (#    414:20  Single Ambig)
 &rst
  ixpk= 414, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 237, 238,2098,2099,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HA           14 VAL  MGY         3.50    (#    415:20  Unique         2.16, 3.12 A)
 &rst
  ixpk= 415, nxpk= 20, iat= 200,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  101 LEU  HA           14 VAL  MGY         5.50    (#    416:20  Unique         3.32, 4.68 A)
 &rst
  ixpk= 416, nxpk= 20, iat=1667,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  129 TYR  HD           14 VAL  MGY         5.50    (#    417:20  Unique         4.96, 9.61 A)
 &rst
  ixpk= 417, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2102,2111,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  HA           14 VAL  MGY         5.50    (#    418:20  Unique         3.67, 6.17 A)
 &rst
  ixpk= 418, nxpk= 20, iat= 325,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:419     14 VAL  MGY         5.50    (#    419:20  Single Ambig)
 &rst
  ixpk= 419, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 235, 369,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  151 PHE  HD           14 VAL  MGY         3.50    (#    420:20  Unique         2.75, 5.79 A)
 &rst
  ixpk= 420, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2515,2523,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   35 PHE  HD           14 VAL  MGY         3.50    (#    421:20  Unique         1.99, 5.58 A)
 &rst
  ixpk= 421, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 559, 567,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HN           14 VAL  MGY         3.50    (#    422:20  Unique         2.39, 4.03 A)
 &rst
  ixpk= 422, nxpk= 20, iat= 198,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   15 ILE  HN           14 VAL  MGY         4.40    (#    423:20  Unique         3.07, 4.76 A)
 &rst
  ixpk= 423, nxpk= 20, iat= 214,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  102 LEU  HN           14 VAL  MGY         4.40    (#    424:20  Unique         3.99, 5.85 A)
 &rst
  ixpk= 424, nxpk= 20, iat=1684,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  147 VAL  MGX          14 VAL  MGX         2.60    (#    425:20  Unique         3.99, 7.22 A)
 &rst
  ixpk= 425, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  147 VAL  MGY          14 VAL  MGX         5.50    (#    426:20  Unique         3.99, 7.22 A)
 &rst
  ixpk= 426, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:428     14 VAL  MGX         3.50    (#    428:20  Single Ambig)
 &rst
  ixpk= 428, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.32, r4= 8.07,
 igr1=1669,1670,2570,2571,2572,2574,2575,2576,1073,1074,
      1075,1077,1078,1079,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  MGX          14 VAL  MGX         3.50    (#    429:20  Unique         2.00, 5.55 A)
 &rst
  ixpk= 429, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:430     14 VAL  MGX         3.50    (#    430:20  Single Ambig)
 &rst
  ixpk= 430, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.77, r4= 8.52,
 igr1= 185, 186, 187, 227, 228, 229, 224, 225,2570,2571,
      2572,2574,2575,2576,1073,1074,1075,1077,1078,1079,
      
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  148 MET  ME           14 VAL  MGX         5.50    (#    431:20  Unique         2.91, 5.57 A)
 &rst
  ixpk= 431, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2464,2465,2466,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HB           14 VAL  MGX         2.60    (#    432:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 432, nxpk= 20, iat= 202,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   99 TRP  HB+          14 VAL  MGX         4.40    (#    433:20  Unique         3.29, 6.10 A)
 &rst
  ixpk= 433, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1625,1626,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HA           14 VAL  MGX         3.50    (#    434:20  Unique         2.16, 3.12 A)
 &rst
  ixpk= 434, nxpk= 20, iat= 200,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:435     14 VAL  MGX         5.50    (#    435:20  Single Ambig)
 &rst
  ixpk= 435, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.25, r4=11.00,
 igr1= 174, 175, 174, 175,2455, 358, 341,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:436     14 VAL  MGX         5.50    (#    436:20  Single Ambig)
 &rst
  ixpk= 436, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 216,2509,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  101 LEU  HA           14 VAL  MGX         3.50    (#    437:20  Unique         3.32, 4.68 A)
 &rst
  ixpk= 437, nxpk= 20, iat=1667,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  151 PHE  HD           14 VAL  MGX         2.60    (#    438:20  Unique         2.75, 5.79 A)
 &rst
  ixpk= 438, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2515,2523,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   99 TRP  HE3          14 VAL  MGX         3.50    (#    440:20  Unique         2.87, 5.02 A)
 &rst
  ixpk= 440, nxpk= 20, iat=1640,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:442     14 VAL  MGX         4.40    (#    442:20  Single Ambig)
 &rst
  ixpk= 442, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 179,1621,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  100 PHE  HN           14 VAL  MGX         5.50    (#    443:20  Unique         2.58, 5.14 A)
 &rst
  ixpk= 443, nxpk= 20, iat=1645,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HN           14 VAL  MGX         3.50    (#    444:20  Unique         2.39, 4.03 A)
 &rst
  ixpk= 444, nxpk= 20, iat= 198,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   15 ILE  HN           14 VAL  MGX         5.50    (#    445:20  Unique         3.07, 4.76 A)
 &rst
  ixpk= 445, nxpk= 20, iat= 214,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:448     15 ILE  HA          5.50    (#    448:20  Single Ambig)
 &rst
  ixpk= 448, nxpk= 20, iat=  -1, 216, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1674,1675,1676,1678,1679,1680, 204, 205, 206, 208,
       209, 210,
 &end
#
#    0 AMB  20-2:453     93 ILE  HB          2.60    (#    453:20  Single Ambig)
 &rst
  ixpk= 453, nxpk= 20, iat=  -1,1521, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1527,1528,1530,1531,1532,
 &end
#
#   93 ILE  HG1-         93 ILE  HB          2.60    (#    454:20  Unique         2.26, 2.49 A)
 &rst
  ixpk= 454, nxpk= 20, iat=  -1,1521, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1527,1528,
 &end
#
#   93 ILE  QG2          93 ILE  HB          2.60    (#    455:20  Unique         2.33, 2.63 A)
 &rst
  ixpk= 455, nxpk= 20, iat=  -1,1521, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1523,1524,1525,
 &end
#
#   15 ILE  QG2          15 ILE  HB          2.60    (#    456:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 456, nxpk= 20, iat=  -1, 218, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1= 220, 221, 222,
 &end
#
#   23 MET  ME           15 ILE  HB          5.50    (#    457:20  Unique         2.18, 3.50 A)
 &rst
  ixpk= 457, nxpk= 20, iat=  -1, 218, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 350, 351, 352,
 &end
#
#   15 ILE  HG1+         15 ILE  HB          3.50    (#    458:20  Unique         2.37, 2.46 A)
 &rst
  ixpk= 458, nxpk= 20, iat=  -1, 218, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 224, 225,
 &end
#
#   93 ILE  HA           93 ILE  HB          2.60    (#    459:20  Unique         2.46, 2.48 A)
 &rst
  ixpk= 459, nxpk= 20, iat=1519,1521, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    0 AMB  20-2:461      0 AMB  20-1:461    5.50    (#    461:20  Double Ambig)
 &rst
  ixpk= 461, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1517,1720,
 igr2=1521, 218,
 &end
#
#   93 ILE  HN           93 ILE  HG1-        3.50    (#    462:20  Unique         2.30, 3.00 A)
 &rst
  ixpk= 462, nxpk= 20, iat=1517,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1527,1528,
 &end
#
#   93 ILE  HN           93 ILE  HG1+        3.50    (#    463:20  Unique         2.30, 3.00 A)
 &rst
  ixpk= 463, nxpk= 20, iat=1517,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1527,1528,
 &end
#
#   94 GLY  HN           93 ILE  HG1-        5.50    (#    464:20  Unique         2.99, 4.08 A)
 &rst
  ixpk= 464, nxpk= 20, iat=1536,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1527,1528,
 &end
#
#    0 AMB  20-2:465      0 AMB  20-1:465    5.50    (#    465:20  Double Ambig)
 &rst
  ixpk= 465, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1536,1795,
 igr2=1527,1528, 926, 927, 928, 930, 931, 932,
 &end
#
#    0 AMB  20-2:466      0 AMB  20-1:466    3.90    (#    466:20  Double Ambig)
 &rst
  ixpk= 466, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1= 852, 860, 773, 782,1419,
 igr2= 834, 835, 836, 838, 839, 840,1527,1528,
 &end
#
#    0 AMB  20-2:469      0 AMB  20-1:469    5.50    (#    469:20  Double Ambig)
 &rst
  ixpk= 469, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=  78,  79,1797,
 igr2=1527,1528, 926, 927, 928, 930, 931, 932,
 &end
#
#   51 TYR  HA           54 LEU  MDX         3.50    (#    470:20  Unique         2.57, 4.60 A)
 &rst
  ixpk= 470, nxpk= 20, iat= 767,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:471      0 AMB  20-1:471    3.50    (#    471:20  Double Ambig)
 &rst
  ixpk= 471, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 827,  78,  79,
 igr2= 834, 835, 836, 838, 839, 840,1527,1528,
 &end
#
#    6 GLY  HA-          93 ILE  HG1+        5.50    (#    472:20  Unique         3.87, 4.98 A)
 &rst
  ixpk= 472, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  78,  79,
 igr2=1527,1528,
 &end
#
#   93 ILE  HB           93 ILE  HG1-        2.60    (#    473:20  Unique         2.26, 2.49 A)
 &rst
  ixpk= 473, nxpk= 20, iat=1521,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1527,1528,
 &end
#
#   93 ILE  HB           93 ILE  HG1+        2.60    (#    474:20  Unique         2.26, 2.49 A)
 &rst
  ixpk= 474, nxpk= 20, iat=1521,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1527,1528,
 &end
#
#   84 VAL  MGX          93 ILE  QD1         5.50    (#    475:20  Unique         5.65, 8.12 A)
 &rst
  ixpk= 475, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1370,1371,1372,1374,1375,1376,
 igr2=1530,1531,1532,
 &end
#
#    0 AMB  20-2:476      0 AMB  20-1:476    4.40    (#    476:20  Double Ambig)
 &rst
  ixpk= 476, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.55, r4= 9.30,
 igr1=1496,1497,1498,1500,1501,1502, 384, 385, 386,
 igr2=1530,1531,1532, 192, 193, 194,
 &end
#
#    0 AMB  20-2:477     93 ILE  QD1         5.50    (#    477:20  Single Ambig)
 &rst
  ixpk= 477, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1547,1548,1303,1304, 111, 112,
 igr2=1530,1531,1532,
 &end
#
#    0 AMB  20-2:478      0 AMB  20-1:478    4.40    (#    478:20  Double Ambig)
 &rst
  ixpk= 478, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1=1625,1626,1257,1258, 796, 797,1097,1098,
 igr2= 192, 193, 194,1530,1531,1532,
 &end
#
#    0 AMB  20-2:479      0 AMB  20-1:479    4.40    (#    479:20  Double Ambig)
 &rst
  ixpk= 479, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=  78,  79, 827,
 igr2=1530,1531,1532, 192, 193, 194,
 &end
#
#    6 GLY  HA+          93 ILE  QD1         3.50    (#    480:20  Unique         1.98, 3.26 A)
 &rst
  ixpk= 480, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  78,  79,
 igr2=1530,1531,1532,
 &end
#
#    0 AMB  20-2:481      0 AMB  20-1:481    3.50    (#    481:20  Double Ambig)
 &rst
  ixpk= 481, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 174, 175,1519,
 igr2= 192, 193, 194,1530,1531,1532,
 &end
#
#    7 TYR  HA           93 ILE  QD1         5.50    (#    482:20  Unique         4.01, 5.07 A)
 &rst
  ixpk= 482, nxpk= 20, iat=  85,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1530,1531,1532,
 &end
#
#    0 AMB  20-2:484     93 ILE  QD1         4.40    (#    484:20  Single Ambig)
 &rst
  ixpk= 484, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1536,1423,
 igr2=1530,1531,1532,
 &end
#
#    0 AMB  20-2:485     93 ILE  QD1         5.50    (#    485:20  Single Ambig)
 &rst
  ixpk= 485, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=  76,1506,
 igr2=1530,1531,1532,
 &end
#
#   93 ILE  HN           93 ILE  QD1         3.50    (#    486:20  Unique         1.84, 2.75 A)
 &rst
  ixpk= 486, nxpk= 20, iat=1517,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1530,1531,1532,
 &end
#
#   17 ASN  HN           16 CYS  HA          3.50    (#    487:20  Unique         2.21, 2.34 A)
 &rst
  ixpk= 487, nxpk= 20, iat= 244, 235, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:488     16 CYS  HA          5.50    (#    488:20  Single Ambig)
 &rst
  ixpk= 488, nxpk= 20, iat=  -1, 235, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1715,1716, 561, 565, 559, 567,
 &end
#
#   22 VAL  HA           16 CYS  HA          4.40    (#    489:20  Unique         2.20, 2.72 A)
 &rst
  ixpk= 489, nxpk= 20, iat= 325, 235, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   16 CYS  HB+          16 CYS  HA          4.40    (#    490:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 490, nxpk= 20, iat=  -1, 235, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 237, 238,
 &end
#
#   16 CYS  HB-          16 CYS  HA          4.40    (#    491:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 491, nxpk= 20, iat=  -1, 235, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 237, 238,
 &end
#
#    0 AMB  20-2:492     16 CYS  HA          5.50    (#    492:20  Single Ambig)
 &rst
  ixpk= 492, nxpk= 20, iat=  -1, 235, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1=1707,1708,2615, 286, 287,2612,2613,
 &end
#
#   22 VAL  MGY          16 CYS  HA          3.50    (#    493:20  Unique         2.74, 5.54 A)
 &rst
  ixpk= 493, nxpk= 20, iat=  -1, 235, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#  101 LEU  MDX          16 CYS  HB+         5.50    (#    494:20  Unique         1.98, 4.47 A2.6)
 &rst
  ixpk= 494, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2= 237, 238,
 &end
#
#    0 AMB  20-2:495      0 AMB  20-1:495    4.40    (#    495:20  Double Ambig)
 &rst
  ixpk= 495, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1=2617,2618,2619,2621,2622,2623, 329, 330, 331, 333,
       334, 335,
 igr2= 237, 238, 237, 238,
 &end
#
#  101 LEU  MDX          16 CYS  HB-         4.40    (#    496:20  Unique         1.98, 4.47 A)
 &rst
  ixpk= 496, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2= 237, 238,
 &end
#
#  158 LEU  MDX          16 CYS  HB-         4.40    (#    497:20  Unique         2.00, 5.10 A)
 &rst
  ixpk= 497, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2617,2618,2619,2621,2622,2623,
 igr2= 237, 238,
 &end
#
#    0 AMB  20-2:498      0 AMB  20-1:498    5.50    (#    498:20  Double Ambig)
 &rst
  ixpk= 498, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1=2570,2571,2572,2574,2575,2576,1073,1074,1075,1077,
      1078,1079,
 igr2=2587,2588, 237, 238,
 &end
#
#    0 AMB  20-2:499      0 AMB  20-1:499    5.50    (#    499:20  Double Ambig)
 &rst
  ixpk= 499, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=12.00, r4=12.75,
 igr1=1073,1074,1075,1077,1078,1079,2570,2571,2572,2574,
      2575,2576,2554,2555,2556,2558,2559,2560,
 igr2= 237, 238, 237, 238, 237, 238,
 &end
#
#  103 GLN  HB-          16 CYS  HB+         5.50    (#    500:20  Unique         3.14, 5.04 A)
 &rst
  ixpk= 500, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1707,1708,
 igr2= 237, 238,
 &end
#
#  103 GLN  HB-          16 CYS  HB-         5.50    (#    501:20  Unique         3.14, 5.04 A)
 &rst
  ixpk= 501, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1707,1708,
 igr2= 237, 238,
 &end
#
#    0 AMB  20-2:502      0 AMB  20-1:502    5.50    (#    502:20  Double Ambig)
 &rst
  ixpk= 502, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.25, r4=11.00,
 igr1= 310, 311, 218,2477,2478,2480,2481,
 igr2= 237, 238,2587,2588,2587,2588,
 &end
#
#  156 MET  HB+         156 MET  HG+         2.60    (#    503:20  Unique         2.37, 2.57 A)
 &rst
  ixpk= 503, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2584,2585,
 igr2=2587,2588,
 &end
#
#  156 MET  HA          156 MET  HG+         3.50    (#    505:20  Unique         3.10, 3.48 A)
 &rst
  ixpk= 505, nxpk= 20, iat=2582,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2587,2588,
 &end
#
#   16 CYS  HA           16 CYS  HB+         3.50    (#    507:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 507, nxpk= 20, iat= 235,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 237, 238,
 &end
#
#   16 CYS  HA           16 CYS  HB-         3.50    (#    508:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 508, nxpk= 20, iat= 235,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 237, 238,
 &end
#
#    0 AMB  20-2:509      0 AMB  20-1:509    5.50    (#    509:20  Double Ambig)
 &rst
  ixpk= 509, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2597,2527,2627,
 igr2=2587,2588,2587,2588, 237, 238,2587,2588,
 &end
#
#   17 ASN  HN           16 CYS  HB-         3.50    (#    510:20  Unique         2.50, 3.29 A)
 &rst
  ixpk= 510, nxpk= 20, iat= 244,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 237, 238,
 &end
#
#   17 ASN  HN           16 CYS  HB+         3.50    (#    511:20  Unique         2.50, 3.29 A)
 &rst
  ixpk= 511, nxpk= 20, iat= 244,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 237, 238,
 &end
#
#  156 MET  HN          156 MET  HG+         3.50    (#    512:20  Unique         1.95, 2.82 A)
 &rst
  ixpk= 512, nxpk= 20, iat=2580,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2587,2588,
 &end
#
#   17 ASN  HB-          17 ASN  HA          2.60    (#    516:20  Unique         2.27, 2.56 A)
 &rst
  ixpk= 516, nxpk= 20, iat=  -1, 246, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 248, 249,
 &end
#
#    0 AMB  20-2:517     17 ASN  HA          4.40    (#    517:20  Single Ambig)
 &rst
  ixpk= 517, nxpk= 20, iat=  -1, 246, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 262, 263,1707,1708, 286, 287,
 &end
#
#   17 ASN  HB+          17 ASN  HA          2.60    (#    518:20  Unique         2.27, 2.56 A)
 &rst
  ixpk= 518, nxpk= 20, iat=  -1, 246, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 248, 249,
 &end
#
#    0 AMB  20-2:519     17 ASN  HA          4.40    (#    519:20  Single Ambig)
 &rst
  ixpk= 519, nxpk= 20, iat=  -1, 246, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1= 260,1768,1769,
 &end
#
#   16 CYS  HA           17 ASN  HA          4.40    (#    522:20  Unique         4.35, 4.39 A)
 &rst
  ixpk= 522, nxpk= 20, iat= 235, 246, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:523     17 ASN  HA          5.50    (#    523:20  Single Ambig)
 &rst
  ixpk= 523, nxpk= 20, iat=  -1, 246, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 271, 294, 295,
 &end
#
#   18 ARG  HN           17 ASN  HA          3.50    (#    524:20  Unique         2.46, 2.56 A)
 &rst
  ixpk= 524, nxpk= 20, iat= 258, 246, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   18 ARG  HN           17 ASN  HB+         3.50    (#    526:20  Unique         2.10, 2.97 A)
 &rst
  ixpk= 526, nxpk= 20, iat= 258,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 248, 249,
 &end
#
#   18 ARG  HN           17 ASN  HB-         3.50    (#    527:20  Unique         2.10, 2.97 A)
 &rst
  ixpk= 527, nxpk= 20, iat= 258,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 248, 249,
 &end
#
#   17 ASN  HA           17 ASN  HB-         4.40    (#    528:20  Unique         2.27, 2.56 A)
 &rst
  ixpk= 528, nxpk= 20, iat= 246,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 248, 249,
 &end
#
#   17 ASN  HA           17 ASN  HB+         3.50    (#    529:20  Unique         2.27, 2.56 A)
 &rst
  ixpk= 529, nxpk= 20, iat= 246,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 248, 249,
 &end
#
#  158 LEU  MDX          18 ARG  HA          3.50    (#    530:20  Unique         2.07, 3.59 A)
 &rst
  ixpk= 530, nxpk= 20, iat=  -1, 260, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2617,2618,2619,2621,2622,2623,
 &end
#
#   18 ARG  HG-          18 ARG  HA          2.60    (#    531:20  Unique         2.09, 3.01 A)
 &rst
  ixpk= 531, nxpk= 20, iat=  -1, 260, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 265, 266,
 &end
#
#   18 ARG  HB-          18 ARG  HA          2.60    (#    532:20  Unique         2.36, 2.78 A)
 &rst
  ixpk= 532, nxpk= 20, iat=  -1, 260, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 262, 263,
 &end
#
#   18 ARG  HB+          18 ARG  HA          2.60    (#    533:20  Unique         2.36, 2.78 A)
 &rst
  ixpk= 533, nxpk= 20, iat=  -1, 260, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 262, 263,
 &end
#
#   18 ARG  HD+          18 ARG  HA          3.50    (#    534:20  Unique         2.04, 3.56 A)
 &rst
  ixpk= 534, nxpk= 20, iat=  -1, 260, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 268, 269,
 &end
#
#   19 GLN  HN           18 ARG  HA          3.50    (#    535:20  Unique         2.99, 3.17 A)
 &rst
  ixpk= 535, nxpk= 20, iat= 282, 260, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   18 ARG  HN           18 ARG  HA          3.50    (#    536:20  Unique         2.82, 2.87 A)
 &rst
  ixpk= 536, nxpk= 20, iat= 258, 260, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   82 ARG  HN           82 ARG  HB+         2.60    (#    537:20  Unique         2.53, 3.17 A)
 &rst
  ixpk= 537, nxpk= 20, iat=1321,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1325,1326,
 &end
#
#   78 LYS  HN           78 LYS  HD+         3.50    (#    538:20  Unique         1.99, 2.93 A)
 &rst
  ixpk= 538, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1254,1255,
 &end
#
#   85 ARG  HN           85 ARG  HB-         3.50    (#    539:20  Unique         2.24, 2.94 A)
 &rst
  ixpk= 539, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1384,1385,
 &end
#
#   18 ARG  HN           18 ARG  HB+         2.60    (#    540:20  Unique         2.13, 2.95 A)
 &rst
  ixpk= 540, nxpk= 20, iat= 258,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 262, 263,
 &end
#
#   18 ARG  HN           18 ARG  HB-         3.50    (#    541:20  Unique         2.13, 2.95 A)
 &rst
  ixpk= 541, nxpk= 20, iat= 258,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 262, 263,
 &end
#
#   19 GLN  HN           18 ARG  HB+         5.50    (#    542:20  Unique         3.45, 3.99 A)
 &rst
  ixpk= 542, nxpk= 20, iat= 282,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 262, 263,
 &end
#
#    0 AMB  20-2:543      0 AMB  20-1:543    5.50    (#    543:20  Double Ambig)
 &rst
  ixpk= 543, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 282,1417,
 igr2= 262, 263,1309,1310,
 &end
#
#    0 AMB  20-2:545      0 AMB  20-1:545    4.40    (#    545:20  Double Ambig)
 &rst
  ixpk= 545, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1382,2675,
 igr2=1384,1385, 262, 263,
 &end
#
#   82 ARG  HA           82 ARG  HB+         2.60    (#    546:20  Unique         2.27, 2.46 A)
 &rst
  ixpk= 546, nxpk= 20, iat=1323,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1325,1326,
 &end
#
#   18 ARG  HA           18 ARG  HB+         2.60    (#    547:20  Unique         2.36, 2.78 A)
 &rst
  ixpk= 547, nxpk= 20, iat= 260,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 262, 263,
 &end
#
#    0 AMB  20-2:548      0 AMB  20-1:548    2.60    (#    548:20  Double Ambig)
 &rst
  ixpk= 548, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 260,2494,1444,
 igr2= 262, 263,2480,2481,1384,1385,
 &end
#
#    0 AMB  20-2:549      0 AMB  20-1:549    2.60    (#    549:20  Double Ambig)
 &rst
  ixpk= 549, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 268, 269,1390,1391,
 igr2= 262, 263,1384,1385,
 &end
#
#    0 AMB  20-2:550      0 AMB  20-1:550    2.60    (#    550:20  Double Ambig)
 &rst
  ixpk= 550, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1331,1332, 268, 269,
 igr2=1325,1326, 262, 263,
 &end
#
#    0 AMB  20-2:551      0 AMB  20-1:551    2.60    (#    551:20  Double Ambig)
 &rst
  ixpk= 551, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 265, 266,1328,1329,
 igr2= 262, 263,1325,1326,
 &end
#
#    0 AMB  20-2:552      0 AMB  20-1:552    2.60    (#    552:20  Double Ambig)
 &rst
  ixpk= 552, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1251,1252, 248, 249,
 igr2=1254,1255, 262, 263,
 &end
#
#    0 AMB  20-2:553      0 AMB  20-1:553    3.50    (#    553:20  Double Ambig)
 &rst
  ixpk= 553, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1=1527,1528,1530,1531,1532,1527,1528,
 igr2=1254,1255,1254,1255,1309,1310,
 &end
#
#    0 AMB  20-2:555      0 AMB  20-1:555    3.50    (#    555:20  Double Ambig)
 &rst
  ixpk= 555, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2617,2618,2619,2621,2622,2623,1693,1694,1695,1697,
      1698,1699,1058,1059,1060,
 igr2= 265, 266,1055,1056,
 &end
#
#  158 LEU  MDY          18 ARG  HG-         3.50    (#    556:20  Unique         1.98, 5.27 A)
 &rst
  ixpk= 556, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2617,2618,2619,2621,2622,2623,
 igr2= 265, 266,
 &end
#
#    0 AMB  20-2:557     18 ARG  HG-         2.60    (#    557:20  Single Ambig)
 &rst
  ixpk= 557, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2691,2692, 262, 263,
 igr2= 265, 266,
 &end
#
#    0 AMB  20-2:558      0 AMB  20-1:558    2.60    (#    558:20  Double Ambig)
 &rst
  ixpk= 558, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2691,2692, 262, 263,2393,2394,
 igr2= 265, 266, 265, 266,2396,2397,
 &end
#
#  134 ARG  HD+         134 ARG  HG-         2.60    (#    559:20  Unique         2.26, 2.71 A)
 &rst
  ixpk= 559, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2200,2201,
 igr2=2197,2198,
 &end
#
#    0 AMB  20-2:560      0 AMB  20-1:560    2.60    (#    560:20  Double Ambig)
 &rst
  ixpk= 560, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2326,2327,2423,2424,
 igr2=2323,2324,2420,2421,
 &end
#
#   18 ARG  HA           18 ARG  HG-         2.60    (#    561:20  Unique         2.09, 3.01 A)
 &rst
  ixpk= 561, nxpk= 20, iat= 260,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 265, 266,
 &end
#
#   18 ARG  HA           18 ARG  HG+         2.60    (#    562:20  Unique         2.09, 3.01 A)
 &rst
  ixpk= 562, nxpk= 20, iat= 260,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 265, 266,
 &end
#
#  134 ARG  HA          134 ARG  HG-         3.50    (#    563:20  Unique         2.06, 2.91 A)
 &rst
  ixpk= 563, nxpk= 20, iat=2192,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2197,2198,
 &end
#
#    0 AMB  20-2:564      0 AMB  20-1:564    3.50    (#    564:20  Double Ambig)
 &rst
  ixpk= 564, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2192,2677,
 igr2=2197,2198, 265, 266,
 &end
#
#  134 ARG  HN          134 ARG  HG-         2.60    (#    565:20  Unique         3.36, 3.83 A)
 &rst
  ixpk= 565, nxpk= 20, iat=2190,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2197,2198,
 &end
#
#    0 AMB  20-2:566      0 AMB  20-1:566    2.60    (#    566:20  Double Ambig)
 &rst
  ixpk= 566, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2190,2130,
 igr2=2197,2198,2396,2397,2197,2198,
 &end
#
#  103 GLN  HE2+         18 ARG  HG-         3.50    (#    567:20  Unique         1.95, 3.96 A)
 &rst
  ixpk= 567, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1715,1716,
 igr2= 265, 266,
 &end
#
#    0 AMB  20-2:568      0 AMB  20-1:568    3.50    (#    568:20  Double Ambig)
 &rst
  ixpk= 568, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2128,2413,2627,
 igr2=2396,2397,2420,2421, 265, 266,
 &end
#
#   18 ARG  HN           18 ARG  HG-         3.50    (#    569:20  Unique         2.04, 3.64 A)
 &rst
  ixpk= 569, nxpk= 20, iat= 258,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 265, 266,
 &end
#
#   18 ARG  HN           18 ARG  HG+         3.50    (#    570:20  Unique         2.04, 3.64 A)
 &rst
  ixpk= 570, nxpk= 20, iat= 258,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 265, 266,
 &end
#
#   67 ILE  HN           67 ILE  HG1-        4.40    (#    571:20  Unique         1.96, 2.75 A)
 &rst
  ixpk= 571, nxpk= 20, iat=1045,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1055,1056,
 &end
#
#   72 ARG  HN           72 ARG  HG-         3.50    (#    572:20  Unique         1.99, 2.95 A)
 &rst
  ixpk= 572, nxpk= 20, iat=1118,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1125,1126,
 &end
#
#   18 ARG  HN           18 ARG  HD+         3.55    (#    573:20  Unique         1.95, 3.20 A)
 &rst
  ixpk= 573, nxpk= 20, iat= 258,  -1, r1= 0.00, r2= 1.80, r3= 3.98, r4= 4.73,
 igr2= 268, 269,
 &end
#
#   82 ARG  HN           82 ARG  HD+         3.50    (#    574:20  Unique         4.14, 4.43 A)
 &rst
  ixpk= 574, nxpk= 20, iat=1321,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1331,1332,
 &end
#
#    0 AMB  20-2:575      0 AMB  20-1:575    2.60    (#    575:20  Double Ambig)
 &rst
  ixpk= 575, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 271, 294, 295,
 igr2= 268, 269, 268, 269,
 &end
#
#  103 GLN  HE2-         18 ARG  HD+         3.50    (#    576:20  Unique         1.93, 3.53 A)
 &rst
  ixpk= 576, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1715,1716,
 igr2= 268, 269,
 &end
#
#   18 ARG  HA           18 ARG  HD+         3.50    (#    577:20  Unique         2.04, 3.56 A)
 &rst
  ixpk= 577, nxpk= 20, iat= 260,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 268, 269,
 &end
#
#   18 ARG  HB+          18 ARG  HD+         2.60    (#    578:20  Unique         2.02, 3.40 A)
 &rst
  ixpk= 578, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 262, 263,
 igr2= 268, 269,
 &end
#
#    0 AMB  20-2:579      0 AMB  20-1:579    2.60    (#    579:20  Double Ambig2.6)
 &rst
  ixpk= 579, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 265, 266,2396,2397,
 igr2= 268, 269,2326,2327,
 &end
#
#    0 AMB  20-2:580      0 AMB  20-1:580    2.60    (#    580:20  Double Ambig)
 &rst
  ixpk= 580, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2320,2321, 262, 263,2323,2324,
 igr2=2326,2327, 268, 269,2326,2327,
 &end
#
#    0 AMB  20-2:581      0 AMB  20-1:581    2.60    (#    581:20  Double Ambig)
 &rst
  ixpk= 581, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2323,2324, 265, 266,
 igr2=2326,2327, 268, 269,
 &end
#
#   68 LEU  MDY          68 LEU  HA          2.60    (#    582:20  Unique         2.21, 4.00 A)
 &rst
  ixpk= 582, nxpk= 20, iat=  -1,1066, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1073,1074,1075,1077,1078,1079,
 &end
#
#   68 LEU  HB-          68 LEU  HA          3.50    (#    583:20  Unique         2.30, 2.67 A)
 &rst
  ixpk= 583, nxpk= 20, iat=  -1,1066, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1068,1069,
 &end
#
#   68 LEU  HB+          68 LEU  HA          3.50    (#    584:20  Unique         2.30, 2.67 A)
 &rst
  ixpk= 584, nxpk= 20, iat=  -1,1066, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1068,1069,
 &end
#
#   19 GLN  HB-          19 GLN  HA          2.60    (#    585:20  Unique         2.35, 2.72 A)
 &rst
  ixpk= 585, nxpk= 20, iat=  -1, 284, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 286, 287,
 &end
#
#   19 GLN  HG+          19 GLN  HA          3.50    (#    586:20  Unique         2.45, 3.48 A)
 &rst
  ixpk= 586, nxpk= 20, iat=  -1, 284, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 289, 290,
 &end
#
#    0 AMB  20-2:587     19 GLN  HA          2.60    (#    587:20  Single Ambig)
 &rst
  ixpk= 587, nxpk= 20, iat=  -1, 284, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2631,2632, 286, 287, 289, 290,
 &end
#
#   20 GLY  HA+          19 GLN  HA          5.50    (#    588:20  Unique         4.43, 4.77 A)
 &rst
  ixpk= 588, nxpk= 20, iat=  -1, 284, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 301, 302,
 &end
#
#   19 GLN  HN           19 GLN  HA          3.50    (#    589:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 589, nxpk= 20, iat= 282, 284, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   69 ALA  HN           68 LEU  HA          5.50    (#    590:20  Unique         3.50, 3.52 A)
 &rst
  ixpk= 590, nxpk= 20, iat=1083,1066, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   20 GLY  HN           19 GLN  HA          3.50    (#    591:20  Unique         3.19, 3.33 A)
 &rst
  ixpk= 591, nxpk= 20, iat= 299, 284, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   68 LEU  HN           68 LEU  HA          3.50    (#    592:20  Unique         2.85, 2.93 A)
 &rst
  ixpk= 592, nxpk= 20, iat=1064,1066, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   45 SER  HN           48 GLN  HB-         3.50    (#    593:20  Unique         1.94, 2.76 A)
 &rst
  ixpk= 593, nxpk= 20, iat= 685,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 725, 726,
 &end
#
#   49 ALA  HN           48 GLN  HB-         5.50    (#    594:20  Unique         2.47, 3.05 A)
 &rst
  ixpk= 594, nxpk= 20, iat= 738,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 725, 726,
 &end
#
#   20 GLY  HN            0 AMB  20-1:595    3.50    (#    595:20  Single Ambig)
 &rst
  ixpk= 595, nxpk= 20, iat= 299,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2631,2632, 286, 287,
 &end
#
#    0 AMB  20-2:596      0 AMB  20-1:596    3.50    (#    596:20  Double Ambig)
 &rst
  ixpk= 596, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 299, 748,
 igr2= 286, 287, 790, 791,
 &end
#
#   48 GLN  HN           48 GLN  HB-         3.50    (#    597:20  Unique         2.40, 3.05 A)
 &rst
  ixpk= 597, nxpk= 20, iat= 721,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 725, 726,
 &end
#
#   19 GLN  HN            0 AMB  20-1:598    3.50    (#    598:20  Single Ambig)
 &rst
  ixpk= 598, nxpk= 20, iat= 282,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 286, 287,2631,2632,
 &end
#
#   19 GLN  HN           19 GLN  HB-         3.50    (#    599:20  Unique         2.54, 3.18 A)
 &rst
  ixpk= 599, nxpk= 20, iat= 282,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 286, 287,
 &end
#
#   19 GLN  HA            0 AMB  20-1:601    2.60    (#    601:20  Single Ambig)
 &rst
  ixpk= 601, nxpk= 20, iat= 284,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr2=2631,2632, 286, 287,
 &end
#
#   19 GLN  HA           19 GLN  HB-         2.60    (#    602:20  Unique         2.35, 2.72 A)
 &rst
  ixpk= 602, nxpk= 20, iat= 284,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 286, 287,
 &end
#
#    0 AMB  20-2:603     48 GLN  HB-         2.60    (#    603:20  Single Ambig)
 &rst
  ixpk= 603, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 723, 689, 690,
 igr2= 725, 726,
 &end
#
#   18 ARG  HA           19 GLN  HB-         5.50    (#    604:20  Unique         5.55, 6.06 A)
 &rst
  ixpk= 604, nxpk= 20, iat= 260,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 286, 287,
 &end
#
#   48 GLN  HG+          48 GLN  HB-         2.60    (#    605:20  Unique         2.34, 2.57 A)
 &rst
  ixpk= 605, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 728, 729,
 igr2= 725, 726,
 &end
#
#    0 AMB  20-2:611      0 AMB  20-1:611    2.60    (#    611:20  Double Ambig)
 &rst
  ixpk= 611, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 286, 287, 262, 263,
 igr2= 289, 290, 289, 290,
 &end
#
#   19 GLN  HB-          19 GLN  HG-         2.60    (#    612:20  Unique         2.26, 2.58 A)
 &rst
  ixpk= 612, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 286, 287,
 igr2= 289, 290,
 &end
#
#   19 GLN  HA           19 GLN  HG+         3.50    (#    613:20  Unique         2.45, 3.48 A)
 &rst
  ixpk= 613, nxpk= 20, iat= 284,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 289, 290,
 &end
#
#   19 GLN  HA           19 GLN  HG-         3.50    (#    614:20  Unique         2.45, 3.48 A)
 &rst
  ixpk= 614, nxpk= 20, iat= 284,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 289, 290,
 &end
#
#   19 GLN  HE2-         19 GLN  HG-         4.40    (#    615:20  Unique         2.12, 3.24 A)
 &rst
  ixpk= 615, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 294, 295,
 igr2= 289, 290,
 &end
#
#   19 GLN  HE2-         19 GLN  HG+         5.50    (#    616:20  Unique         2.12, 3.24 A)
 &rst
  ixpk= 616, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 294, 295,
 igr2= 289, 290,
 &end
#
#    0 AMB  20-2:617      0 AMB  20-1:617    3.50    (#    617:20  Double Ambig)
 &rst
  ixpk= 617, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 294, 295, 253, 254,
 igr2= 289, 290, 289, 290,
 &end
#
#    0 AMB  20-2:618      0 AMB  20-1:618    2.60    (#    618:20  Double Ambig)
 &rst
  ixpk= 618, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1= 253, 254, 294, 295, 253, 254,
 igr2= 313, 314, 289, 290,
 &end
#
#   19 GLN  HN            0 AMB  20-1:619    2.60    (#    619:20  Single Ambig)
 &rst
  ixpk= 619, nxpk= 20, iat= 282,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr2= 289, 290, 313, 314,
 &end
#
#   19 GLN  HN           19 GLN  HG+         2.60    (#    620:20  Unique         2.27, 3.27 A)
 &rst
  ixpk= 620, nxpk= 20, iat= 282,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 289, 290,
 &end
#
#    0 AMB  20-2:621      0 AMB  20-1:621    5.50    (#    621:20  Double Ambig)
 &rst
  ixpk= 621, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 299,2083,
 igr2= 313, 314, 289, 290, 313, 314,
 &end
#
#   20 GLY  HN           19 GLN  HG+         5.50    (#    622:20  Unique         4.08, 4.91 A)
 &rst
  ixpk= 622, nxpk= 20, iat= 299,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 289, 290,
 &end
#
#   22 VAL  HN           21 GLN  HG+         5.50    (#    623:20  Unique         3.90, 4.76 A)
 &rst
  ixpk= 623, nxpk= 20, iat= 323,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 313, 314,
 &end
#
#   95 GLN  HN           94 GLY  HA-         5.50    (#    624:20  Unique         2.19, 2.61 A)
 &rst
  ixpk= 624, nxpk= 20, iat=1543,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1538,1539,
 &end
#
#    0 AMB  20-2:625      0 AMB  20-1:625    2.60    (#    625:20  Double Ambig)
 &rst
  ixpk= 625, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 299,1266,
 igr2= 301, 302,1538,1539,
 &end
#
#   20 GLY  HN           20 GLY  HA-         2.60    (#    626:20  Unique         2.30, 2.62 A)
 &rst
  ixpk= 626, nxpk= 20, iat= 299,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 301, 302,
 &end
#
#   21 GLN  HN           20 GLY  HA+         5.50    (#    627:20  Unique         2.84, 3.20 A)
 &rst
  ixpk= 627, nxpk= 20, iat= 306,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 301, 302,
 &end
#
#   94 GLY  HN           94 GLY  HA-         5.50    (#    628:20  Unique         2.61, 2.79 A)
 &rst
  ixpk= 628, nxpk= 20, iat=1536,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1538,1539,
 &end
#
#   21 GLN  HN           20 GLY  HA-         5.50    (#    629:20  Unique         2.84, 3.20 A)
 &rst
  ixpk= 629, nxpk= 20, iat= 306,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 301, 302,
 &end
#
#   30 GLN  HN           30 GLN  HB+         4.40    (#    634:20  Unique         2.46, 3.23 A)
 &rst
  ixpk= 634, nxpk= 20, iat= 465,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 469, 470,
 &end
#
#   30 GLN  HN           30 GLN  HB-         3.50    (#    635:20  Unique         2.46, 3.23 A)
 &rst
  ixpk= 635, nxpk= 20, iat= 465,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 469, 470,
 &end
#
#   32 SER  HN           30 GLN  HB+         5.50    (#    636:20  Unique         2.34, 3.31 A)
 &rst
  ixpk= 636, nxpk= 20, iat= 499,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 469, 470,
 &end
#
#   30 GLN  HA           30 GLN  HB+         3.50    (#    637:20  Unique         2.37, 2.74 A)
 &rst
  ixpk= 637, nxpk= 20, iat= 467,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 469, 470,
 &end
#
#   30 GLN  HA           30 GLN  HB-         3.50    (#    638:20  Unique         2.37, 2.74 A)
 &rst
  ixpk= 638, nxpk= 20, iat= 467,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 469, 470,
 &end
#
#   30 GLN  HG+          30 GLN  HB-         2.60    (#    640:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 640, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 472, 473,
 igr2= 469, 470,
 &end
#
#   30 GLN  HG+          30 GLN  HB+         2.60    (#    642:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 642, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 472, 473,
 igr2= 469, 470,
 &end
#
#   30 GLN  HB-          30 GLN  HG+         2.60    (#    645:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 645, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 469, 470,
 igr2= 472, 473,
 &end
#
#   30 GLN  HB+          30 GLN  HG+         2.60    (#    646:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 646, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 469, 470,
 igr2= 472, 473,
 &end
#
#    0 AMB  20-2:647      0 AMB  20-1:647    4.40    (#    647:20  Double Ambig)
 &rst
  ixpk= 647, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 460, 461, 503, 504, 503, 504,
 igr2= 472, 473, 472, 473, 472, 473,
 &end
#
#   58 VAL  HA           58 VAL  HB          3.50    (#    648:20  Unique         2.51, 2.84 A)
 &rst
  ixpk= 648, nxpk= 20, iat= 896, 898, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   30 GLN  HE2-         30 GLN  HG+         2.60    (#    649:20  Unique         2.12, 3.20 A)
 &rst
  ixpk= 649, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 477, 478,
 igr2= 472, 473,
 &end
#
#    0 AMB  20-2:650      0 AMB  20-1:650    3.50    (#    650:20  Double Ambig)
 &rst
  ixpk= 650, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1594,1595,1594,1595,1594,1595,1555,1556,
 igr2=1586,1587,1589,1590,1550,1551,
 &end
#
#   99 TRP  HZ2           0 AMB  20-1:651    4.40    (#    651:20  Single Ambig)
 &rst
  ixpk= 651, nxpk= 20, iat=1634,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr2=1589,1590,1586,1587,
 &end
#
#   59 GLY  HN           58 VAL  HB          4.40    (#    652:20  Unique         3.11, 3.61 A)
 &rst
  ixpk= 652, nxpk= 20, iat= 910, 898, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   37 GLN  HN           37 GLN  HG+         3.50    (#    653:20  Unique         2.23, 3.54 A)
 &rst
  ixpk= 653, nxpk= 20, iat= 585,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 592, 593,
 &end
#
#    0 AMB  20-2:654      0 AMB  20-1:654    3.50    (#    654:20  Double Ambig)
 &rst
  ixpk= 654, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 482, 458,
 igr2= 472, 473, 472, 473,
 &end
#
#    0 AMB  20-2:655      0 AMB  20-1:655    5.50    (#    655:20  Double Ambig)
 &rst
  ixpk= 655, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1631,1582,
 igr2=1586,1587,1586,1587,1589,1590,
 &end
#
#   27 ARG  HN           30 GLN  HG+         3.50    (#    656:20  Unique         2.82, 8.69 A)
 &rst
  ixpk= 656, nxpk= 20, iat= 414,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 472, 473,
 &end
#
#   23 MET  HN           22 VAL  HA          3.50    (#    657:20  Unique         2.22, 2.32 A)
 &rst
  ixpk= 657, nxpk= 20, iat= 339, 325, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:658     22 VAL  HA          5.50    (#    658:20  Single Ambig)
 &rst
  ixpk= 658, nxpk= 20, iat=  -1, 325, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2104,2109, 561, 565,
 &end
#
#   16 CYS  HA           22 VAL  HA          3.50    (#    659:20  Unique         2.20, 2.72 A)
 &rst
  ixpk= 659, nxpk= 20, iat= 235, 325, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   22 VAL  HB           22 VAL  HA          5.50    (#    661:20  Unique         2.50, 2.68 A)
 &rst
  ixpk= 661, nxpk= 20, iat= 327, 325, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   22 VAL  MGX          22 VAL  HA          3.50    (#    663:20  Unique         1.95, 3.33 A)
 &rst
  ixpk= 663, nxpk= 20, iat=  -1, 325, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  MGY          22 VAL  HA          3.50    (#    664:20  Unique         1.95, 3.33 A)
 &rst
  ixpk= 664, nxpk= 20, iat=  -1, 325, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   14 VAL  MGY          22 VAL  HB          3.50    (#    666:20  Unique         2.54, 5.72 A)
 &rst
  ixpk= 666, nxpk= 20, iat=  -1, 327, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  MGX          22 VAL  HB          2.60    (#    667:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 667, nxpk= 20, iat=  -1, 327, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  MGY          22 VAL  HB          2.60    (#    668:20  Unique         2.22, 2.63 A2.6)
 &rst
  ixpk= 668, nxpk= 20, iat=  -1, 327, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   71 THR  MG2         150 GLU  HG+         4.40    (#    669:20  Unique         3.19, 5.21 A)
 &rst
  ixpk= 669, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1110,1111,1112,
 igr2=2499,2500,
 &end
#
#  150 GLU  HB-         150 GLU  HG+         2.60    (#    670:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 670, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2496,2497,
 igr2=2499,2500,
 &end
#
#  150 GLU  HB+         150 GLU  HG+         2.60    (#    671:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 671, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2496,2497,
 igr2=2499,2500,
 &end
#
#  150 GLU  HA          150 GLU  HG+         2.60    (#    673:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 673, nxpk= 20, iat=2494,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2499,2500,
 &end
#
#  160 GLU  HA          160 GLU  HG-         2.60    (#    674:20  Unique         2.25, 2.99 A)
 &rst
  ixpk= 674, nxpk= 20, iat=2646,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2651,2652,
 &end
#
#   22 VAL  HA           22 VAL  HB          5.50    (#    675:20  Unique         2.50, 2.68 A)
 &rst
  ixpk= 675, nxpk= 20, iat= 325, 327, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HD          150 GLU  HG+         4.40    (#    676:20  Unique         2.56, 6.74 A)
 &rst
  ixpk= 676, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2515,2523,
 igr2=2499,2500,
 &end
#
#  160 GLU  HN          160 GLU  HG-         3.50    (#    677:20  Unique         2.22, 3.06 A)
 &rst
  ixpk= 677, nxpk= 20, iat=2644,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2651,2652,
 &end
#
#  161 ASN  HN          160 GLU  HG-         5.50    (#    678:20  Unique         2.27, 4.45 A)
 &rst
  ixpk= 678, nxpk= 20, iat=2659,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2651,2652,
 &end
#
#   22 VAL  HN           22 VAL  MGX         3.50    (#    679:20  Unique         1.95, 3.73 A)
 &rst
  ixpk= 679, nxpk= 20, iat= 323,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   35 PHE  HD           22 VAL  MGX         4.40    (#    680:20  Unique         3.87, 7.15 A)
 &rst
  ixpk= 680, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 559, 567,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HA           22 VAL  MGX         4.40    (#    681:20  Unique         1.95, 3.33 A)
 &rst
  ixpk= 681, nxpk= 20, iat= 325,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  129 TYR  HA           22 VAL  MGX         3.50    (#    683:20  Unique         1.99, 3.84 A)
 &rst
  ixpk= 683, nxpk= 20, iat=2096,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:685     22 VAL  MGX         4.40    (#    685:20  Single Ambig)
 &rst
  ixpk= 685, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1= 237, 238,2098,2099,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HB           22 VAL  MGX         2.60    (#    686:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 686, nxpk= 20, iat= 327,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:687     22 VAL  MGX         3.50    (#    687:20  Single Ambig)
 &rst
  ixpk= 687, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2071,2457,2458,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  148 MET  ME           22 VAL  MGX         2.60    (#    688:20  Unique         1.99, 4.56 A)
 &rst
  ixpk= 688, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=2464,2465,2466,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  127 VAL  MGX          22 VAL  MGX         2.60    (#    689:20  Unique         2.06, 6.68 A)
 &rst
  ixpk= 689, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  101 LEU  MDY          22 VAL  MGX         4.40    (#    690:20  Unique         3.77, 7.84 A)
 &rst
  ixpk= 690, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   14 VAL  MGY          22 VAL  MGY         2.60    (#    692:20  Unique         2.00, 5.55 A)
 &rst
  ixpk= 692, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HB           22 VAL  MGY         2.60    (#    693:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 693, nxpk= 20, iat= 327,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:694      0 AMB  20-1:694    3.50    (#    694:20  Double Ambig)
 &rst
  ixpk= 694, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2071,2496,2497,2457,2458,
 igr2= 329, 330, 331, 333, 334, 335,2554,2555,2556,2558,
      2559,2560,
 &end
#
#    0 AMB  20-2:695     22 VAL  MGY         5.50    (#    695:20  Single Ambig)
 &rst
  ixpk= 695, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2098,2099, 360, 361,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   16 CYS  HB-          22 VAL  MGY         3.50    (#    696:20  Unique         2.71, 6.63 A)
 &rst
  ixpk= 696, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 237, 238,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:697      0 AMB  20-1:697    2.60    (#    697:20  Double Ambig)
 &rst
  ixpk= 697, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1286,1287, 237, 238,2098,2099,
 igr2=1354,1355,1356,1358,1359,1360, 329, 330, 331, 333,
       334, 335,
 &end
#
#  129 TYR  HA           22 VAL  MGY         2.60    (#    698:20  Unique         1.99, 3.84 A)
 &rst
  ixpk= 698, nxpk= 20, iat=2096,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  129 TYR  HD           22 VAL  MGY         2.60    (#    700:20  Unique         2.44, 6.68 A)
 &rst
  ixpk= 700, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2102,2111,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HA           22 VAL  MGY         3.50    (#    701:20  Unique         1.95, 3.33 A)
 &rst
  ixpk= 701, nxpk= 20, iat= 325,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   16 CYS  HA           22 VAL  MGY         3.50    (#    702:20  Unique         2.74, 5.54 A)
 &rst
  ixpk= 702, nxpk= 20, iat= 235,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:703      0 AMB  20-1:703    4.40    (#    703:20  Double Ambig)
 &rst
  ixpk= 703, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 559, 567,1364,
 igr2= 329, 330, 331, 333, 334, 335,1354,1355,1356,1358,
      1359,1360,
 &end
#
#    0 AMB  20-2:704     22 VAL  MGY         4.40    (#    704:20  Single Ambig)
 &rst
  ixpk= 704, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2139, 244,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   23 MET  HN           22 VAL  MGY         3.50    (#    705:20  Unique         1.97, 3.92 A)
 &rst
  ixpk= 705, nxpk= 20, iat= 339,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HN           22 VAL  MGY         3.50    (#    706:20  Unique         1.95, 3.73 A)
 &rst
  ixpk= 706, nxpk= 20, iat= 323,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:707      0 AMB  20-1:707    3.50    (#    707:20  Double Ambig)
 &rst
  ixpk= 707, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1621, 380,
 igr2=1601, 358,
 &end
#
#   25 ALA  MB           25 ALA  HA          3.50    (#    708:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 708, nxpk= 20, iat=  -1, 382, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 384, 385, 386,
 &end
#
#  124 TRP  HA           25 ALA  HA          4.40    (#    711:20  Unique         2.57, 3.64 A)
 &rst
  ixpk= 711, nxpk= 20, iat=1997, 382, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:712     25 ALA  HA          3.50    (#    712:20  Single Ambig)
 &rst
  ixpk= 712, nxpk= 20, iat=  -1, 382, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 390, 380,
 &end
#
#    0 AMB  20-2:714     25 ALA  MB          2.60    (#    714:20  Single Ambig)
 &rst
  ixpk= 714, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 380, 390,
 igr2= 384, 385, 386,
 &end
#
#  121 PHE  HE           25 ALA  MB          3.50    (#    716:20  Unique         2.00, 5.43 A)
 &rst
  ixpk= 716, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1966,1970,
 igr2= 384, 385, 386,
 &end
#
#  124 TRP  HA           25 ALA  MB          3.50    (#    719:20  Unique         2.02, 4.09 A)
 &rst
  ixpk= 719, nxpk= 20, iat=1997,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 384, 385, 386,
 &end
#
#   58 VAL  HA           25 ALA  MB          5.50    (#    720:20  Unique         4.65, 5.77 A)
 &rst
  ixpk= 720, nxpk= 20, iat= 896,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 384, 385, 386,
 &end
#
#    0 AMB  20-2:721     25 ALA  MB          4.40    (#    721:20  Single Ambig)
 &rst
  ixpk= 721, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1960,1961, 392,
 igr2= 384, 385, 386,
 &end
#
#    0 AMB  20-2:722     25 ALA  MB          3.50    (#    722:20  Single Ambig)
 &rst
  ixpk= 722, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1999,2000,1960,1961,
 igr2= 384, 385, 386,
 &end
#
#  124 TRP  HB-          25 ALA  MB          4.40    (#    723:20  Unique         2.17, 4.69 A)
 &rst
  ixpk= 723, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1999,2000,
 igr2= 384, 385, 386,
 &end
#
#  113 MET  ME           25 ALA  MB          3.50    (#    724:20  Unique         2.00, 3.72 A)
 &rst
  ixpk= 724, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1854,1855,1856,
 igr2= 384, 385, 386,
 &end
#
#   23 MET  ME           25 ALA  MB          4.40    (#    725:20  Unique         3.70, 6.22 A)
 &rst
  ixpk= 725, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1= 350, 351, 352,
 igr2= 384, 385, 386,
 &end
#
#   25 ALA  HA           25 ALA  MB          3.50    (#    726:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 726, nxpk= 20, iat= 382,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 384, 385, 386,
 &end
#
#   27 ARG  HN           26 ARG  HA          5.50    (#    728:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 728, nxpk= 20, iat= 414, 392, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:731     27 ARG  HA          4.40    (#    731:20  Single Ambig)
 &rst
  ixpk= 731, nxpk= 20, iat=  -1, 416, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 418, 419,1948,1949,
 &end
#
#    0 AMB  20-2:732      0 AMB  20-1:732    3.50    (#    732:20  Double Ambig)
 &rst
  ixpk= 732, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1854,1855,1856,1931,1932,
 igr2=1845, 416,
 &end
#
#   27 ARG  HD+          27 ARG  HA          4.40    (#    734:20  Unique         2.22, 4.57 A)
 &rst
  ixpk= 734, nxpk= 20, iat=  -1, 416, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 424, 425,
 &end
#
#  121 PHE  HB-          27 ARG  HA          5.50    (#    735:20  Unique         4.29, 5.48 A)
 &rst
  ixpk= 735, nxpk= 20, iat=  -1, 416, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1960,1961,
 &end
#
#  121 PHE  HA           27 ARG  HA          5.50    (#    736:20  Unique         3.03, 4.39 A)
 &rst
  ixpk= 736, nxpk= 20, iat=1958, 416, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   28 PHE  HN           27 ARG  HA          2.60    (#    738:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 738, nxpk= 20, iat= 438, 416, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  114 GLN  HN          113 MET  HA          3.50    (#    739:20  Unique         2.66, 2.91 A)
 &rst
  ixpk= 739, nxpk= 20, iat=1860,1845, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  113 MET  HN          113 MET  HA          3.50    (#    740:20  Unique         2.27, 2.77 A)
 &rst
  ixpk= 740, nxpk= 20, iat=1843,1845, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  119 PRO  HB-         119 PRO  HG-         3.50    (#    746:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 746, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1934,1935,
 igr2=1931,1932,
 &end
#
#  119 PRO  HD-         119 PRO  HG-         3.50    (#    747:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 747, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1928,1929,
 igr2=1931,1932,
 &end
#
#    0 AMB  20-2:748      0 AMB  20-1:748    2.60    (#    748:20  Double Ambig)
 &rst
  ixpk= 748, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1331,1332,1928,1929,
 igr2=1328,1329,1931,1932,
 &end
#
#    0 AMB  20-2:749      0 AMB  20-1:749    3.50    (#    749:20  Double Ambig)
 &rst
  ixpk= 749, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1323,1915,2233,
 igr2=1328,1329,1931,1932,2323,2324,
 &end
#
#  141 ARG  HN          141 ARG  HG-         3.50    (#    750:20  Unique         1.93, 3.42 A)
 &rst
  ixpk= 750, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2323,2324,
 &end
#
#  120 GLU  HN          119 PRO  HG-         5.50    (#    751:20  Unique         4.50, 5.16 A)
 &rst
  ixpk= 751, nxpk= 20, iat=1941,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1931,1932,
 &end
#
#   72 ARG  HN           72 ARG  HD+         4.40    (#    752:20  Unique         3.78, 4.47 A)
 &rst
  ixpk= 752, nxpk= 20, iat=1118,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1128,1129,
 &end
#
#    0 AMB  20-2:753      0 AMB  20-1:753    5.50    (#    753:20  Double Ambig)
 &rst
  ixpk= 753, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.80, r4=10.55,
 igr1=2437,1093,2453,2659,
 igr2=2423,2424,1128,1129,2423,2424, 268, 269,
 &end
#
#    0 AMB  20-2:754      0 AMB  20-1:754    3.50    (#    754:20  Double Ambig)
 &rst
  ixpk= 754, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2415,1120,
 igr2=2423,2424,1128,1129,
 &end
#
#  142 ASP  HA          145 ARG  HD+         3.50    (#    755:20  Unique         2.43, 3.79 A)
 &rst
  ixpk= 755, nxpk= 20, iat=2342,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2399,2400,
 &end
#
#    0 AMB  20-2:756      0 AMB  20-1:756    3.50    (#    756:20  Double Ambig)
 &rst
  ixpk= 756, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1131,1151,1152,
 igr2=1128,1129,1128,1129,
 &end
#
#   95 GLN  HE2+          8 ARG  HD-         5.50    (#    757:20  Unique         3.72, 6.33 A)
 &rst
  ixpk= 757, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1555,1556,
 igr2= 114, 115,
 &end
#
#   82 ARG  HE           82 ARG  HD+         3.50    (#    758:20  Unique         2.28, 2.75 A)
 &rst
  ixpk= 758, nxpk= 20, iat=1334,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1331,1332,
 &end
#
#    0 AMB  20-2:759      0 AMB  20-1:759    3.50    (#    759:20  Double Ambig)
 &rst
  ixpk= 759, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1189,1190,1191,1193,1194,1195,1189,1190,1191,1193,
      1194,1195,
 igr2=2423,2424,2423,2424,
 &end
#
#  147 VAL  MGY         146 ARG  HD+         5.50    (#    760:20  Unique         5.79, 8.38 A)
 &rst
  ixpk= 760, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=2423,2424,
 &end
#
#  146 ARG  HG-         146 ARG  HD+         2.60    (#    761:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 761, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2420,2421,
 igr2=2423,2424,
 &end
#
#    0 AMB  20-2:762      0 AMB  20-1:762    3.50    (#    762:20  Double Ambig)
 &rst
  ixpk= 762, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 446, 454, 852, 860,
 igr2= 440, 866,
 &end
#
#   29 GLY  HN           28 PHE  HA          3.50    (#    763:20  Unique         2.14, 2.19 A)
 &rst
  ixpk= 763, nxpk= 20, iat= 458, 440, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:765     56 GLU  HA          2.60    (#    765:20  Single Ambig)
 &rst
  ixpk= 765, nxpk= 20, iat=  -1, 866, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 864, 879,
 &end
#
#    0 AMB  20-2:766      0 AMB  20-1:766    5.50    (#    766:20  Double Ambig)
 &rst
  ixpk= 766, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 854, 858, 894, 495,
 igr2= 866, 440,
 &end
#
#   53 GLU  HA           56 GLU  HA          5.50    (#    767:20  Unique         4.99, 5.29 A)
 &rst
  ixpk= 767, nxpk= 20, iat= 812, 866, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   28 PHE  HB+          28 PHE  HA          5.50    (#    768:20  Unique         2.58, 2.82 A)
 &rst
  ixpk= 768, nxpk= 20, iat=  -1, 440, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 442, 443,
 &end
#
#   56 GLU  HG+          56 GLU  HA          3.50    (#    769:20  Unique         2.34, 3.01 A)
 &rst
  ixpk= 769, nxpk= 20, iat=  -1, 866, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 871, 872,
 &end
#
#    0 AMB  20-2:770      0 AMB  20-1:770    2.60    (#    770:20  Double Ambig)
 &rst
  ixpk= 770, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 871, 872, 442, 443,
 igr2= 866, 440,
 &end
#
#   56 GLU  HB-          56 GLU  HA          2.60    (#    771:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 771, nxpk= 20, iat=  -1, 866, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 868, 869,
 &end
#
#    0 AMB  20-2:772      0 AMB  20-1:772    5.50    (#    772:20  Double Ambig)
 &rst
  ixpk= 772, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.54, r4= 9.29,
 igr1= 472, 473, 886, 887, 883, 884, 898,
 igr2= 440, 866,
 &end
#
#   28 PHE  HA           28 PHE  HB+         5.50    (#    773:20  Unique         2.58, 2.82 A)
 &rst
  ixpk= 773, nxpk= 20, iat= 440,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 442, 443,
 &end
#
#   28 PHE  HA           28 PHE  HB-         5.50    (#    774:20  Unique         2.58, 2.82 A)
 &rst
  ixpk= 774, nxpk= 20, iat= 440,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 442, 443,
 &end
#
#   28 PHE  HD           28 PHE  HB-         4.40    (#    776:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 776, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 446, 454,
 igr2= 442, 443,
 &end
#
#   28 PHE  HD           28 PHE  HB+         3.50    (#    777:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 777, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 446, 454,
 igr2= 442, 443,
 &end
#
#  161 ASN  HN          161 ASN  HB+         3.50    (#    778:20  Unique         2.14, 2.98 A)
 &rst
  ixpk= 778, nxpk= 20, iat=2659,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2663,2664,
 &end
#
#  161 ASN  HD2+        161 ASN  HB+         3.50    (#    779:20  Unique         2.11, 3.39 A)
 &rst
  ixpk= 779, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2668,2669,
 igr2=2663,2664,
 &end
#
#   28 PHE  HN           28 PHE  HB+         3.50    (#    780:20  Unique         2.09, 2.88 A)
 &rst
  ixpk= 780, nxpk= 20, iat= 438,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 442, 443,
 &end
#
#   28 PHE  HN           28 PHE  HB-         4.40    (#    781:20  Unique         2.09, 2.88 A)
 &rst
  ixpk= 781, nxpk= 20, iat= 438,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 442, 443,
 &end
#
#   29 GLY  HN           29 GLY  HA-         3.50    (#    782:20  Unique         2.30, 2.74 A)
 &rst
  ixpk= 782, nxpk= 20, iat= 458,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 460, 461,
 &end
#
#   29 GLY  HN           29 GLY  HA+         2.60    (#    783:20  Unique         2.30, 2.74 A)
 &rst
  ixpk= 783, nxpk= 20, iat= 458,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 460, 461,
 &end
#
#   30 GLN  HN           29 GLY  HA-         3.50    (#    784:20  Unique         2.14, 2.76 A)
 &rst
  ixpk= 784, nxpk= 20, iat= 465,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 460, 461,
 &end
#
#   30 GLN  HN           29 GLY  HA+         3.50    (#    785:20  Unique         2.14, 2.76 A)
 &rst
  ixpk= 785, nxpk= 20, iat= 465,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 460, 461,
 &end
#
#   30 GLN  HB-          30 GLN  HA          2.60    (#    787:20  Unique         2.37, 2.74 A)
 &rst
  ixpk= 787, nxpk= 20, iat=  -1, 467, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 469, 470,
 &end
#
#   30 GLN  HB+          30 GLN  HA          2.60    (#    788:20  Unique         2.37, 2.74 A)
 &rst
  ixpk= 788, nxpk= 20, iat=  -1, 467, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 469, 470,
 &end
#
#   30 GLN  HG+          30 GLN  HA          4.40    (#    789:20  Unique         2.45, 3.02 A)
 &rst
  ixpk= 789, nxpk= 20, iat=  -1, 467, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 472, 473,
 &end
#
#    0 AMB  20-2:790     30 GLN  HA          5.50    (#    790:20  Single Ambig)
 &rst
  ixpk= 790, nxpk= 20, iat=  -1, 467, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 460, 461, 503, 504,
 &end
#
#   32 SER  HN           30 GLN  HA          5.50    (#    792:20  Unique         3.29, 4.31 A)
 &rst
  ixpk= 792, nxpk= 20, iat= 499, 467, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   30 GLN  HN           30 GLN  HA          3.50    (#    793:20  Unique         2.28, 2.88 A)
 &rst
  ixpk= 793, nxpk= 20, iat= 465, 467, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   31 HIS  HN           30 GLN  HA          3.50    (#    794:20  Unique         2.15, 2.59 A)
 &rst
  ixpk= 794, nxpk= 20, iat= 482, 467, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   31 HIS  HN           31 HIS  HA          5.50    (#    796:20  Unique         2.78, 2.90 A)
 &rst
  ixpk= 796, nxpk= 20, iat= 482, 484, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   31 HIS  HB+          31 HIS  HA          3.50    (#    798:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 798, nxpk= 20, iat=  -1, 484, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 486, 487,
 &end
#
#   31 HIS  HB-          31 HIS  HA          3.50    (#    799:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 799, nxpk= 20, iat=  -1, 484, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 486, 487,
 &end
#
#   31 HIS  HA           31 HIS  HB+         3.50    (#    800:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 800, nxpk= 20, iat= 484,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 486, 487,
 &end
#
#   31 HIS  HA           31 HIS  HB-         4.40    (#    801:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 801, nxpk= 20, iat= 484,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 486, 487,
 &end
#
#   32 SER  HB+          32 SER  HA          2.60    (#    803:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 803, nxpk= 20, iat=  -1, 501, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 503, 504,
 &end
#
#   32 SER  HB-          32 SER  HA          2.60    (#    804:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 804, nxpk= 20, iat=  -1, 501, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 503, 504,
 &end
#
#    0 AMB  20-2:807      0 AMB  20-1:807    3.50    (#    807:20  Double Ambig)
 &rst
  ixpk= 807, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 510, 482,
 igr2= 503, 504, 503, 504,
 &end
#
#    0 AMB  20-2:808     32 SER  HB-         3.50    (#    808:20  Single Ambig)
 &rst
  ixpk= 808, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 510, 482,
 igr2= 503, 504,
 &end
#
#   33 TRP  HD1          32 SER  HB-         5.50    (#    809:20  Unique         4.63, 5.56 A)
 &rst
  ixpk= 809, nxpk= 20, iat= 518,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 503, 504,
 &end
#
#   32 SER  HN           32 SER  HB+         3.50    (#    810:20  Unique         2.27, 3.05 A)
 &rst
  ixpk= 810, nxpk= 20, iat= 499,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 503, 504,
 &end
#
#   32 SER  HN           32 SER  HB-         3.50    (#    811:20  Unique         2.27, 3.05 A)
 &rst
  ixpk= 811, nxpk= 20, iat= 499,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 503, 504,
 &end
#
#   32 SER  HA           32 SER  HB+         2.60    (#    812:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 812, nxpk= 20, iat= 501,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 503, 504,
 &end
#
#   32 SER  HA           32 SER  HB-         2.60    (#    813:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 813, nxpk= 20, iat= 501,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 503, 504,
 &end
#
#   30 GLN  HB+          32 SER  HB-         5.50    (#    816:20  Unique         3.16, 4.84 A)
 &rst
  ixpk= 816, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 469, 470,
 igr2= 503, 504,
 &end
#
#   30 GLN  HB+          32 SER  HB+         5.50    (#    817:20  Unique         3.16, 4.84 A)
 &rst
  ixpk= 817, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 469, 470,
 igr2= 503, 504,
 &end
#
#   30 GLN  HB-          32 SER  HB+         5.50    (#    818:20  Unique         3.16, 4.84 A)
 &rst
  ixpk= 818, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 469, 470,
 igr2= 503, 504,
 &end
#
#    0 AMB  20-2:819     33 TRP  HA          5.70    (#    819:20  Single Ambig)
 &rst
  ixpk= 819, nxpk= 20, iat=  -1, 512, r1= 0.00, r2= 1.80, r3= 6.85, r4= 7.60,
 igr1= 525,2378,2383,
 &end
#
#   34 GLN  HG+          33 TRP  HA          4.40    (#    820:20  Unique         3.81, 5.37 A)
 &rst
  ixpk= 820, nxpk= 20, iat=  -1, 512, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 541, 542,
 &end
#
#    0 AMB  20-2:821      0 AMB  20-1:821    5.50    (#    821:20  Double Ambig)
 &rst
  ixpk= 821, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 469, 470,2023,2024,
 igr2= 416, 512,
 &end
#
#  155 VAL  MGX         155 VAL  HB          2.60    (#    823:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 823, nxpk= 20, iat=  -1,2568, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2570,2571,2572,2574,2575,2576,
 &end
#
#  155 VAL  MGY         155 VAL  HB          2.60    (#    824:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 824, nxpk= 20, iat=  -1,2568, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2570,2571,2572,2574,2575,2576,
 &end
#
#  155 VAL  HA          155 VAL  HB          3.50    (#    825:20  Unique         2.55, 2.86 A)
 &rst
  ixpk= 825, nxpk= 20, iat=2566,2568, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  152 ALA  HA          155 VAL  HB          4.40    (#    826:20  Unique         2.56, 3.51 A)
 &rst
  ixpk= 826, nxpk= 20, iat=2529,2568, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  155 VAL  HN          155 VAL  HB          2.60    (#    827:20  Unique         2.52, 2.92 A)
 &rst
  ixpk= 827, nxpk= 20, iat=2564,2568, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  156 MET  HN          155 VAL  HB          3.50    (#    828:20  Unique         2.58, 3.04 A)
 &rst
  ixpk= 828, nxpk= 20, iat=2580,2568, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  117 SER  HN          116 SER  HA          2.60    (#    830:20  Unique         2.35, 2.40 A)
 &rst
  ixpk= 830, nxpk= 20, iat=1902,1893, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  116 SER  HN          116 SER  HA          3.50    (#    831:20  Unique         2.81, 2.88 A)
 &rst
  ixpk= 831, nxpk= 20, iat=1891,1893, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  118 THR  HN          116 SER  HA          4.40    (#    832:20  Unique         4.56, 4.71 A)
 &rst
  ixpk= 832, nxpk= 20, iat=1913,1893, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  116 SER  HB-         116 SER  HA          2.60    (#    833:20  Unique         2.37, 2.79 A)
 &rst
  ixpk= 833, nxpk= 20, iat=  -1,1893, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1895,1896,
 &end
#
#  116 SER  HB+         116 SER  HA          2.60    (#    834:20  Unique         2.37, 2.79 A)
 &rst
  ixpk= 834, nxpk= 20, iat=  -1,1893, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1895,1896,
 &end
#
#   34 GLN  HA           34 GLN  HB-         5.50    (#    835:20  Unique         2.37, 2.79 A)
 &rst
  ixpk= 835, nxpk= 20, iat= 536,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 538, 539,
 &end
#
#   34 GLN  HA           34 GLN  HB+         5.50    (#    836:20  Unique         2.37, 2.79 A)
 &rst
  ixpk= 836, nxpk= 20, iat= 536,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 538, 539,
 &end
#
#    0 AMB  20-2:840     66 ARG  HB-         3.50    (#    840:20  Single Ambig)
 &rst
  ixpk= 840, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1745,1746,1747,1749,1750,1751,1073,1074,1075,1077,
      1078,1079,
 igr2=1025,1026,
 &end
#
#  105 VAL  MGY          66 ARG  HB-         3.50    (#    841:20  Unique         2.68, 5.86 A)
 &rst
  ixpk= 841, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1745,1746,1747,1749,1750,1751,
 igr2=1025,1026,
 &end
#
#   89 LYS  HG-          89 LYS  HB-         2.60    (#    842:20  Unique         2.32, 2.71 A)
 &rst
  ixpk= 842, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1461,1462,
 igr2=1458,1459,
 &end
#
#   78 LYS  HG-          78 LYS  HB-         2.60    (#    843:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 843, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1251,1252,
 igr2=1248,1249,
 &end
#
#   66 ARG  HD+          66 ARG  HB-         3.50    (#    844:20  Unique         2.24, 3.42 A)
 &rst
  ixpk= 844, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1031,1032,
 igr2=1025,1026,
 &end
#
#   89 LYS  HA           89 LYS  HB-         2.60    (#    845:20  Unique         2.27, 2.48 A)
 &rst
  ixpk= 845, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1458,1459,
 &end
#
#    0 AMB  20-2:846      0 AMB  20-1:846    4.10    (#    846:20  Double Ambig)
 &rst
  ixpk= 846, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.80, r4= 6.55,
 igr1=1486,1722,
 igr2=1458,1459,1025,1026,
 &end
#
#   66 ARG  HA           66 ARG  HB-         2.60    (#    847:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 847, nxpk= 20, iat=1023,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1025,1026,
 &end
#
#   89 LYS  HN           89 LYS  HB-         3.50    (#    849:20  Unique         2.13, 2.79 A)
 &rst
  ixpk= 849, nxpk= 20, iat=1454,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1458,1459,
 &end
#
#   66 ARG  HN           66 ARG  HB-         3.50    (#    850:20  Unique         2.98, 3.49 A)
 &rst
  ixpk= 850, nxpk= 20, iat=1021,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1025,1026,
 &end
#
#   67 ILE  HN           66 ARG  HB-         3.50    (#    851:20  Unique         2.88, 3.61 A)
 &rst
  ixpk= 851, nxpk= 20, iat=1045,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1025,1026,
 &end
#
#    0 AMB  20-2:853     34 GLN  HA          5.50    (#    853:20  Single Ambig)
 &rst
  ixpk= 853, nxpk= 20, iat=  -1, 536, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 369,2149,2154,
 &end
#
#    0 AMB  20-2:858      0 AMB  20-1:858    5.50    (#    858:20  Double Ambig)
 &rst
  ixpk= 858, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1384,1385,1483,1484, 656, 657,
 igr2=1430,  66,
 &end
#
#   35 PHE  HA           35 PHE  HB+         5.50    (#    860:20  Unique         2.36, 2.78 A)
 &rst
  ixpk= 860, nxpk= 20, iat= 553,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 555, 556,
 &end
#
#   35 PHE  HA           35 PHE  HB-         3.50    (#    861:20  Unique         2.36, 2.78 A)
 &rst
  ixpk= 861, nxpk= 20, iat= 553,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 555, 556,
 &end
#
#   43 GLY  HN           42 PRO  HB+         4.40    (#    870:20  Unique         4.13, 4.39 A)
 &rst
  ixpk= 870, nxpk= 20, iat= 663,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 656, 657,
 &end
#
#    0 AMB  20-2:871      0 AMB  20-1:871    5.50    (#    871:20  Double Ambig)
 &rst
  ixpk= 871, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1720, 663, 879,
 igr2=1707,1708, 656, 657, 578, 579,
 &end
#
#  103 GLN  HE2+        103 GLN  HB+         5.50    (#    872:20  Unique         1.93, 3.70 A)
 &rst
  ixpk= 872, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1715,1716,
 igr2=1707,1708,
 &end
#
#   42 PRO  HA           42 PRO  HB+         2.60    (#    873:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 873, nxpk= 20, iat= 659,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 656, 657,
 &end
#
#   42 PRO  HA           42 PRO  HB-         3.50    (#    874:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 874, nxpk= 20, iat= 659,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 656, 657,
 &end
#
#   42 PRO  HD+          42 PRO  HB+         4.40    (#    875:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 875, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 650, 651,
 igr2= 656, 657,
 &end
#
#   42 PRO  HD+          42 PRO  HB-         5.50    (#    876:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 876, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 650, 651,
 igr2= 656, 657,
 &end
#
#   42 PRO  HD-          42 PRO  HB+         5.50    (#    877:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 877, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 650, 651,
 igr2= 656, 657,
 &end
#
#   42 PRO  HD-          42 PRO  HB-         5.50    (#    878:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 878, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 650, 651,
 igr2= 656, 657,
 &end
#
#    0 AMB  20-2:880      0 AMB  20-1:880    2.60    (#    880:20  Double Ambig)
 &rst
  ixpk= 880, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 653, 654,   8,   9,
 igr2= 656, 657, 656, 657,
 &end
#
#    0 AMB  20-2:881      0 AMB  20-1:881    2.60    (#    881:20  Double Ambig)
 &rst
  ixpk= 881, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.28, r4= 5.03,
 igr1=  15,  16,  17, 653, 654,
 igr2= 656, 657, 656, 657,
 &end
#
#    0 AMB  20-2:882      0 AMB  20-1:882    2.60    (#    882:20  Double Ambig)
 &rst
  ixpk= 882, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.53, r4= 5.28,
 igr1=  15,  16,  17,1710,1711, 653, 654,
 igr2= 656, 657,1707,1708,
 &end
#
#    0 AMB  20-2:883      0 AMB  20-1:883    2.60    (#    883:20  Double Ambig)
 &rst
  ixpk= 883, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 883, 884, 653, 654,
 igr2= 578, 579, 656, 657,
 &end
#
#   42 PRO  HB-          42 PRO  HG+         2.60    (#    886:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 886, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 656, 657,
 igr2= 653, 654,
 &end
#
#   42 PRO  HB-          42 PRO  HG-         2.60    (#    887:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 887, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 656, 657,
 igr2= 653, 654,
 &end
#
#   42 PRO  HB+          42 PRO  HG+         2.60    (#    888:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 888, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 656, 657,
 igr2= 653, 654,
 &end
#
#   42 PRO  HB+          42 PRO  HG-         2.60    (#    889:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 889, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 656, 657,
 igr2= 653, 654,
 &end
#
#   41 ASN  HB+          42 PRO  HG-         5.50    (#    891:20  Unique         3.65, 5.03 A)
 &rst
  ixpk= 891, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 639, 640,
 igr2= 653, 654,
 &end
#
#   42 PRO  HD-          42 PRO  HG+         3.50    (#    892:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 892, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 650, 651,
 igr2= 653, 654,
 &end
#
#   42 PRO  HD-          42 PRO  HG-         3.50    (#    893:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 893, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 650, 651,
 igr2= 653, 654,
 &end
#
#   42 PRO  HD+          42 PRO  HG+         3.50    (#    894:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 894, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 650, 651,
 igr2= 653, 654,
 &end
#
#   42 PRO  HD+          42 PRO  HG-         3.50    (#    895:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 895, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 650, 651,
 igr2= 653, 654,
 &end
#
#   42 PRO  HA           42 PRO  HG+         4.40    (#    896:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 896, nxpk= 20, iat= 659,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 653, 654,
 &end
#
#   42 PRO  HA           42 PRO  HG-         4.40    (#    897:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 897, nxpk= 20, iat= 659,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 653, 654,
 &end
#
#   41 ASN  HA           42 PRO  HG-         4.40    (#    899:20  Unique         4.54, 4.59 A)
 &rst
  ixpk= 899, nxpk= 20, iat= 637,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 653, 654,
 &end
#
#   41 ASN  HA           42 PRO  HG+         4.40    (#    900:20  Unique         4.54, 4.59 A)
 &rst
  ixpk= 900, nxpk= 20, iat= 637,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 653, 654,
 &end
#
#   41 ASN  HN           42 PRO  HD+         5.50    (#    902:20  Unique         4.63, 4.89 A)
 &rst
  ixpk= 902, nxpk= 20, iat= 635,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 650, 651,
 &end
#
#   44 GLU  HN           42 PRO  HD-         5.50    (#    903:20  Unique         4.56, 5.54 A)
 &rst
  ixpk= 903, nxpk= 20, iat= 670,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 650, 651,
 &end
#
#   41 ASN  HD2+         42 PRO  HD+         5.50    (#    904:20  Unique         1.97, 3.69 A)
 &rst
  ixpk= 904, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 650, 651,
 &end
#
#   41 ASN  HD2+         42 PRO  HD-         5.50    (#    905:20  Unique         1.97, 3.69 A)
 &rst
  ixpk= 905, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 650, 651,
 &end
#
#   41 ASN  HD2-         42 PRO  HD-         5.50    (#    906:20  Unique         1.97, 3.69 A)
 &rst
  ixpk= 906, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 650, 651,
 &end
#
#   41 ASN  HD2-         42 PRO  HD+         5.50    (#    907:20  Unique         1.97, 3.69 A)
 &rst
  ixpk= 907, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 650, 651,
 &end
#
#   41 ASN  HA           42 PRO  HD-         2.60    (#    909:20  Unique         2.35, 2.45 A)
 &rst
  ixpk= 909, nxpk= 20, iat= 637,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 650, 651,
 &end
#
#   41 ASN  HA           42 PRO  HD+         2.60    (#    910:20  Unique         2.35, 2.45 A)
 &rst
  ixpk= 910, nxpk= 20, iat= 637,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 650, 651,
 &end
#
#   41 ASN  HB+          42 PRO  HD+         3.50    (#    911:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 911, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   41 ASN  HB+          42 PRO  HD-         3.50    (#    912:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 912, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   41 ASN  HB-          42 PRO  HD-         3.50    (#    913:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 913, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   41 ASN  HB-          42 PRO  HD+         4.40    (#    914:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 914, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   42 PRO  HB+          42 PRO  HD-         4.40    (#    915:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 915, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#   42 PRO  HB+          42 PRO  HD+         5.50    (#    916:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 916, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#    0 AMB  20-2:917      0 AMB  20-1:917    3.50    (#    917:20  Double Ambig)
 &rst
  ixpk= 917, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 653, 654,   8,   9,
 igr2= 650, 651, 650, 651,
 &end
#
#    0 AMB  20-2:918     42 PRO  HD-         2.60    (#    918:20  Single Ambig)
 &rst
  ixpk= 918, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 653, 654,   8,   9,
 igr2= 650, 651,
 &end
#
#    0 AMB  20-2:919     42 PRO  HD-         3.50    (#    919:20  Single Ambig)
 &rst
  ixpk= 919, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 653, 654,  15,  16,  17,
 igr2= 650, 651,
 &end
#
#    0 AMB  20-2:920      0 AMB  20-1:920    3.50    (#    920:20  Double Ambig)
 &rst
  ixpk= 920, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 653, 654,  15,  16,  17,
 igr2= 650, 651, 650, 651,
 &end
#
#   42 PRO  HB-          42 PRO  HD+         4.40    (#    921:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 921, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#   42 PRO  HB-          42 PRO  HD-         3.50    (#    922:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 922, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#    0 AMB  20-2:925     37 GLN  HA          5.50    (#    925:20  Single Ambig)
 &rst
  ixpk= 925, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 8.54, r4= 9.29,
 igr1= 185, 186, 187, 834, 835, 836, 838, 839, 840, 227,
       228, 229, 224, 225,
 &end
#
#   37 GLN  HB-          37 GLN  HA          2.60    (#    926:20  Unique         2.32, 2.73 A)
 &rst
  ixpk= 926, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 589, 590,
 &end
#
#   37 GLN  HB+          37 GLN  HA          2.60    (#    927:20  Unique         2.32, 2.73 A)
 &rst
  ixpk= 927, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 589, 590,
 &end
#
#   37 GLN  HG+          37 GLN  HA          3.50    (#    928:20  Unique         2.17, 2.93 A)
 &rst
  ixpk= 928, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 592, 593,
 &end
#
#    0 AMB  20-2:929     37 GLN  HA          3.50    (#    929:20  Single Ambig)
 &rst
  ixpk= 929, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 174, 175, 174, 175,
 &end
#
#   13 ILE  HN           37 GLN  HA          3.50    (#    931:20  Unique         3.28, 3.79 A)
 &rst
  ixpk= 931, nxpk= 20, iat= 179, 587, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   37 GLN  HN           37 GLN  HA          4.40    (#    932:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 932, nxpk= 20, iat= 585, 587, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   38 GLY  HN           37 GLN  HA          2.60    (#    933:20  Unique         2.20, 2.29 A)
 &rst
  ixpk= 933, nxpk= 20, iat= 602, 587, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  103 GLN  HA          103 GLN  HG+         3.50    (#    934:20  Unique         2.74, 3.35 A)
 &rst
  ixpk= 934, nxpk= 20, iat=1705,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1710,1711,
 &end
#
#   37 GLN  HA           37 GLN  HB-         3.50    (#    936:20  Unique         2.32, 2.73 A)
 &rst
  ixpk= 936, nxpk= 20, iat= 587,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 589, 590,
 &end
#
#   40 ILE  QD1           9 PRO  HB+         2.60    (#    937:20  Unique         2.00, 3.74 A)
 &rst
  ixpk= 937, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 629, 630, 631,
 igr2= 135, 136,
 &end
#
#    0 AMB  20-2:938      0 AMB  20-1:938    3.50    (#    938:20  Double Ambig)
 &rst
  ixpk= 938, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 620, 626, 627,
 igr2= 135, 136, 135, 136,
 &end
#
#  111 ILE  QG2          58 VAL  HB          4.40    (#    939:20  Unique         2.37, 5.25 A)
 &rst
  ixpk= 939, nxpk= 20, iat=  -1, 898, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1816,1817,1818,
 &end
#
#    0 AMB  20-2:940     58 VAL  HB          3.50    (#    940:20  Single Ambig)
 &rst
  ixpk= 940, nxpk= 20, iat=  -1, 898, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#    0 AMB  20-2:941     58 VAL  HB          2.60    (#    941:20  Single Ambig)
 &rst
  ixpk= 941, nxpk= 20, iat=  -1, 898, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,
 &end
#
#   95 GLN  HA           95 GLN  HG-         5.50    (#    943:20  Unique         3.25, 3.78 A)
 &rst
  ixpk= 943, nxpk= 20, iat=1545,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1550,1551,
 &end
#
#   60 LEU  HN           58 VAL  HB          3.80    (#    944:20  Unique         2.48, 3.29 A)
 &rst
  ixpk= 944, nxpk= 20, iat= 917, 898, r1= 0.00, r2= 1.80, r3= 3.80, r4= 4.55,  &end
#
#    0 AMB  20-2:945      0 AMB  20-1:945    4.40    (#    945:20  Double Ambig)
 &rst
  ixpk= 945, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 894,1640,
 igr2= 898, 592, 593,
 &end
#
#   30 GLN  HE2+         30 GLN  HG+         3.50    (#    946:20  Unique         2.12, 3.20 A)
 &rst
  ixpk= 946, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 477, 478,
 igr2= 472, 473,
 &end
#
#    0 AMB  20-2:947      0 AMB  20-1:947    2.60    (#    947:20  Double Ambig)
 &rst
  ixpk= 947, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 465, 585,
 igr2= 472, 473, 592, 593,
 &end
#
#   38 GLY  HN           37 GLN  HG+         3.50    (#    948:20  Unique         3.03, 4.46 A)
 &rst
  ixpk= 948, nxpk= 20, iat= 602,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 592, 593,
 &end
#
#   11 VAL  HN           39 GLY  HA+         4.40    (#    949:20  Unique         2.16, 3.38 A)
 &rst
  ixpk= 949, nxpk= 20, iat= 156,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 611, 612,
 &end
#
#   38 GLY  HN           38 GLY  HA-         3.50    (#    950:20  Unique         2.51, 2.77 A)
 &rst
  ixpk= 950, nxpk= 20, iat= 602,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 604, 605,
 &end
#
#   39 GLY  HN           39 GLY  HA+         3.50    (#    951:20  Unique         2.29, 2.58 A)
 &rst
  ixpk= 951, nxpk= 20, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 611, 612,
 &end
#
#   39 GLY  HN           38 GLY  HA-         3.50    (#    952:20  Unique         2.74, 3.25 A)
 &rst
  ixpk= 952, nxpk= 20, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 604, 605,
 &end
#
#   40 ILE  HN           39 GLY  HA+         3.50    (#    953:20  Unique         2.14, 2.60 A)
 &rst
  ixpk= 953, nxpk= 20, iat= 616,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 611, 612,
 &end
#
#   10 ASN  HD2+         39 GLY  HA+         5.50    (#    954:20  Unique         3.17, 4.01 A)
 &rst
  ixpk= 954, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 151, 152,
 igr2= 611, 612,
 &end
#
#   10 ASN  HA           39 GLY  HA+         3.50    (#    955:20  Unique         1.82, 2.70 A)
 &rst
  ixpk= 955, nxpk= 20, iat= 144,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 611, 612,
 &end
#
#   39 GLY  HA-          38 GLY  HA-         4.40    (#    959:20  Unique         4.33, 4.86 A)
 &rst
  ixpk= 959, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 611, 612,
 igr2= 604, 605,
 &end
#
#    0 AMB  20-2:960      0 AMB  20-1:960    5.50    (#    960:20  Double Ambig)
 &rst
  ixpk= 960, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.17, r4=10.92,
 igr1= 626, 627, 742, 743, 744,
 igr2= 611, 612, 611, 612, 604, 605, 604, 605,
 &end
#
#    0 AMB  20-2:961      0 AMB  20-1:961    5.50    (#    961:20  Double Ambig)
 &rst
  ixpk= 961, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=12.59, r4=13.34,
 igr1= 132, 133, 111, 112, 829, 830, 108, 109, 108, 109,
      1612,1613,
 igr2= 611, 612, 611, 612, 604, 605, 611, 612, 611, 612,
       611, 612,
 &end
#
#   10 ASN  HA           39 GLY  HA-         3.50    (#    962:20  Unique         1.82, 2.70 A)
 &rst
  ixpk= 962, nxpk= 20, iat= 144,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 611, 612,
 &end
#
#   40 ILE  HN           39 GLY  HA-         3.50    (#    963:20  Unique         2.14, 2.60 A)
 &rst
  ixpk= 963, nxpk= 20, iat= 616,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 611, 612,
 &end
#
#   39 GLY  HN           39 GLY  HA-         2.60    (#    964:20  Unique         2.29, 2.58 A)
 &rst
  ixpk= 964, nxpk= 20, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 611, 612,
 &end
#
#   41 ASN  HN           40 ILE  HA          3.50    (#    965:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 965, nxpk= 20, iat= 635, 618, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   40 ILE  HN           40 ILE  HA          5.50    (#    967:20  Unique         2.86, 2.91 A)
 &rst
  ixpk= 967, nxpk= 20, iat= 616, 618, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:968     40 ILE  HA          2.60    (#    968:20  Single Ambig)
 &rst
  ixpk= 968, nxpk= 20, iat=  -1, 618, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1= 742, 743, 744, 626, 627,
 &end
#
#   40 ILE  QG2          40 ILE  HA          2.60    (#    969:20  Unique         2.34, 3.13 A)
 &rst
  ixpk= 969, nxpk= 20, iat=  -1, 618, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1= 622, 623, 624,
 &end
#
#   40 ILE  HG1+         40 ILE  HA          3.50    (#    970:20  Unique         2.45, 2.76 A)
 &rst
  ixpk= 970, nxpk= 20, iat=  -1, 618, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 626, 627,
 &end
#
#    0 AMB  20-2:971     40 ILE  HB          2.60    (#    971:20  Single Ambig)
 &rst
  ixpk= 971, nxpk= 20, iat=  -1, 620, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 622, 623, 624, 629, 630, 631,
 &end
#
#   40 ILE  HG1-         40 ILE  HB          2.60    (#    972:20  Unique         2.42, 2.75 A)
 &rst
  ixpk= 972, nxpk= 20, iat=  -1, 620, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 626, 627,
 &end
#
#    9 PRO  HG-          40 ILE  HB          5.50    (#    973:20  Unique         2.00, 2.90 A)
 &rst
  ixpk= 973, nxpk= 20, iat=  -1, 620, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 132, 133,
 &end
#
#    9 PRO  HB+          40 ILE  HB          5.50    (#    974:20  Unique         1.93, 2.77 A)
 &rst
  ixpk= 974, nxpk= 20, iat=  -1, 620, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 135, 136,
 &end
#
#    9 PRO  HG+          40 ILE  HB          5.50    (#    975:20  Unique         2.00, 2.90 A)
 &rst
  ixpk= 975, nxpk= 20, iat=  -1, 620, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 132, 133,
 &end
#
#   40 ILE  HA           40 ILE  HB          5.50    (#    976:20  Unique         3.01, 3.02 A)
 &rst
  ixpk= 976, nxpk= 20, iat= 618, 620, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   40 ILE  HN           40 ILE  HB          3.50    (#    977:20  Unique         2.41, 2.50 A)
 &rst
  ixpk= 977, nxpk= 20, iat= 616, 620, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:978     40 ILE  HB          5.50    (#    978:20  Single Ambig)
 &rst
  ixpk= 978, nxpk= 20, iat=  -1, 620, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 151, 152,1171,
 &end
#
#   40 ILE  HN           40 ILE  HG1+        5.50    (#    980:20  Unique         2.07, 3.08 A)
 &rst
  ixpk= 980, nxpk= 20, iat= 616,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 626, 627,
 &end
#
#   40 ILE  HN           40 ILE  HG1-        5.50    (#    981:20  Unique         2.07, 3.08 A)
 &rst
  ixpk= 981, nxpk= 20, iat= 616,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 626, 627,
 &end
#
#   40 ILE  QD1          40 ILE  HG1-        2.60    (#    983:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 983, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 629, 630, 631,
 igr2= 626, 627,
 &end
#
#   40 ILE  QD1          40 ILE  HG1+        2.60    (#    984:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 984, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 629, 630, 631,
 igr2= 626, 627,
 &end
#
#   40 ILE  HA           40 ILE  HG1+        5.50    (#    985:20  Unique         2.45, 2.76 A)
 &rst
  ixpk= 985, nxpk= 20, iat= 618,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 626, 627,
 &end
#
#    0 AMB  20-2:987     40 ILE  QD1         4.40    (#    987:20  Single Ambig)
 &rst
  ixpk= 987, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 156, 635,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  20-2:988     40 ILE  QD1         4.40    (#    988:20  Single Ambig)
 &rst
  ixpk= 988, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1169, 733, 734,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  HN           40 ILE  QD1         3.50    (#    989:20  Unique         3.84, 4.63 A)
 &rst
  ixpk= 989, nxpk= 20, iat= 616,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 629, 630, 631,
 &end
#
#   74 TRP  HH2          40 ILE  QD1         2.60    (#    990:20  Unique         3.30, 4.35 A)
 &rst
  ixpk= 990, nxpk= 20, iat=1171,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  20-2:991     40 ILE  QD1         3.50    (#    991:20  Single Ambig)
 &rst
  ixpk= 991, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 158, 144,
 igr2= 629, 630, 631,
 &end
#
#    9 PRO  HA           40 ILE  QD1         4.40    (#    992:20  Unique         4.05, 5.09 A)
 &rst
  ixpk= 992, nxpk= 20, iat= 138,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  20-2:993     40 ILE  QD1         5.50    (#    993:20  Single Ambig)
 &rst
  ixpk= 993, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1= 611, 612, 659,
 igr2= 629, 630, 631,
 &end
#
#   46 ALA  HA           40 ILE  QD1         2.60    (#    994:20  Unique         1.95, 3.34 A)
 &rst
  ixpk= 994, nxpk= 20, iat= 698,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  20-2:995     40 ILE  QD1         3.50    (#    995:20  Single Ambig)
 &rst
  ixpk= 995, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 132, 133, 677, 678,1586,1587,
 igr2= 629, 630, 631,
 &end
#
#    9 PRO  HB+          40 ILE  QD1         2.60    (#    996:20  Unique         2.00, 3.74 A)
 &rst
  ixpk= 996, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 135, 136,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  20-2:997     40 ILE  QD1         2.60    (#    997:20  Single Ambig)
 &rst
  ixpk= 997, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1= 135, 136, 160,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  20-2:998     40 ILE  QD1         2.60    (#    998:20  Single Ambig)
 &rst
  ixpk= 998, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1= 626, 627, 742, 743, 744, 700, 701, 702,
 igr2= 629, 630, 631,
 &end
#
#   98 LYS  HD-          40 ILE  QD1         4.40    (#   1001:20  Unique         1.94, 4.89 A)
 &rst
  ixpk= 1001, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1609,1610,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  HG1+         40 ILE  QD1         2.60    (#   1002:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1002, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 626, 627,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  HG1+         40 ILE  QG2         2.60    (#   1003:20  Unique         2.42, 3.50 A)
 &rst
  ixpk= 1003, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 626, 627,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  20-2:1004    40 ILE  QG2         2.60    (#   1004:20  Single Ambig)
 &rst
  ixpk= 1004, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.08, r4= 4.83,
 igr1= 742, 743, 744, 626, 627,
 igr2= 622, 623, 624,
 &end
#
#    9 PRO  HB-          40 ILE  QG2         3.50    (#   1005:20  Unique         3.19, 4.65 A)
 &rst
  ixpk= 1005, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 135, 136,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  20-2:1006    40 ILE  QG2         3.50    (#   1006:20  Single Ambig)
 &rst
  ixpk= 1006, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1= 135, 136,  15,  16,  17,1573,1574,
 igr2= 622, 623, 624,
 &end
#
#   44 GLU  HB+          40 ILE  QG2         2.60    (#   1007:20  Unique         1.97, 3.37 A)
 &rst
  ixpk= 1007, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 674, 675,
 igr2= 622, 623, 624,
 &end
#
#   41 ASN  HB-          40 ILE  QG2         5.50    (#   1008:20  Unique         3.33, 5.05 A)
 &rst
  ixpk= 1008, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 639, 640,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  HA           40 ILE  QG2         2.60    (#   1009:20  Unique         2.34, 3.13 A)
 &rst
  ixpk= 1009, nxpk= 20, iat= 618,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  20-2:1011    40 ILE  QG2         4.40    (#   1011:20  Single Ambig)
 &rst
  ixpk= 1011, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1171, 151, 152,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  HN           40 ILE  QG2         4.40    (#   1012:20  Unique         4.28, 4.56 A)
 &rst
  ixpk= 1012, nxpk= 20, iat= 616,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 622, 623, 624,
 &end
#
#   44 GLU  HN           40 ILE  QG2         4.40    (#   1013:20  Unique         2.76, 3.60 A)
 &rst
  ixpk= 1013, nxpk= 20, iat= 670,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 622, 623, 624,
 &end
#
#   49 ALA  HN           40 ILE  QG2         4.40    (#   1014:20  Unique         3.79, 4.85 A)
 &rst
  ixpk= 1014, nxpk= 20, iat= 738,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 622, 623, 624,
 &end
#
#   41 ASN  HN           40 ILE  QG2         3.50    (#   1016:20  Unique         2.06, 3.28 A)
 &rst
  ixpk= 1016, nxpk= 20, iat= 635,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 622, 623, 624,
 &end
#
#   41 ASN  HN           41 ASN  HA          3.50    (#   1017:20  Unique         2.75, 2.79 A)
 &rst
  ixpk= 1017, nxpk= 20, iat= 635, 637, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   44 GLU  HN           41 ASN  HA          5.50    (#   1018:20  Unique         4.67, 5.03 A)
 &rst
  ixpk= 1018, nxpk= 20, iat= 670, 637, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   44 GLU  HG-          41 ASN  HB+         5.50    (#   1021:20  Unique         2.00, 3.74 A)
 &rst
  ixpk= 1021, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 677, 678,
 igr2= 639, 640,
 &end
#
#   42 PRO  HD-          41 ASN  HB+         3.50    (#   1022:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 1022, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 650, 651,
 igr2= 639, 640,
 &end
#
#   42 PRO  HD-          41 ASN  HB-         4.40    (#   1023:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 1023, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 650, 651,
 igr2= 639, 640,
 &end
#
#   42 PRO  HD+          41 ASN  HB+         5.50    (#   1024:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 1024, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 650, 651,
 igr2= 639, 640,
 &end
#
#   41 ASN  HA           41 ASN  HB+         3.50    (#   1026:20  Unique         2.25, 2.82 A)
 &rst
  ixpk= 1026, nxpk= 20, iat= 637,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 639, 640,
 &end
#
#   41 ASN  HA           41 ASN  HB-         5.50    (#   1027:20  Unique         2.25, 2.82 A)
 &rst
  ixpk= 1027, nxpk= 20, iat= 637,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 639, 640,
 &end
#
#   41 ASN  HD2-         41 ASN  HB+         4.40    (#   1028:20  Unique         2.12, 3.15 A)
 &rst
  ixpk= 1028, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   41 ASN  HD2-         41 ASN  HB-         5.50    (#   1029:20  Unique         2.12, 3.15 A)
 &rst
  ixpk= 1029, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   41 ASN  HD2+         41 ASN  HB+         5.50    (#   1030:20  Unique         2.12, 3.15 A)
 &rst
  ixpk= 1030, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   41 ASN  HD2+         41 ASN  HB-         4.40    (#   1031:20  Unique         2.12, 3.15 A)
 &rst
  ixpk= 1031, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   41 ASN  HN           41 ASN  HB-         5.50    (#   1032:20  Unique         2.11, 2.81 A)
 &rst
  ixpk= 1032, nxpk= 20, iat= 635,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 639, 640,
 &end
#
#   41 ASN  HN           41 ASN  HB+         5.50    (#   1033:20  Unique         2.11, 2.81 A)
 &rst
  ixpk= 1033, nxpk= 20, iat= 635,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 639, 640,
 &end
#
#   43 GLY  HN           42 PRO  HA          2.60    (#   1034:20  Unique         2.29, 2.40 A)
 &rst
  ixpk= 1034, nxpk= 20, iat= 663, 659, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   44 GLU  HN           42 PRO  HA          4.40    (#   1035:20  Unique         3.88, 4.10 A)
 &rst
  ixpk= 1035, nxpk= 20, iat= 670, 659, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    9 PRO  HD+          42 PRO  HA          5.50    (#   1037:20  Unique         5.03, 5.73 A2.6)
 &rst
  ixpk= 1037, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 129, 130,
 &end
#
#   42 PRO  HD+          42 PRO  HA          5.50    (#   1038:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 1038, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 650, 651,
 &end
#
#   43 GLY  HA-          42 PRO  HA          4.40    (#   1039:20  Unique         4.35, 4.40 A)
 &rst
  ixpk= 1039, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 665, 666,
 &end
#
#   42 PRO  HD-          42 PRO  HA          5.50    (#   1040:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 1040, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 650, 651,
 &end
#
#   42 PRO  HB+          42 PRO  HA          2.60    (#   1041:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1041, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 656, 657,
 &end
#
#    0 AMB  20-2:1042    42 PRO  HA          3.50    (#   1042:20  Single Ambig)
 &rst
  ixpk= 1042, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 653, 654,   8,   9, 674, 675,
 &end
#
#    1 MET  ME           42 PRO  HA          3.50    (#   1043:20  Unique         2.00, 3.35 A)
 &rst
  ixpk= 1043, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=  15,  16,  17,
 &end
#
#   42 PRO  HB-          42 PRO  HA          2.60    (#   1044:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1044, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 656, 657,
 &end
#
#  103 GLN  HA          103 GLN  HB+         5.50    (#   1046:20  Unique         2.24, 2.62 A)
 &rst
  ixpk= 1046, nxpk= 20, iat=1705,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1707,1708,
 &end
#
#    0 AMB  20-2:1047   104 LEU  HA          3.50    (#   1047:20  Single Ambig)
 &rst
  ixpk= 1047, nxpk= 20, iat=  -1,1722, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1011,1012,1013,1015,1016,1017,1745,1746,1747,1749,
      1750,1751,
 &end
#
#  104 LEU  MDX         104 LEU  HA          3.50    (#   1048:20  Unique         1.99, 3.66 A)
 &rst
  ixpk= 1048, nxpk= 20, iat=  -1,1722, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1729,1730,1731,1733,1734,1735,
 &end
#
#   44 GLU  HG-          44 GLU  HA          2.60    (#   1050:20  Unique         2.35, 3.11 A)
 &rst
  ixpk= 1050, nxpk= 20, iat=  -1, 672, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 677, 678,
 &end
#
#   44 GLU  HG+          44 GLU  HA          2.60    (#   1051:20  Unique         2.35, 3.11 A)
 &rst
  ixpk= 1051, nxpk= 20, iat=  -1, 672, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 677, 678,
 &end
#
#   44 GLU  HB+          44 GLU  HA          2.60    (#   1052:20  Unique         2.48, 2.82 A)
 &rst
  ixpk= 1052, nxpk= 20, iat=  -1, 672, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 674, 675,
 &end
#
#   48 GLN  HG+          44 GLU  HA          5.50    (#   1053:20  Unique         3.79, 4.95 A)
 &rst
  ixpk= 1053, nxpk= 20, iat=  -1, 672, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 728, 729,
 &end
#
#    0 AMB  20-2:1054     0 AMB  20-1:1054   4.40    (#   1054:20  Double Ambig)
 &rst
  ixpk= 1054, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1= 689, 690,1759,1760,1768,1769, 740, 723,
 igr2= 672,1722,
 &end
#
#   44 GLU  HN           44 GLU  HA          3.50    (#   1055:20  Unique         2.85, 2.93 A)
 &rst
  ixpk= 1055, nxpk= 20, iat= 670, 672, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   45 SER  HN           44 GLU  HA          2.60    (#   1056:20  Unique         2.22, 2.29 A)
 &rst
  ixpk= 1056, nxpk= 20, iat= 685, 672, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   43 GLY  HN           44 GLU  HA          5.50    (#   1057:20  Unique         4.62, 4.73 A)
 &rst
  ixpk= 1057, nxpk= 20, iat= 663, 672, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  105 VAL  HN          104 LEU  HA          3.50    (#   1058:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1058, nxpk= 20, iat=1739,1722, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   45 SER  HN           44 GLU  HB+         3.50    (#   1059:20  Unique         2.58, 3.60 A)
 &rst
  ixpk= 1059, nxpk= 20, iat= 685,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 674, 675,
 &end
#
#   49 ALA  HN           44 GLU  HB+         4.40    (#   1060:20  Unique         2.84, 4.12 A)
 &rst
  ixpk= 1060, nxpk= 20, iat= 738,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 674, 675,
 &end
#
#   44 GLU  HN           44 GLU  HB+         2.60    (#   1061:20  Unique         2.30, 2.83 A)
 &rst
  ixpk= 1061, nxpk= 20, iat= 670,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 674, 675,
 &end
#
#   44 GLU  HA           44 GLU  HB+         3.50    (#   1062:20  Unique         2.48, 2.82 A)
 &rst
  ixpk= 1062, nxpk= 20, iat= 672,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 674, 675,
 &end
#
#    0 AMB  20-2:1063     0 AMB  20-1:1063   4.40    (#   1063:20  Double Ambig)
 &rst
  ixpk= 1063, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 790, 791, 793, 794, 814, 815,
 igr2= 674, 675, 674, 675, 674, 675,
 &end
#
#   49 ALA  MB           44 GLU  HB+         4.40    (#   1064:20  Unique         1.99, 3.69 A)
 &rst
  ixpk= 1064, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 742, 743, 744,
 igr2= 674, 675,
 &end
#
#   40 ILE  QG2          44 GLU  HB+         2.60    (#   1065:20  Unique         1.97, 3.37 A)
 &rst
  ixpk= 1065, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 622, 623, 624,
 igr2= 674, 675,
 &end
#
#   40 ILE  QG2          44 GLU  HG+         4.40    (#   1066:20  Unique         3.05, 5.22 A)
 &rst
  ixpk= 1066, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 622, 623, 624,
 igr2= 677, 678,
 &end
#
#   40 ILE  QG2          44 GLU  HG-         4.40    (#   1067:20  Unique         3.05, 5.22 A)
 &rst
  ixpk= 1067, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 622, 623, 624,
 igr2= 677, 678,
 &end
#
#   49 ALA  MB           44 GLU  HG-         3.50    (#   1068:20  Unique         2.16, 4.56 A)
 &rst
  ixpk= 1068, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 742, 743, 744,
 igr2= 677, 678,
 &end
#
#   49 ALA  MB           44 GLU  HG+         4.40    (#   1069:20  Unique         2.16, 4.56 A)
 &rst
  ixpk= 1069, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 742, 743, 744,
 igr2= 677, 678,
 &end
#
#   47 GLU  HB-          47 GLU  HG+         2.60    (#   1070:20  Unique         2.21, 2.71 A)
 &rst
  ixpk= 1070, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 710, 711,
 igr2= 713, 714,
 &end
#
#   47 GLU  HA           47 GLU  HG+         3.50    (#   1071:20  Unique         2.08, 2.76 A)
 &rst
  ixpk= 1071, nxpk= 20, iat= 708,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 713, 714,
 &end
#
#    0 AMB  20-2:1072     0 AMB  20-1:1072   4.40    (#   1072:20  Double Ambig)
 &rst
  ixpk= 1072, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 740, 723,
 igr2= 677, 678, 713, 714,
 &end
#
#   44 GLU  HA           44 GLU  HG-         3.50    (#   1073:20  Unique         2.35, 3.11 A)
 &rst
  ixpk= 1073, nxpk= 20, iat= 672,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 677, 678,
 &end
#
#   44 GLU  HA           44 GLU  HG+         3.50    (#   1074:20  Unique         2.35, 3.11 A)
 &rst
  ixpk= 1074, nxpk= 20, iat= 672,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 677, 678,
 &end
#
#   51 TYR  HE           47 GLU  HG+         3.50    (#   1075:20  Unique         2.02, 3.84 A)
 &rst
  ixpk= 1075, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 775, 780,
 igr2= 713, 714,
 &end
#
#    0 AMB  20-2:1076     0 AMB  20-1:1076   3.50    (#   1076:20  Double Ambig)
 &rst
  ixpk= 1076, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 773, 782, 644, 645,
 igr2= 713, 714, 677, 678,
 &end
#
#  100 PHE  HE           47 GLU  HG+         5.50    (#   1077:20  Unique         4.07, 6.74 A)
 &rst
  ixpk= 1077, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1655,1659,
 igr2= 713, 714,
 &end
#
#   44 GLU  HN           44 GLU  HG+         3.50    (#   1078:20  Unique         4.32, 4.52 A)
 &rst
  ixpk= 1078, nxpk= 20, iat= 670,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 677, 678,
 &end
#
#   44 GLU  HN           44 GLU  HG-         3.50    (#   1079:20  Unique         4.32, 4.52 A)
 &rst
  ixpk= 1079, nxpk= 20, iat= 670,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 677, 678,
 &end
#
#   45 SER  HN           44 GLU  HG-         3.56    (#   1080:20  Unique         2.23, 3.68 A)
 &rst
  ixpk= 1080, nxpk= 20, iat= 685,  -1, r1= 0.00, r2= 1.80, r3= 4.00, r4= 4.75,
 igr2= 677, 678,
 &end
#
#   45 SER  HN           44 GLU  HG+         5.50    (#   1081:20  Unique         2.23, 3.68 A)
 &rst
  ixpk= 1081, nxpk= 20, iat= 685,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 677, 678,
 &end
#
#   41 ASN  HN           44 GLU  HG+         5.50    (#   1082:20  Unique         3.26, 4.38 A)
 &rst
  ixpk= 1082, nxpk= 20, iat= 635,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 677, 678,
 &end
#
#    0 AMB  20-2:1089    45 SER  HB-         3.50    (#   1089:20  Single Ambig)
 &rst
  ixpk= 1089, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 685, 706,
 igr2= 689, 690,
 &end
#
#    0 AMB  20-2:1090     0 AMB  20-1:1090   3.50    (#   1090:20  Double Ambig)
 &rst
  ixpk= 1090, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 685, 706,
 igr2= 689, 690, 689, 690,
 &end
#
#   46 ALA  HN           45 SER  HB+         3.50    (#   1091:20  Unique         2.04, 2.86 A)
 &rst
  ixpk= 1091, nxpk= 20, iat= 696,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 689, 690,
 &end
#
#   46 ALA  HN           45 SER  HB-         3.50    (#   1092:20  Unique         2.04, 2.86 A)
 &rst
  ixpk= 1092, nxpk= 20, iat= 696,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 689, 690,
 &end
#
#   46 ALA  HN           46 ALA  HA          3.50    (#   1093:20  Unique         2.78, 2.82 A)
 &rst
  ixpk= 1093, nxpk= 20, iat= 696, 698, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   47 GLU  HN           46 ALA  HA          5.50    (#   1094:20  Unique         3.55, 3.55 A)
 &rst
  ixpk= 1094, nxpk= 20, iat= 706, 698, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   74 TRP  HH2          46 ALA  HA          5.50    (#   1095:20  Unique         4.01, 4.65 A)
 &rst
  ixpk= 1095, nxpk= 20, iat=1171, 698, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:1096    46 ALA  HA          2.60    (#   1096:20  Single Ambig)
 &rst
  ixpk= 1096, nxpk= 20, iat=  -1, 698, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 700, 701, 702, 626, 627, 742, 743, 744,
 &end
#
#   40 ILE  QD1          46 ALA  HA          2.60    (#   1097:20  Unique         1.95, 3.34 A)
 &rst
  ixpk= 1097, nxpk= 20, iat=  -1, 698, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1= 629, 630, 631,
 &end
#
#   11 VAL  MGY          46 ALA  HA          2.60    (#   1098:20  Unique         2.69, 4.54 A)
 &rst
  ixpk= 1098, nxpk= 20, iat=  -1, 698, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HB-          46 ALA  MB          4.40    (#   1099:20  Unique         2.40, 4.72 A)
 &rst
  ixpk= 1099, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1603,1604,
 igr2= 700, 701, 702,
 &end
#
#   98 LYS  HG-          46 ALA  MB          3.50    (#   1100:20  Unique         2.00, 4.25 A)
 &rst
  ixpk= 1100, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1606,1607,
 igr2= 700, 701, 702,
 &end
#
#   98 LYS  HD-          46 ALA  MB          2.60    (#   1101:20  Unique         1.93, 2.79 A)
 &rst
  ixpk= 1101, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1609,1610,
 igr2= 700, 701, 702,
 &end
#
#   11 VAL  MGY          46 ALA  MB          2.60    (#   1102:20  Unique         3.30, 6.23 A)
 &rst
  ixpk= 1102, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 700, 701, 702,
 &end
#
#   40 ILE  QD1          46 ALA  MB          2.60    (#   1103:20  Unique         3.16, 5.09 A)
 &rst
  ixpk= 1103, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1= 629, 630, 631,
 igr2= 700, 701, 702,
 &end
#
#   98 LYS  HE+          46 ALA  MB          3.50    (#   1104:20  Unique         3.27, 4.71 A)
 &rst
  ixpk= 1104, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1612,1613,
 igr2= 700, 701, 702,
 &end
#
#    0 AMB  20-2:1105    46 ALA  MB          3.50    (#   1105:20  Single Ambig)
 &rst
  ixpk= 1105, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 710, 711, 713, 714,
 igr2= 700, 701, 702,
 &end
#
#   47 GLU  HA           46 ALA  MB          5.50    (#   1106:20  Unique         3.91, 4.81 A)
 &rst
  ixpk= 1106, nxpk= 20, iat= 708,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 700, 701, 702,
 &end
#
#   46 ALA  HA           46 ALA  MB          2.60    (#   1107:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1107, nxpk= 20, iat= 698,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 700, 701, 702,
 &end
#
#   45 SER  HB+          46 ALA  MB          4.40    (#   1108:20  Unique         3.83, 5.39 A)
 &rst
  ixpk= 1108, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 689, 690,
 igr2= 700, 701, 702,
 &end
#
#   11 VAL  HA           46 ALA  MB          5.50    (#   1110:20  Unique         5.09, 6.70 A)
 &rst
  ixpk= 1110, nxpk= 20, iat= 158,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 700, 701, 702,
 &end
#
#  100 PHE  HE           46 ALA  MB          3.50    (#   1111:20  Unique         2.48, 4.97 A)
 &rst
  ixpk= 1111, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1655,1659,
 igr2= 700, 701, 702,
 &end
#
#   74 TRP  HH2          46 ALA  MB          3.50    (#   1112:20  Unique         2.18, 4.08 A)
 &rst
  ixpk= 1112, nxpk= 20, iat=1171,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 700, 701, 702,
 &end
#
#   74 TRP  HZ2          46 ALA  MB          4.40    (#   1113:20  Unique         3.38, 4.87 A)
 &rst
  ixpk= 1113, nxpk= 20, iat=1169,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 700, 701, 702,
 &end
#
#    0 AMB  20-2:1114    46 ALA  MB          4.40    (#   1114:20  Single Ambig)
 &rst
  ixpk= 1114, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 721, 172,
 igr2= 700, 701, 702,
 &end
#
#    0 AMB  20-2:1115    46 ALA  MB          5.50    (#   1115:20  Single Ambig)
 &rst
  ixpk= 1115, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 738,1156,
 igr2= 700, 701, 702,
 &end
#
#   47 GLU  HN           46 ALA  MB          3.50    (#   1116:20  Unique         2.55, 3.36 A)
 &rst
  ixpk= 1116, nxpk= 20, iat= 706,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 700, 701, 702,
 &end
#
#   46 ALA  HN           46 ALA  MB          2.60    (#   1117:20  Unique         2.06, 2.89 A)
 &rst
  ixpk= 1117, nxpk= 20, iat= 696,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 700, 701, 702,
 &end
#
#   47 GLU  HN           47 GLU  HA          3.50    (#   1118:20  Unique         2.86, 2.86 A)
 &rst
  ixpk= 1118, nxpk= 20, iat= 706, 708, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   50 MET  HN           47 GLU  HA          3.50    (#   1119:20  Unique         3.42, 3.52 A)
 &rst
  ixpk= 1119, nxpk= 20, iat= 748, 708, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   48 GLN  HN           47 GLU  HA          5.50    (#   1120:20  Unique         3.53, 3.55 A)
 &rst
  ixpk= 1120, nxpk= 20, iat= 721, 708, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   51 TYR  HD           47 GLU  HA          5.50    (#   1121:20  Unique         2.91, 4.92 A)
 &rst
  ixpk= 1121, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 773, 782,
 &end
#
#    0 AMB  20-2:1122    47 GLU  HA          3.50    (#   1122:20  Single Ambig)
 &rst
  ixpk= 1122, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1655,1659, 733, 734,
 &end
#
#    0 AMB  20-2:1124    47 GLU  HA          5.50    (#   1124:20  Single Ambig)
 &rst
  ixpk= 1124, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 723, 689, 690, 740,
 &end
#
#    0 AMB  20-2:1125    47 GLU  HA          2.60    (#   1125:20  Single Ambig)
 &rst
  ixpk= 1125, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 713, 714, 710, 711,
 &end
#
#   47 GLU  HB-          47 GLU  HA          2.60    (#   1126:20  Unique         2.45, 2.77 A)
 &rst
  ixpk= 1126, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 710, 711,
 &end
#
#   47 GLU  HG-          47 GLU  HA          2.60    (#   1127:20  Unique         2.08, 2.76 A)
 &rst
  ixpk= 1127, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 713, 714,
 &end
#
#   50 MET  HB+          47 GLU  HA          2.60    (#   1128:20  Unique         2.31, 3.12 A)
 &rst
  ixpk= 1128, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 752, 753,
 &end
#
#   50 MET  HB-          47 GLU  HA          5.50    (#   1129:20  Unique         2.31, 3.12 A)
 &rst
  ixpk= 1129, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 752, 753,
 &end
#
#    0 AMB  20-2:1130    47 GLU  HA          4.40    (#   1130:20  Single Ambig)
 &rst
  ixpk= 1130, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 7.52, r4= 8.27,
 igr1= 162, 163, 164, 166, 167, 168,1055,1056,1693,1694,
      1695,1697,1698,1699,1609,1610, 185, 186, 187, 834,
       835, 836, 838, 839, 840,
 &end
#
#   50 MET  ME           47 GLU  HA          3.50    (#   1131:20  Unique         2.01, 3.13 A)
 &rst
  ixpk= 1131, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 759, 760, 761,
 &end
#
#  136 VAL  MGX         141 ARG  HB+         3.50    (#   1133:20  Unique         1.98, 5.00 A)
 &rst
  ixpk= 1133, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2237,2238,2239,2241,2242,2243,
 igr2=2320,2321,
 &end
#
#    0 AMB  20-2:1134     0 AMB  20-1:1134   4.40    (#   1134:20  Double Ambig)
 &rst
  ixpk= 1134, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.71, r4= 9.46,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,1058,1059,1060,
 igr2= 883, 884, 710, 711,
 &end
#
#  133 VAL  MGX           0 AMB  20-1:1135   3.50    (#   1135:20  Single Ambig)
 &rst
  ixpk= 1135, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2180,2181,2182,2184,2185,2186,
 igr2=2457,2458,2194,2195,2320,2321,
 &end
#
#   47 GLU  HA           47 GLU  HB+         3.50    (#   1136:20  Unique         2.45, 2.77 A)
 &rst
  ixpk= 1136, nxpk= 20, iat= 708,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 710, 711,
 &end
#
#    0 AMB  20-2:1137     0 AMB  20-1:1137   2.60    (#   1137:20  Double Ambig)
 &rst
  ixpk= 1137, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 708,2399,2400,
 igr2= 710, 711,2320,2321,
 &end
#
#    0 AMB  20-2:1138     0 AMB  20-1:1138   4.40    (#   1138:20  Double Ambig)
 &rst
  ixpk= 1138, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=1653,1661,2214,1171,
 igr2= 710, 711,2320,2321,
 &end
#
#  135 GLN  HN          135 GLN  HB+         2.60    (#   1139:20  Unique         2.45, 3.17 A)
 &rst
  ixpk= 1139, nxpk= 20, iat=2214,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2218,2219,
 &end
#
#  141 ARG  HN          141 ARG  HB+         4.40    (#   1140:20  Unique         2.10, 2.87 A)
 &rst
  ixpk= 1140, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2320,2321,
 &end
#
#   48 GLN  HN           47 GLU  HB-         3.50    (#   1141:20  Unique         2.45, 3.12 A)
 &rst
  ixpk= 1141, nxpk= 20, iat= 721,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 710, 711,
 &end
#
#   48 GLN  HN           47 GLU  HB+         5.50    (#   1142:20  Unique         2.45, 3.12 A)
 &rst
  ixpk= 1142, nxpk= 20, iat= 721,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 710, 711,
 &end
#
#    0 AMB  20-2:1143     0 AMB  20-1:1143   3.50    (#   1143:20  Double Ambig)
 &rst
  ixpk= 1143, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2329, 706,
 igr2=2320,2321, 710, 711,
 &end
#
#   47 GLU  HN           47 GLU  HB+         3.50    (#   1144:20  Unique         2.20, 2.56 A)
 &rst
  ixpk= 1144, nxpk= 20, iat= 706,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 710, 711,
 &end
#
#  138 SER  HN          141 ARG  HB+         5.50    (#   1145:20  Unique         3.74, 5.23 A)
 &rst
  ixpk= 1145, nxpk= 20, iat=2263,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2320,2321,
 &end
#
#    0 AMB  20-2:1148     0 AMB  20-1:1148   4.40    (#   1148:20  Double Ambig)
 &rst
  ixpk= 1148, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 706, 810,
 igr2= 713, 714, 677, 678,
 &end
#
#   47 GLU  HN           47 GLU  HG-         4.40    (#   1149:20  Unique         4.16, 4.46 A)
 &rst
  ixpk= 1149, nxpk= 20, iat= 706,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 713, 714,
 &end
#
#   44 GLU  HN           44 GLU  HG-         3.50    (#   1150:20  Unique         4.32, 4.52 A)
 &rst
  ixpk= 1150, nxpk= 20, iat= 670,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 677, 678,
 &end
#
#   51 TYR  HD           47 GLU  HG-         3.50    (#   1151:20  Unique         2.61, 4.24 A)
 &rst
  ixpk= 1151, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 773, 782,
 igr2= 713, 714,
 &end
#
#    0 AMB  20-2:1152    47 GLU  HG-         5.50    (#   1152:20  Single Ambig)
 &rst
  ixpk= 1152, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 733, 734,1655,1659,
 igr2= 713, 714,
 &end
#
#   51 TYR  HE           47 GLU  HG-         4.40    (#   1153:20  Unique         2.02, 3.84 A)
 &rst
  ixpk= 1153, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 775, 780,
 igr2= 713, 714,
 &end
#
#    0 AMB  20-2:1154     0 AMB  20-1:1154   5.50    (#   1154:20  Double Ambig)
 &rst
  ixpk= 1154, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1= 723, 689, 690,1759,1760,1047,
 igr2= 713, 714,1009,
 &end
#
#   47 GLU  HA           47 GLU  HG-         3.50    (#   1155:20  Unique         2.08, 2.76 A)
 &rst
  ixpk= 1155, nxpk= 20, iat= 708,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 713, 714,
 &end
#
#   47 GLU  HB-          47 GLU  HG-         2.60    (#   1157:20  Unique         2.21, 2.71 A)
 &rst
  ixpk= 1157, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 710, 711,
 igr2= 713, 714,
 &end
#
#   67 ILE  QD1          47 GLU  HG+         3.50    (#   1158:20  Unique         2.01, 4.18 A)
 &rst
  ixpk= 1158, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1058,1059,1060,
 igr2= 713, 714,
 &end
#
#   50 MET  ME           47 GLU  HG+         3.50    (#   1159:20  Unique         2.39, 4.09 A)
 &rst
  ixpk= 1159, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 759, 760, 761,
 igr2= 713, 714,
 &end
#
#   50 MET  ME           47 GLU  HG-         3.50    (#   1160:20  Unique         2.39, 4.09 A)
 &rst
  ixpk= 1160, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 759, 760, 761,
 igr2= 713, 714,
 &end
#
#    0 AMB  20-2:1161     0 AMB  20-1:1161   2.60    (#   1161:20  Double Ambig)
 &rst
  ixpk= 1161, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.90, r4= 5.65,
 igr1=1693,1694,1695,1697,1698,1699,1058,1059,1060,1011,
      1012,1013,1015,1016,1017,
 igr2=1009, 713, 714,
 &end
#
#  150 GLU  HB-         150 GLU  HA          2.60    (#   1162:20  Unique         2.36, 2.81 A)
 &rst
  ixpk= 1162, nxpk= 20, iat=  -1,2494, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2496,2497,
 &end
#
#  150 GLU  HB+         150 GLU  HA          2.60    (#   1163:20  Unique         2.36, 2.81 A)
 &rst
  ixpk= 1163, nxpk= 20, iat=  -1,2494, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2496,2497,
 &end
#
#  150 GLU  HG-         150 GLU  HA          2.60    (#   1164:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 1164, nxpk= 20, iat=  -1,2494, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2499,2500,
 &end
#
#  150 GLU  HG+         150 GLU  HA          2.60    (#   1165:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 1165, nxpk= 20, iat=  -1,2494, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2499,2500,
 &end
#
#   51 TYR  HB-          48 GLN  HA          4.40    (#   1166:20  Unique         2.74, 3.70 A)
 &rst
  ixpk= 1166, nxpk= 20, iat=  -1, 723, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 769, 770,
 &end
#
#   51 TYR  HB+          48 GLN  HA          4.40    (#   1167:20  Unique         2.74, 3.70 A)
 &rst
  ixpk= 1167, nxpk= 20, iat=  -1, 723, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 769, 770,
 &end
#
#   48 GLN  HE2-         48 GLN  HA          5.50    (#   1169:20  Unique         2.52, 3.27 A)
 &rst
  ixpk= 1169, nxpk= 20, iat=  -1, 723, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 733, 734,
 &end
#
#   51 TYR  HD           48 GLN  HA          3.50    (#   1170:20  Unique         4.59, 5.13 A)
 &rst
  ixpk= 1170, nxpk= 20, iat=  -1, 723, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 773, 782,
 &end
#
#   48 GLN  HN           48 GLN  HA          3.50    (#   1171:20  Unique         2.78, 2.79 A)
 &rst
  ixpk= 1171, nxpk= 20, iat= 721, 723, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   51 TYR  HN           48 GLN  HA          5.50    (#   1172:20  Unique         3.74, 3.84 A)
 &rst
  ixpk= 1172, nxpk= 20, iat= 765, 723, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:1173     0 AMB  20-1:1173   4.40    (#   1173:20  Double Ambig)
 &rst
  ixpk= 1173, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 738,2470,
 igr2= 723,2494,
 &end
#
#   45 SER  HN           48 GLN  HB+         4.40    (#   1175:20  Unique         1.94, 2.76 A)
 &rst
  ixpk= 1175, nxpk= 20, iat= 685,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 725, 726,
 &end
#
#  114 GLN  HN          114 GLN  HB+         3.50    (#   1176:20  Unique         2.66, 3.38 A)
 &rst
  ixpk= 1176, nxpk= 20, iat=1860,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1864,1865,
 &end
#
#    0 AMB  20-2:1177     0 AMB  20-1:1177   3.50    (#   1177:20  Double Ambig)
 &rst
  ixpk= 1177, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 299, 748,
 igr2= 286, 287, 725, 726,
 &end
#
#   48 GLN  HN           48 GLN  HB+         3.50    (#   1178:20  Unique         2.40, 3.05 A)
 &rst
  ixpk= 1178, nxpk= 20, iat= 721,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 725, 726,
 &end
#
#   44 GLU  HA           48 GLN  HB-         4.40    (#   1179:20  Unique         3.27, 4.03 A)
 &rst
  ixpk= 1179, nxpk= 20, iat= 672,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 725, 726,
 &end
#
#   48 GLN  HG+          48 GLN  HB+         2.60    (#   1181:20  Unique         2.34, 2.57 A)
 &rst
  ixpk= 1181, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 728, 729,
 igr2= 725, 726,
 &end
#
#    0 AMB  20-2:1186     0 AMB  20-1:1186   5.50    (#   1186:20  Double Ambig)
 &rst
  ixpk= 1186, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.25, r4=11.00,
 igr1=1931,1932, 742, 743, 744, 626, 627,
 igr2=1864,1865, 725, 726, 725, 726,
 &end
#
#   47 GLU  HB-          48 GLN  HG+         4.40    (#   1187:20  Unique         3.35, 5.13 A)
 &rst
  ixpk= 1187, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 710, 711,
 igr2= 728, 729,
 &end
#
#   48 GLN  HB-          48 GLN  HG+         2.60    (#   1188:20  Unique         2.34, 2.57 A)
 &rst
  ixpk= 1188, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 725, 726,
 igr2= 728, 729,
 &end
#
#   48 GLN  HB+          48 GLN  HG+         2.60    (#   1189:20  Unique         2.34, 2.57 A)
 &rst
  ixpk= 1189, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 725, 726,
 igr2= 728, 729,
 &end
#
#    0 AMB  20-2:1190     0 AMB  20-1:1190   2.60    (#   1190:20  Double Ambig)
 &rst
  ixpk= 1190, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 689, 690, 723,
 igr2= 728, 729, 728, 729,
 &end
#
#   51 TYR  HE           48 GLN  HG+         5.50    (#   1191:20  Unique         7.63, 9.03 A)
 &rst
  ixpk= 1191, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 775, 780,
 igr2= 728, 729,
 &end
#
#   48 GLN  HE2-         48 GLN  HG+         3.50    (#   1192:20  Unique         2.12, 3.26 A)
 &rst
  ixpk= 1192, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 733, 734,
 igr2= 728, 729,
 &end
#
#   48 GLN  HE2+         48 GLN  HG+         2.60    (#   1193:20  Unique         2.12, 3.26 A)
 &rst
  ixpk= 1193, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 733, 734,
 igr2= 728, 729,
 &end
#
#   48 GLN  HN           48 GLN  HG+         2.60    (#   1194:20  Unique         1.98, 2.93 A)
 &rst
  ixpk= 1194, nxpk= 20, iat= 721,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 728, 729,
 &end
#
#    0 AMB  20-2:1195     0 AMB  20-1:1195   3.50    (#   1195:20  Double Ambig)
 &rst
  ixpk= 1195, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 685, 706,
 igr2= 728, 729, 728, 729,
 &end
#
#   49 ALA  HN           48 GLN  HG+         5.50    (#   1196:20  Unique         3.99, 4.57 A)
 &rst
  ixpk= 1196, nxpk= 20, iat= 738,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 728, 729,
 &end
#
#  126 TRP  HN          125 ARG  HA          3.50    (#   1197:20  Unique         2.14, 2.21 A)
 &rst
  ixpk= 1197, nxpk= 20, iat=2043,2021, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   49 ALA  HN           49 ALA  HA          3.50    (#   1198:20  Unique         2.82, 2.85 A)
 &rst
  ixpk= 1198, nxpk= 20, iat= 738, 740, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1199     0 AMB  20-1:1199   4.40    (#   1199:20  Double Ambig)
 &rst
  ixpk= 1199, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 786, 748,1995,
 igr2= 740,2021,
 &end
#
#    0 AMB  20-2:1202     0 AMB  20-1:1202   4.40    (#   1202:20  Double Ambig)
 &rst
  ixpk= 1202, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 796, 797,1999,2000,2047,2048,
 igr2= 740,2021,
 &end
#
#    0 AMB  20-2:1203    49 ALA  HA          3.50    (#   1203:20  Single Ambig)
 &rst
  ixpk= 1203, nxpk= 20, iat=  -1, 740, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 677, 678, 674, 675,
 &end
#
#   49 ALA  MB           49 ALA  HA          2.60    (#   1204:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1204, nxpk= 20, iat=  -1, 740, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1= 742, 743, 744,
 &end
#
#    0 AMB  20-2:1205     0 AMB  20-1:1205   2.60    (#   1205:20  Double Ambig)
 &rst
  ixpk= 1205, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2023,2024, 790, 791, 793, 794,
 igr2=2021, 740,
 &end
#
#   11 VAL  MGX          49 ALA  MB          2.60    (#   1206:20  Unique         1.99, 4.63 A)
 &rst
  ixpk= 1206, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 742, 743, 744,
 &end
#
#   40 ILE  HG1+         49 ALA  MB          3.50    (#   1207:20  Unique         2.00, 3.42 A)
 &rst
  ixpk= 1207, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 626, 627,
 igr2= 742, 743, 744,
 &end
#
#   40 ILE  QG2          49 ALA  MB          2.60    (#   1208:20  Unique         1.99, 3.33 A)
 &rst
  ixpk= 1208, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1= 622, 623, 624,
 igr2= 742, 743, 744,
 &end
#
#   44 GLU  HB+          49 ALA  MB          2.60    (#   1209:20  Unique         1.99, 3.69 A)
 &rst
  ixpk= 1209, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 674, 675,
 igr2= 742, 743, 744,
 &end
#
#   46 ALA  HA           49 ALA  MB          3.50    (#   1210:20  Unique         3.18, 4.25 A)
 &rst
  ixpk= 1210, nxpk= 20, iat= 698,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 742, 743, 744,
 &end
#
#   49 ALA  HA           49 ALA  MB          2.60    (#   1211:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1211, nxpk= 20, iat= 740,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 742, 743, 744,
 &end
#
#   48 GLN  HN           49 ALA  MB          5.50    (#   1213:20  Unique         4.67, 5.52 A)
 &rst
  ixpk= 1213, nxpk= 20, iat= 721,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 742, 743, 744,
 &end
#
#   50 MET  HN           49 ALA  MB          3.50    (#   1214:20  Unique         2.40, 3.36 A)
 &rst
  ixpk= 1214, nxpk= 20, iat= 748,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 742, 743, 744,
 &end
#
#   49 ALA  HN           49 ALA  MB          2.60    (#   1215:20  Unique         2.13, 2.90 A)
 &rst
  ixpk= 1215, nxpk= 20, iat= 738,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 742, 743, 744,
 &end
#
#    0 AMB  20-2:1216    49 ALA  MB          4.40    (#   1216:20  Single Ambig)
 &rst
  ixpk= 1216, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 810, 602,
 igr2= 742, 743, 744,
 &end
#
#   41 ASN  HN           49 ALA  MB          3.50    (#   1217:20  Unique         1.94, 3.28 A)
 &rst
  ixpk= 1217, nxpk= 20, iat= 635,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 742, 743, 744,
 &end
#
#   52 ARG  HE           49 ALA  MB          5.50    (#   1218:20  Unique         3.70, 5.64 A)
 &rst
  ixpk= 1218, nxpk= 20, iat= 799,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 742, 743, 744,
 &end
#
#   50 MET  HN           50 MET  HA          3.50    (#   1219:20  Unique         2.77, 2.80 A)
 &rst
  ixpk= 1219, nxpk= 20, iat= 748, 750, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1220    50 MET  HA          5.50    (#   1220:20  Single Ambig)
 &rst
  ixpk= 1220, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 810, 602,
 &end
#
#   51 TYR  HN           50 MET  HA          5.50    (#   1221:20  Unique         3.53, 3.54 A)
 &rst
  ixpk= 1221, nxpk= 20, iat= 765, 750, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:1222    50 MET  HA          5.50    (#   1222:20  Single Ambig)
 &rst
  ixpk= 1222, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782,1653,1661,
 &end
#
#    0 AMB  20-2:1223    50 MET  HA          5.50    (#   1223:20  Single Ambig)
 &rst
  ixpk= 1223, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 767, 740,
 &end
#
#   53 GLU  HG-          50 MET  HA          4.40    (#   1225:20  Unique         2.00, 4.46 A)
 &rst
  ixpk= 1225, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 817, 818,
 &end
#
#   11 VAL  HB           50 MET  HA          4.40    (#   1226:20  Unique         3.10, 3.57 A)
 &rst
  ixpk= 1226, nxpk= 20, iat= 160, 750, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:1227    50 MET  HA          2.60    (#   1227:20  Single Ambig)
 &rst
  ixpk= 1227, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 3.60, r4= 4.35,
 igr1= 755, 756, 742, 743, 744, 829, 830,
 &end
#
#    0 AMB  20-2:1228    50 MET  HA          2.60    (#   1228:20  Single Ambig)
 &rst
  ixpk= 1228, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 752, 753, 755, 756,
 &end
#
#    0 AMB  20-2:1229    50 MET  HA          3.50    (#   1229:20  Single Ambig)
 &rst
  ixpk= 1229, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 752, 753, 189, 190,
 &end
#
#   11 VAL  MGY          50 MET  HA          3.50    (#   1230:20  Unique         1.95, 4.16 A)
 &rst
  ixpk= 1230, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGX          50 MET  HA          2.60    (#   1231:20  Unique         1.95, 4.16 A)
 &rst
  ixpk= 1231, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:1232    50 MET  HA          2.60    (#   1232:20  Single Ambig)
 &rst
  ixpk= 1232, nxpk= 20, iat=  -1, 750, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1= 192, 193, 194, 189, 190,
 &end
#
#   50 MET  ME           50 MET  HB+         4.40    (#   1233:20  Unique         1.99, 3.49 A)
 &rst
  ixpk= 1233, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 759, 760, 761,
 igr2= 752, 753,
 &end
#
#   50 MET  ME           50 MET  HB-         4.40    (#   1234:20  Unique         1.99, 3.49 A)
 &rst
  ixpk= 1234, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 759, 760, 761,
 igr2= 752, 753,
 &end
#
#   11 VAL  MGX          50 MET  HB-         4.40    (#   1235:20  Unique         1.99, 4.71 A)
 &rst
  ixpk= 1235, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 752, 753,
 &end
#
#   50 MET  HA           50 MET  HB-         5.50    (#   1236:20  Unique         2.33, 2.69 A)
 &rst
  ixpk= 1236, nxpk= 20, iat= 750,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 752, 753,
 &end
#
#   51 TYR  HE           50 MET  HB-         5.50    (#   1237:20  Unique         3.83, 6.82 A)
 &rst
  ixpk= 1237, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 775, 780,
 igr2= 752, 753,
 &end
#
#   50 MET  HN           50 MET  HB+         4.40    (#   1239:20  Unique         2.28, 2.53 A)
 &rst
  ixpk= 1239, nxpk= 20, iat= 748,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 752, 753,
 &end
#
#   50 MET  HN           50 MET  HB-         4.40    (#   1240:20  Unique         2.28, 2.53 A)
 &rst
  ixpk= 1240, nxpk= 20, iat= 748,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 752, 753,
 &end
#
#   51 TYR  HD           50 MET  HG+         5.50    (#   1241:20  Unique         2.44, 5.83 A)
 &rst
  ixpk= 1241, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782,
 igr2= 755, 756,
 &end
#
#  129 TYR  HD          155 VAL  HB          5.50    (#   1243:20  Unique         3.37, 5.19 A)
 &rst
  ixpk= 1243, nxpk= 20, iat=  -1,2568, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2102,2111,
 &end
#
#   50 MET  HA           50 MET  HG-         5.50    (#   1244:20  Unique         2.50, 3.03 A)
 &rst
  ixpk= 1244, nxpk= 20, iat= 750,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 755, 756,
 &end
#
#   50 MET  HA           50 MET  HG+         4.40    (#   1245:20  Unique         2.50, 3.03 A)
 &rst
  ixpk= 1245, nxpk= 20, iat= 750,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 755, 756,
 &end
#
#   50 MET  ME           50 MET  HG+         3.50    (#   1246:20  Unique         2.27, 3.66 A)
 &rst
  ixpk= 1246, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 759, 760, 761,
 igr2= 755, 756,
 &end
#
#   50 MET  ME           50 MET  HG-         4.40    (#   1247:20  Unique         2.27, 3.66 A)
 &rst
  ixpk= 1247, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 759, 760, 761,
 igr2= 755, 756,
 &end
#
#    0 AMB  20-2:1248    50 MET  HG-         5.50    (#   1248:20  Single Ambig)
 &rst
  ixpk= 1248, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 189, 190, 752, 753,
 igr2= 755, 756,
 &end
#
#    0 AMB  20-2:1249     0 AMB  20-1:1249   5.50    (#   1249:20  Double Ambig)
 &rst
  ixpk= 1249, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 189, 190, 752, 753,
 igr2= 755, 756, 755, 756,
 &end
#
#   50 MET  ME            0 AMB  20-1:1250   4.40    (#   1250:20  Single Ambig)
 &rst
  ixpk= 1250, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 759, 760, 761,
 igr2= 767,1047,
 &end
#
#    0 AMB  20-2:1251     0 AMB  20-1:1251   2.60    (#   1251:20  Double Ambig)
 &rst
  ixpk= 1251, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1693,1694,1695,1697,1698,1699, 834, 835, 836, 838,
       839, 840, 834, 835, 836, 838, 839, 840,
 igr2=1047, 767,
 &end
#
#    0 AMB  20-2:1252    67 ILE  HA          3.50    (#   1252:20  Single Ambig)
 &rst
  ixpk= 1252, nxpk= 20, iat=  -1,1047, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1051,1052,1053,1073,1074,1075,1077,1078,1079,
 &end
#
#    0 AMB  20-2:1253    67 ILE  HA          3.50    (#   1253:20  Single Ambig)
 &rst
  ixpk= 1253, nxpk= 20, iat=  -1,1047, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1688,1689,1055,1056,
 &end
#
#   54 LEU  HB+          51 TYR  HA          5.50    (#   1254:20  Unique         2.26, 3.01 A)
 &rst
  ixpk= 1254, nxpk= 20, iat=  -1, 767, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 829, 830,
 &end
#
#   51 TYR  HB-          51 TYR  HA          3.50    (#   1255:20  Unique         2.59, 2.82 A)
 &rst
  ixpk= 1255, nxpk= 20, iat=  -1, 767, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 769, 770,
 &end
#
#   51 TYR  HB+          51 TYR  HA          3.50    (#   1256:20  Unique         2.59, 2.82 A)
 &rst
  ixpk= 1256, nxpk= 20, iat=  -1, 767, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 769, 770,
 &end
#
#  102 LEU  HA           67 ILE  HA          4.40    (#   1257:20  Unique         1.99, 2.40 A)
 &rst
  ixpk= 1257, nxpk= 20, iat=1686,1047, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   51 TYR  HE            0 AMB  20-1:1258   5.50    (#   1258:20  Single Ambig)
 &rst
  ixpk= 1258, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 775, 780,
 igr2= 767,1047,
 &end
#
#    0 AMB  20-2:1259     0 AMB  20-1:1259   4.40    (#   1259:20  Double Ambig)
 &rst
  ixpk= 1259, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 773, 782,1653,1661,
 igr2= 767,1047,
 &end
#
#   69 ALA  HN           67 ILE  HA          4.40    (#   1260:20  Unique         3.68, 3.84 A)
 &rst
  ixpk= 1260, nxpk= 20, iat=1083,1047, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   51 TYR  HN           51 TYR  HA          5.50    (#   1261:20  Unique         2.81, 2.82 A)
 &rst
  ixpk= 1261, nxpk= 20, iat= 765, 767, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:1262    67 ILE  HA          3.50    (#   1262:20  Single Ambig)
 &rst
  ixpk= 1262, nxpk= 20, iat=  -1,1047, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1045,1703,
 &end
#
#   68 LEU  HN           67 ILE  HA          3.50    (#   1263:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1263, nxpk= 20, iat=1064,1047, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   51 TYR  HN           51 TYR  HB-         4.40    (#   1264:20  Unique         2.17, 2.86 A)
 &rst
  ixpk= 1264, nxpk= 20, iat= 765,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 769, 770,
 &end
#
#   51 TYR  HN           51 TYR  HB+         4.40    (#   1265:20  Unique         2.17, 2.86 A)
 &rst
  ixpk= 1265, nxpk= 20, iat= 765,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 769, 770,
 &end
#
#   51 TYR  HD           51 TYR  HB+         3.50    (#   1266:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 1266, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 773, 782,
 igr2= 769, 770,
 &end
#
#   51 TYR  HD           51 TYR  HB-         4.40    (#   1267:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 1267, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 773, 782,
 igr2= 769, 770,
 &end
#
#   51 TYR  HA           51 TYR  HB+         4.40    (#   1268:20  Unique         2.59, 2.82 A)
 &rst
  ixpk= 1268, nxpk= 20, iat= 767,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 769, 770,
 &end
#
#    0 AMB  20-2:1269    51 TYR  HB-         4.40    (#   1269:20  Single Ambig)
 &rst
  ixpk= 1269, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 767, 723,
 igr2= 769, 770,
 &end
#
#    0 AMB  20-2:1270    51 TYR  HB-         5.50    (#   1270:20  Single Ambig)
 &rst
  ixpk= 1270, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 834, 835, 836, 838, 839, 840, 834, 835, 836, 838,
       839, 840,
 igr2= 769, 770,
 &end
#
#    0 AMB  20-2:1271     0 AMB  20-1:1271   5.50    (#   1271:20  Double Ambig)
 &rst
  ixpk= 1271, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1= 834, 835, 836, 838, 839, 840, 834, 835, 836, 838,
       839, 840,
 igr2= 769, 770, 769, 770,
 &end
#
#   84 VAL  MGX          93 ILE  HA          4.40    (#   1272:20  Unique         3.05, 4.29 A)
 &rst
  ixpk= 1272, nxpk= 20, iat=  -1,1519, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:1273     0 AMB  20-1:1273   4.40    (#   1273:20  Double Ambig)
 &rst
  ixpk= 1273, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1496,1497,1498,1500,1501,1502,1919,1920,1921,
 igr2=1519,1904,
 &end
#
#   52 ARG  HG-          52 ARG  HA          3.00    (#   1274:20  Unique         2.26, 3.05 A)
 &rst
  ixpk= 1274, nxpk= 20, iat=  -1, 788, r1= 0.00, r2= 1.80, r3= 3.37, r4= 4.12,
 igr1= 793, 794,
 &end
#
#    0 AMB  20-2:1275     0 AMB  20-1:1275   2.60    (#   1275:20  Double Ambig)
 &rst
  ixpk= 1275, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1= 790, 791, 793, 794,1521,
 igr2= 788,1519,
 &end
#
#   52 ARG  HB-          52 ARG  HA          3.50    (#   1276:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 1276, nxpk= 20, iat=  -1, 788, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 790, 791,
 &end
#
#   52 ARG  HD+          52 ARG  HA          4.40    (#   1277:20  Unique         3.73, 4.71 A)
 &rst
  ixpk= 1277, nxpk= 20, iat=  -1, 788, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 796, 797,
 &end
#
#  119 PRO  HD+         117 SER  HA          5.50    (#   1278:20  Unique         4.83, 5.42 A)
 &rst
  ixpk= 1278, nxpk= 20, iat=  -1,1904, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1928,1929,
 &end
#
#    0 AMB  20-2:1279    52 ARG  HA          4.40    (#   1279:20  Single Ambig)
 &rst
  ixpk= 1279, nxpk= 20, iat=  -1, 788, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 848, 849, 796, 797,
 &end
#
#    0 AMB  20-2:1280     0 AMB  20-1:1280   5.50    (#   1280:20  Double Ambig)
 &rst
  ixpk= 1280, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.64, r4= 9.39,
 igr1=1895,1896,  78,  79, 827,
 igr2=1904,1519, 788,
 &end
#
#  117 SER  HB+         117 SER  HA          2.60    (#   1281:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 1281, nxpk= 20, iat=  -1,1904, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1906,1907,
 &end
#
#    0 AMB  20-2:1282     0 AMB  20-1:1282   5.50    (#   1282:20  Double Ambig)
 &rst
  ixpk= 1282, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1419, 852, 860,
 igr2=1519, 788,
 &end
#
#    0 AMB  20-2:1283     0 AMB  20-1:1283   3.50    (#   1283:20  Double Ambig)
 &rst
  ixpk= 1283, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1913, 765,
 igr2=1904, 788,
 &end
#
#   52 ARG  HN           52 ARG  HA          3.50    (#   1284:20  Unique         2.81, 2.83 A)
 &rst
  ixpk= 1284, nxpk= 20, iat= 786, 788, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1285     0 AMB  20-1:1285   5.50    (#   1285:20  Double Ambig)
 &rst
  ixpk= 1285, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1506, 104, 738,1380,
 igr2=1519, 788,
 &end
#
#  117 SER  HN          117 SER  HA          3.50    (#   1286:20  Unique         2.75, 2.76 A)
 &rst
  ixpk= 1286, nxpk= 20, iat=1902,1904, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   93 ILE  HN           93 ILE  HA          3.50    (#   1287:20  Unique         2.88, 2.90 A)
 &rst
  ixpk= 1287, nxpk= 20, iat=1517,1519, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1288    52 ARG  HA          5.50    (#   1288:20  Single Ambig)
 &rst
  ixpk= 1288, nxpk= 20, iat=  -1, 788, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 864, 879,
 &end
#
#   52 ARG  HE           52 ARG  HA          5.50    (#   1289:20  Unique         4.58, 5.07 A)
 &rst
  ixpk= 1289, nxpk= 20, iat= 799, 788, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   52 ARG  HN           52 ARG  HB+         4.40    (#   1291:20  Unique         2.07, 2.58 A)
 &rst
  ixpk= 1291, nxpk= 20, iat= 786,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 790, 791,
 &end
#
#   52 ARG  HA           52 ARG  HB+         3.50    (#   1292:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 1292, nxpk= 20, iat= 788,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 790, 791,
 &end
#
#    0 AMB  20-2:1293     0 AMB  20-1:1293   2.60    (#   1293:20  Double Ambig)
 &rst
  ixpk= 1293, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.20, r4= 5.95,
 igr1= 796, 797,2483,2484,1257,1258,1312,1313,
 igr2= 790, 791,2480,2481,1254,1255,1309,1310,
 &end
#
#    0 AMB  20-2:1294     0 AMB  20-1:1294   5.50    (#   1294:20  Double Ambig)
 &rst
  ixpk= 1294, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1292,1293, 725, 726,
 igr2=1309,1310, 790, 791,
 &end
#
#    2 ILE  QG2          90 PRO  HG-         3.50    (#   1295:20  Unique         5.26, 6.50 A)
 &rst
  ixpk= 1295, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  27,  28,  29,
 igr2=1480,1481,
 &end
#
#    0 AMB  20-2:1297     0 AMB  20-1:1297   3.50    (#   1297:20  Double Ambig)
 &rst
  ixpk= 1297, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2483,2484, 796, 797,
 igr2=2477,2478, 793, 794,
 &end
#
#  149 LYS  HA          149 LYS  HG+         3.50    (#   1298:20  Unique         2.09, 3.12 A)
 &rst
  ixpk= 1298, nxpk= 20, iat=2472,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2477,2478,
 &end
#
#  150 GLU  HN          149 LYS  HG+         5.50    (#   1299:20  Unique         3.45, 4.43 A)
 &rst
  ixpk= 1299, nxpk= 20, iat=2492,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2477,2478,
 &end
#
#    0 AMB  20-2:1300     0 AMB  20-1:1300   4.40    (#   1300:20  Double Ambig)
 &rst
  ixpk= 1300, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=2470,1490, 738,
 igr2=2477,2478,1480,1481, 793, 794,
 &end
#
#    0 AMB  20-2:1302     0 AMB  20-1:1302   5.50    (#   1302:20  Double Ambig)
 &rst
  ixpk= 1302, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 786,1266,
 igr2= 796, 797,1257,1258,
 &end
#
#   78 LYS  HN           78 LYS  HE+         5.50    (#   1303:20  Unique         4.15, 4.79 A)
 &rst
  ixpk= 1303, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1257,1258,
 &end
#
#    0 AMB  20-2:1304     0 AMB  20-1:1304   4.40    (#   1304:20  Double Ambig)
 &rst
  ixpk= 1304, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1=1412, 294, 295, 616,
 igr2=1312,1313,2714,2715, 796, 797,1467,1468,
 &end
#
#    0 AMB  20-2:1305     0 AMB  20-1:1305   5.50    (#   1305:20  Double Ambig)
 &rst
  ixpk= 1305, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 812,1538,1539,2703,
 igr2= 796, 797,1257,1258,2714,2715,
 &end
#
#    0 AMB  20-2:1306     0 AMB  20-1:1306   5.50    (#   1306:20  Double Ambig)
 &rst
  ixpk= 1306, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1323,1106,1519,
 igr2=1312,1313,2483,2484,1257,1258,1312,1313,
 &end
#
#    0 AMB  20-2:1307     0 AMB  20-1:1307   4.40    (#   1307:20  Double Ambig)
 &rst
  ixpk= 1307, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2415,1538,1539,
 igr2=2483,2484,1257,1258,
 &end
#
#    0 AMB  20-2:1308     0 AMB  20-1:1308   2.60    (#   1308:20  Double Ambig)
 &rst
  ixpk= 1308, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 790, 791,1309,1310,
 igr2= 796, 797,1312,1313,
 &end
#
#    0 AMB  20-2:1309     0 AMB  20-1:1309   2.60    (#   1309:20  Double Ambig)
 &rst
  ixpk= 1309, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1303,1304,1303,1304,
 igr2=1312,1313,1312,1313,
 &end
#
#    0 AMB  20-2:1311     0 AMB  20-1:1311   3.50    (#   1311:20  Double Ambig)
 &rst
  ixpk= 1311, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1527,1528,1530,1531,1532, 192, 193, 194,
 igr2=1257,1258,1257,1258, 796, 797,
 &end
#
#   53 GLU  HN           53 GLU  HA          3.50    (#   1312:20  Unique         2.82, 2.84 A)
 &rst
  ixpk= 1312, nxpk= 20, iat= 810, 812, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   54 LEU  HN           53 GLU  HA          4.40    (#   1313:20  Unique         3.48, 3.50 A)
 &rst
  ixpk= 1313, nxpk= 20, iat= 825, 812, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:1314     0 AMB  20-1:1314   2.60    (#   1314:20  Double Ambig)
 &rst
  ixpk= 1314, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2584,2585, 817, 818,
 igr2=2582, 812,
 &end
#
#    0 AMB  20-2:1315   156 MET  HA          2.60    (#   1315:20  Single Ambig)
 &rst
  ixpk= 1315, nxpk= 20, iat=  -1,2582, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2651,2652,2634,2635,2634,2635,
 &end
#
#  156 MET  HG-         156 MET  HA          3.50    (#   1316:20  Unique         3.10, 3.48 A)
 &rst
  ixpk= 1316, nxpk= 20, iat=  -1,2582, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2587,2588,
 &end
#
#   56 GLU  HG+          53 GLU  HA          4.40    (#   1317:20  Unique         2.30, 3.46 A)
 &rst
  ixpk= 1317, nxpk= 20, iat=  -1, 812, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 871, 872,
 &end
#
#  156 MET  HG+         156 MET  HA          3.50    (#   1318:20  Unique         3.10, 3.48 A)
 &rst
  ixpk= 1318, nxpk= 20, iat=  -1,2582, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2587,2588,
 &end
#
#    0 AMB  20-2:1319     0 AMB  20-1:1319   4.40    (#   1319:20  Double Ambig)
 &rst
  ixpk= 1319, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 793, 794,2568,
 igr2= 812,2582,
 &end
#
#    0 AMB  20-2:1320     0 AMB  20-1:1320   4.40    (#   1320:20  Double Ambig)
 &rst
  ixpk= 1320, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.76, r4= 8.51,
 igr1=2570,2571,2572,2574,2575,2576, 834, 835, 836, 838,
       839, 840, 185, 186, 187,
 igr2=2582, 812,
 &end
#
#  155 VAL  MGX         156 MET  HA          3.50    (#   1321:20  Unique         3.51, 5.56 A)
 &rst
  ixpk= 1321, nxpk= 20, iat=  -1,2582, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2570,2571,2572,2574,2575,2576,
 &end
#
#  164 LYS  HB+         164 LYS  HA          3.50    (#   1323:20  Unique         2.31, 2.57 A)
 &rst
  ixpk= 1323, nxpk= 20, iat=  -1,2703, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2705,2706,
 &end
#
#    0 AMB  20-2:1324    80 PRO  HG-         3.50    (#   1324:20  Single Ambig)
 &rst
  ixpk= 1324, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1289,1290,
 &end
#
#    0 AMB  20-2:1325     0 AMB  20-1:1325   2.60    (#   1325:20  Double Ambig)
 &rst
  ixpk= 1325, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 817, 818,1934,1935, 868, 869,
 igr2= 814, 815,1931,1932, 814, 815,
 &end
#
#   80 PRO  HB+          80 PRO  HG-         2.60    (#   1326:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 1326, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1292,1293,
 igr2=1289,1290,
 &end
#
#  119 PRO  HD-         119 PRO  HG+         3.50    (#   1327:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1327, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1928,1929,
 igr2=1931,1932,
 &end
#
#    0 AMB  20-2:1328     0 AMB  20-1:1328   2.60    (#   1328:20  Double Ambig)
 &rst
  ixpk= 1328, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1331,1332,2399,2400,
 igr2=1289,1290,2396,2397,
 &end
#
#   79 LEU  HA           80 PRO  HG-         4.40    (#   1329:20  Unique         4.39, 4.43 A)
 &rst
  ixpk= 1329, nxpk= 20, iat=1268,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1289,1290,
 &end
#
#    0 AMB  20-2:1330    80 PRO  HG-         3.50    (#   1330:20  Single Ambig)
 &rst
  ixpk= 1330, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1295,1347,
 igr2=1289,1290,
 &end
#
#  114 GLN  HA          119 PRO  HG+         4.40    (#   1331:20  Unique         2.95, 4.49 A)
 &rst
  ixpk= 1331, nxpk= 20, iat=1862,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1931,1932,
 &end
#
#    0 AMB  20-2:1332     0 AMB  20-1:1332   4.40    (#   1332:20  Double Ambig)
 &rst
  ixpk= 1332, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 448, 452, 616,
 igr2=1931,1932, 814, 815,
 &end
#
#   83 LEU  HN           80 PRO  HG-         5.50    (#   1333:20  Unique         2.60, 3.96 A)
 &rst
  ixpk= 1333, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1289,1290,
 &end
#
#    0 AMB  20-2:1334     0 AMB  20-1:1334   2.60    (#   1334:20  Double Ambig)
 &rst
  ixpk= 1334, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1299,1543,
 igr2=1303,1304,1547,1548,
 &end
#
#    0 AMB  20-2:1335     0 AMB  20-1:1335   2.60    (#   1335:20  Double Ambig)
 &rst
  ixpk= 1335, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2470,1941,
 igr2=2474,2475,1934,1935,
 &end
#
#    0 AMB  20-2:1336     0 AMB  20-1:1336   2.60    (#   1336:20  Double Ambig)
 &rst
  ixpk= 1336, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2492,2597,
 igr2=2474,2475,2584,2585,
 &end
#
#    0 AMB  20-2:1337     0 AMB  20-1:1337   2.60    (#   1337:20  Double Ambig)
 &rst
  ixpk= 1337, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1= 604, 605,1937,2472,
 igr2= 817, 818,1934,1935,2474,2475,
 &end
#
#   53 GLU  HA           53 GLU  HG-         2.60    (#   1338:20  Unique         2.44, 3.21 A)
 &rst
  ixpk= 1338, nxpk= 20, iat= 812,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 817, 818,
 &end
#
#    0 AMB  20-2:1339     0 AMB  20-1:1339   2.60    (#   1339:20  Double Ambig)
 &rst
  ixpk= 1339, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1301,1538,1539,
 igr2=1303,1304,1547,1548,
 &end
#
#    0 AMB  20-2:1340     0 AMB  20-1:1340   5.50    (#   1340:20  Double Ambig)
 &rst
  ixpk= 1340, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.76, r4=11.51,
 igr1=1928,1929, 114, 115,2423,2424,2511,2512,
 igr2=1934,1935,1547,1548,2474,2475, 202,
 &end
#
#    0 AMB  20-2:1341     0 AMB  20-1:1341   5.50    (#   1341:20  Double Ambig)
 &rst
  ixpk= 1341, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1312,1313,2483,2484,
 igr2=1303,1304,2474,2475,
 &end
#
#    0 AMB  20-2:1344     0 AMB  20-1:1344   2.60    (#   1344:20  Double Ambig)
 &rst
  ixpk= 1344, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2480,2481,2477,2478, 814, 815,1931,1932, 793, 794,
      
 igr2=2474,2475, 817, 818,1934,1935,
 &end
#
#    0 AMB  20-2:1345     0 AMB  20-1:1345   2.60    (#   1345:20  Double Ambig)
 &rst
  ixpk= 1345, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.09, r4= 5.84,
 igr1=1306,1307,2477,2478, 793, 794,1368,
 igr2=1303,1304,2474,2475, 817, 818,1303,1304,
 &end
#
#    0 AMB  20-2:1346    54 LEU  HA          2.60    (#   1346:20  Single Ambig)
 &rst
  ixpk= 1346, nxpk= 20, iat=  -1, 827, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1= 189, 190, 192, 193, 194,
 &end
#
#    0 AMB  20-2:1347    54 LEU  HA          2.60    (#   1347:20  Single Ambig)
 &rst
  ixpk= 1347, nxpk= 20, iat=  -1, 827, r1= 0.00, r2= 1.80, r3= 4.08, r4= 4.83,
 igr1= 834, 835, 836, 838, 839, 840, 834, 835, 836, 838,
       839, 840, 185, 186, 187,
 &end
#
#   54 LEU  HB-          54 LEU  HA          3.50    (#   1348:20  Unique         2.29, 2.67 A)
 &rst
  ixpk= 1348, nxpk= 20, iat=  -1, 827, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 829, 830,
 &end
#
#   54 LEU  HG           54 LEU  HA          3.50    (#   1349:20  Unique         2.59, 2.84 A)
 &rst
  ixpk= 1349, nxpk= 20, iat= 832, 827, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1350    54 LEU  HA          3.50    (#   1350:20  Single Ambig)
 &rst
  ixpk= 1350, nxpk= 20, iat=  -1, 827, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 829, 830, 817, 818,
 &end
#
#   57 GLU  HG+          54 LEU  HA          4.40    (#   1351:20  Unique         1.97, 3.24 A)
 &rst
  ixpk= 1351, nxpk= 20, iat=  -1, 827, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 886, 887,
 &end
#
#   55 PHE  HN           54 LEU  HA          5.50    (#   1352:20  Unique         3.50, 3.52 A)
 &rst
  ixpk= 1352, nxpk= 20, iat= 844, 827, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   58 VAL  HN           54 LEU  HA          5.50    (#   1353:20  Unique         2.91, 3.30 A)
 &rst
  ixpk= 1353, nxpk= 20, iat= 894, 827, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   53 GLU  HN           54 LEU  HA          5.50    (#   1354:20  Unique         5.06, 5.13 A)
 &rst
  ixpk= 1354, nxpk= 20, iat= 810, 827, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   56 GLU  HN           54 LEU  HA          5.50    (#   1355:20  Unique         3.92, 4.11 A)
 &rst
  ixpk= 1355, nxpk= 20, iat= 864, 827, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   54 LEU  HN           54 LEU  HA          3.50    (#   1356:20  Unique         2.77, 2.78 A)
 &rst
  ixpk= 1356, nxpk= 20, iat= 825, 827, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1357     0 AMB  20-1:1357   2.60    (#   1357:20  Double Ambig)
 &rst
  ixpk= 1357, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 834, 835, 836, 838, 839, 840, 834, 835, 836, 838,
       839, 840, 185, 186, 187,
 igr2= 829, 830, 829, 830, 829, 830,
 &end
#
#    0 AMB  20-2:1358     0 AMB  20-1:1358   3.50    (#   1358:20  Double Ambig)
 &rst
  ixpk= 1358, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 832, 755, 756,
 igr2= 829, 830, 829, 830,
 &end
#
#   54 LEU  HA           54 LEU  HB+         4.40    (#   1360:20  Unique         2.29, 2.67 A)
 &rst
  ixpk= 1360, nxpk= 20, iat= 827,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 829, 830,
 &end
#
#   51 TYR  HA           54 LEU  HB+         5.50    (#   1361:20  Unique         2.26, 3.01 A)
 &rst
  ixpk= 1361, nxpk= 20, iat= 767,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 829, 830,
 &end
#
#   55 PHE  HN           54 LEU  HB+         5.50    (#   1362:20  Unique         2.64, 3.40 A)
 &rst
  ixpk= 1362, nxpk= 20, iat= 844,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 829, 830,
 &end
#
#   54 LEU  HN           54 LEU  HB+         4.40    (#   1363:20  Unique         2.20, 2.51 A)
 &rst
  ixpk= 1363, nxpk= 20, iat= 825,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 829, 830,
 &end
#
#   54 LEU  HN           54 LEU  HB-         5.50    (#   1364:20  Unique         2.20, 2.51 A)
 &rst
  ixpk= 1364, nxpk= 20, iat= 825,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 829, 830,
 &end
#
#   55 PHE  HN           54 LEU  HB-         5.50    (#   1365:20  Unique         2.64, 3.40 A)
 &rst
  ixpk= 1365, nxpk= 20, iat= 844,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 829, 830,
 &end
#
#   83 LEU  HA           83 LEU  HB-         4.40    (#   1367:20  Unique         2.26, 2.70 A)
 &rst
  ixpk= 1367, nxpk= 20, iat=1347,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1349,1350,
 &end
#
#   53 GLU  HA           54 LEU  HB-         5.50    (#   1368:20  Unique         5.53, 5.79 A)
 &rst
  ixpk= 1368, nxpk= 20, iat= 812,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 829, 830,
 &end
#
#   54 LEU  HA           54 LEU  HB-         5.50    (#   1369:20  Unique         2.29, 2.67 A)
 &rst
  ixpk= 1369, nxpk= 20, iat= 827,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 829, 830,
 &end
#
#    0 AMB  20-2:1371    13 ILE  HB          4.40    (#   1371:20  Single Ambig)
 &rst
  ixpk= 1371, nxpk= 20, iat=  -1, 183, r1= 0.00, r2= 1.80, r3= 5.75, r4= 6.50,
 igr1= 189, 190, 350, 351, 352,
 &end
#
#    0 AMB  20-2:1373    54 LEU  HG          2.60    (#   1373:20  Single Ambig)
 &rst
  ixpk= 1373, nxpk= 20, iat=  -1, 832, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1= 834, 835, 836, 838, 839, 840, 185, 186, 187,
 &end
#
#    0 AMB  20-2:1375     0 AMB  20-1:1375   2.60    (#   1375:20  Double Ambig)
 &rst
  ixpk= 1375, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1303,1304, 817, 818, 829, 830,
 igr2=1306,1307, 793, 794, 832,
 &end
#
#    0 AMB  20-2:1376     0 AMB  20-1:1376   2.60    (#   1376:20  Double Ambig)
 &rst
  ixpk= 1376, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.60, r4= 6.35,
 igr1= 790, 791,1248,1249,1254,1255,1309,1310,2480,2481,
      
 igr2= 793, 794,1251,1252,1251,1252,1306,1307,2477,2478,
      
 &end
#
#    0 AMB  20-2:1377     0 AMB  20-1:1377   2.60    (#   1377:20  Double Ambig)
 &rst
  ixpk= 1377, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.20, r4= 5.95,
 igr1=2483,2484,1257,1258,1312,1313, 796, 797,
 igr2=2477,2478,1251,1252,1306,1307, 793, 794,
 &end
#
#    0 AMB  20-2:1378     0 AMB  20-1:1378   3.50    (#   1378:20  Double Ambig)
 &rst
  ixpk= 1378, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2472, 846,
 igr2=2477,2478, 832,
 &end
#
#    0 AMB  20-2:1379     0 AMB  20-1:1379   4.40    (#   1379:20  Double Ambig)
 &rst
  ixpk= 1379, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1301,1538,1539,
 igr2=1306,1307,1251,1252,
 &end
#
#    0 AMB  20-2:1381     0 AMB  20-1:1381   4.40    (#   1381:20  Double Ambig)
 &rst
  ixpk= 1381, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1419,2130,1364,
 igr2=1306,1307,2477,2478,
 &end
#
#    0 AMB  20-2:1382   149 LYS  HG-         5.50    (#   1382:20  Single Ambig)
 &rst
  ixpk= 1382, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2128,2527,2413,
 igr2=2477,2478,
 &end
#
#    0 AMB  20-2:1383     0 AMB  20-1:1383   5.50    (#   1383:20  Double Ambig)
 &rst
  ixpk= 1383, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2470, 738,
 igr2=2477,2478, 793, 794,
 &end
#
#   81 LYS  HN           81 LYS  HG-         4.40    (#   1384:20  Unique         2.35, 3.35 A)
 &rst
  ixpk= 1384, nxpk= 20, iat=1299,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1306,1307,
 &end
#
#   54 LEU  HN           54 LEU  MDX         4.40    (#   1385:20  Unique         3.98, 5.13 A)
 &rst
  ixpk= 1385, nxpk= 20, iat= 825,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    7 TYR  HE           93 ILE  HG1-        4.40    (#   1386:20  Unique         2.22, 4.13 A)
 &rst
  ixpk= 1386, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=  93,  98,
 igr2=1527,1528,
 &end
#
#    0 AMB  20-2:1388     0 AMB  20-1:1388   4.40    (#   1388:20  Double Ambig)
 &rst
  ixpk= 1388, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1= 769, 770,  87,  88,  68,  69,
 igr2= 834, 835, 836, 838, 839, 840,1527,1528,
 &end
#
#  140 LYS  HE-         140 LYS  HG+         5.50    (#   1389:20  Unique         1.95, 3.27 A)
 &rst
  ixpk= 1389, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2307,2308,
 igr2=2301,2302,
 &end
#
#    0 AMB  20-2:1390    54 LEU  MDX         3.50    (#   1390:20  Single Ambig)
 &rst
  ixpk= 1390, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 829, 830,1009,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:1391    54 LEU  MDX         2.60    (#   1391:20  Single Ambig)
 &rst
  ixpk= 1391, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 832, 224, 225, 755, 756,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:1392    54 LEU  MDX         2.60    (#   1392:20  Single Ambig)
 &rst
  ixpk= 1392, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 924, 951, 952,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:1393    54 LEU  MDX         2.60    (#   1393:20  Single Ambig)
 &rst
  ixpk= 1393, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 189, 190, 350, 351, 352,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:1395    54 LEU  MDY         2.60    (#   1395:20  Single Ambig)
 &rst
  ixpk= 1395, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 924,1691,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:1396    54 LEU  MDY         2.60    (#   1396:20  Single Ambig)
 &rst
  ixpk= 1396, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 832, 224, 225, 755, 756,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:1397    54 LEU  MDY         3.50    (#   1397:20  Single Ambig)
 &rst
  ixpk= 1397, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 189, 190, 350, 351, 352,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#   54 LEU  HB+          54 LEU  MDY         3.50    (#   1398:20  Unique         1.97, 3.21 A)
 &rst
  ixpk= 1398, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 829, 830,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:1399    54 LEU  MDY         3.50    (#   1399:20  Single Ambig)
 &rst
  ixpk= 1399, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 898, 886, 887,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#   54 LEU  HA           54 LEU  MDY         2.60    (#   1400:20  Unique         2.50, 4.31 A)
 &rst
  ixpk= 1400, nxpk= 20, iat= 827,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#   60 LEU  HN           54 LEU  MDY         4.40    (#   1402:20  Unique         2.22, 4.53 A)
 &rst
  ixpk= 1402, nxpk= 20, iat= 917,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#   55 PHE  HN           54 LEU  MDY         4.40    (#   1403:20  Unique         2.61, 5.03 A)
 &rst
  ixpk= 1403, nxpk= 20, iat= 844,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#   54 LEU  HN           54 LEU  MDY         3.70    (#   1404:20  Unique         3.98, 5.13 A)
 &rst
  ixpk= 1404, nxpk= 20, iat= 825,  -1, r1= 0.00, r2= 1.80, r3= 4.99, r4= 5.74,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:1405    55 PHE  HA          4.40    (#   1405:20  Single Ambig)
 &rst
  ixpk= 1405, nxpk= 20, iat=  -1, 846, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 864, 879,
 &end
#
#   55 PHE  HN           55 PHE  HA          3.50    (#   1406:20  Unique         2.82, 2.85 A)
 &rst
  ixpk= 1406, nxpk= 20, iat= 844, 846, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   59 GLY  HN           55 PHE  HA          5.50    (#   1407:20  Unique         2.34, 2.63 A)
 &rst
  ixpk= 1407, nxpk= 20, iat= 910, 846, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:1408     0 AMB  20-1:1408   3.50    (#   1408:20  Double Ambig)
 &rst
  ixpk= 1408, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 852, 860,1034,
 igr2= 846,1741,
 &end
#
#   60 LEU  HN           55 PHE  HA          3.50    (#   1409:20  Unique         1.92, 2.50 A)
 &rst
  ixpk= 1409, nxpk= 20, iat= 917, 846, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   55 PHE  HB+          55 PHE  HA          3.50    (#   1410:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 1410, nxpk= 20, iat=  -1, 846, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 848, 849,
 &end
#
#   55 PHE  HB-          55 PHE  HA          5.50    (#   1411:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 1411, nxpk= 20, iat=  -1, 846, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 848, 849,
 &end
#
#    0 AMB  20-2:1412    55 PHE  HA          3.50    (#   1412:20  Single Ambig)
 &rst
  ixpk= 1412, nxpk= 20, iat=  -1, 846, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 900, 901, 902, 904, 905, 906,1883,1884,1885,
 &end
#
#   55 PHE  HA           55 PHE  HB+         4.40    (#   1415:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 1415, nxpk= 20, iat= 846,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 848, 849,
 &end
#
#   55 PHE  HA           55 PHE  HB-         4.40    (#   1416:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 1416, nxpk= 20, iat= 846,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 848, 849,
 &end
#
#  129 TYR  HD          129 TYR  HB+         3.50    (#   1417:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 1417, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2102,2111,
 igr2=2098,2099,
 &end
#
#   55 PHE  HD           55 PHE  HB+         3.50    (#   1419:20  Unique         2.31, 3.03 A)
 &rst
  ixpk= 1419, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 852, 860,
 igr2= 848, 849,
 &end
#
#   55 PHE  HD           55 PHE  HB-         4.40    (#   1420:20  Unique         2.31, 3.03 A)
 &rst
  ixpk= 1420, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 852, 860,
 igr2= 848, 849,
 &end
#
#   55 PHE  HN           55 PHE  HB+         3.50    (#   1421:20  Unique         2.32, 2.55 A)
 &rst
  ixpk= 1421, nxpk= 20, iat= 844,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 848, 849,
 &end
#
#   55 PHE  HN           55 PHE  HB-         4.40    (#   1422:20  Unique         2.32, 2.55 A)
 &rst
  ixpk= 1422, nxpk= 20, iat= 844,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 848, 849,
 &end
#
#    0 AMB  20-2:1423     0 AMB  20-1:1423   5.50    (#   1423:20  Double Ambig)
 &rst
  ixpk= 1423, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2139, 244,
 igr2=2098,2099,2098,2099,
 &end
#
#   56 GLU  HN           55 PHE  HB+         5.50    (#   1424:20  Unique         2.63, 3.47 A)
 &rst
  ixpk= 1424, nxpk= 20, iat= 864,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 848, 849,
 &end
#
#   56 GLU  HN           55 PHE  HB-         4.40    (#   1425:20  Unique         2.63, 3.47 A)
 &rst
  ixpk= 1425, nxpk= 20, iat= 864,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 848, 849,
 &end
#
#   56 GLU  HN           55 PHE  HB-         5.50    (#   1426:20  Unique         2.63, 3.47 A)
 &rst
  ixpk= 1426, nxpk= 20, iat= 864,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 848, 849,
 &end
#
#   29 GLY  HN           28 PHE  HA          3.50    (#   1428:20  Unique         2.14, 2.19 A)
 &rst
  ixpk= 1428, nxpk= 20, iat= 458, 440, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  115 THR  MG2          56 GLU  HA          5.50    (#   1429:20  Unique         2.35, 4.10 A)
 &rst
  ixpk= 1429, nxpk= 20, iat=  -1, 866, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1883,1884,1885,
 &end
#
#    0 AMB  20-2:1430     0 AMB  20-1:1430   3.50    (#   1430:20  Double Ambig)
 &rst
  ixpk= 1430, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 igr2=2393,2394,2393,2394,
 &end
#
#    0 AMB  20-2:1431     0 AMB  20-1:1431   2.60    (#   1431:20  Double Ambig)
 &rst
  ixpk= 1431, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2651,2652, 886, 887,2634,2635,
 igr2=2648,2649, 868, 869,2648,2649,
 &end
#
#    0 AMB  20-2:1432     0 AMB  20-1:1432   2.60    (#   1432:20  Double Ambig)
 &rst
  ixpk= 1432, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2651,2652, 886, 887,2634,2635,
 igr2=2648,2649, 868, 869,
 &end
#
#   56 GLU  HG+          56 GLU  HB+         2.60    (#   1433:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 1433, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 871, 872,
 igr2= 868, 869,
 &end
#
#   56 GLU  HG+          56 GLU  HB-         3.50    (#   1434:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 1434, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 871, 872,
 igr2= 868, 869,
 &end
#
#  145 ARG  HD+         145 ARG  HB+         2.60    (#   1436:20  Unique         2.15, 2.94 A)
 &rst
  ixpk= 1436, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2399,2400,
 igr2=2393,2394,
 &end
#
#   56 GLU  HA           56 GLU  HB-         3.50    (#   1437:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 1437, nxpk= 20, iat= 866,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 868, 869,
 &end
#
#   56 GLU  HA           56 GLU  HB+         3.50    (#   1438:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 1438, nxpk= 20, iat= 866,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 868, 869,
 &end
#
#  160 GLU  HA          160 GLU  HB+         2.60    (#   1439:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1439, nxpk= 20, iat=2646,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2648,2649,
 &end
#
#  160 GLU  HA          160 GLU  HB-         2.60    (#   1440:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1440, nxpk= 20, iat=2646,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2648,2649,
 &end
#
#  160 GLU  HN          160 GLU  HB+         2.60    (#   1441:20  Unique         2.30, 3.00 A)
 &rst
  ixpk= 1441, nxpk= 20, iat=2644,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2648,2649,
 &end
#
#  160 GLU  HN          160 GLU  HB-         2.60    (#   1442:20  Unique         2.30, 3.00 A)
 &rst
  ixpk= 1442, nxpk= 20, iat=2644,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2648,2649,
 &end
#
#  161 ASN  HN          160 GLU  HB+         3.50    (#   1443:20  Unique         2.31, 3.25 A)
 &rst
  ixpk= 1443, nxpk= 20, iat=2659,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2648,2649,
 &end
#
#  161 ASN  HN          160 GLU  HB-         3.50    (#   1444:20  Unique         2.31, 3.25 A)
 &rst
  ixpk= 1444, nxpk= 20, iat=2659,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2648,2649,
 &end
#
#    0 AMB  20-2:1445     0 AMB  20-1:1445   3.50    (#   1445:20  Double Ambig)
 &rst
  ixpk= 1445, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 864, 879,
 igr2= 868, 869, 868, 869,
 &end
#
#    0 AMB  20-2:1446    56 GLU  HB-         3.50    (#   1446:20  Single Ambig)
 &rst
  ixpk= 1446, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 864, 879,
 igr2= 868, 869,
 &end
#
#  145 ARG  HN          145 ARG  HB+         2.60    (#   1447:20  Unique         2.15, 2.70 A)
 &rst
  ixpk= 1447, nxpk= 20, iat=2389,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2393,2394,
 &end
#
#   56 GLU  HN           56 GLU  HG+         3.50    (#   1449:20  Unique         2.33, 2.82 A)
 &rst
  ixpk= 1449, nxpk= 20, iat= 864,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 871, 872,
 &end
#
#   56 GLU  HN           56 GLU  HG-         3.50    (#   1450:20  Unique         2.33, 2.82 A)
 &rst
  ixpk= 1450, nxpk= 20, iat= 864,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 871, 872,
 &end
#
#    0 AMB  20-2:1451     0 AMB  20-1:1451   5.50    (#   1451:20  Double Ambig)
 &rst
  ixpk= 1451, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 854, 858, 894,
 igr2= 871, 872, 871, 872,
 &end
#
#   55 PHE  HD           56 GLU  HG+         4.40    (#   1452:20  Unique         2.48, 5.35 A)
 &rst
  ixpk= 1452, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 852, 860,
 igr2= 871, 872,
 &end
#
#   55 PHE  HD           56 GLU  HG-         3.50    (#   1453:20  Unique         2.48, 5.35 A)
 &rst
  ixpk= 1453, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 852, 860,
 igr2= 871, 872,
 &end
#
#    0 AMB  20-2:1454    56 GLU  HG-         5.50    (#   1454:20  Single Ambig)
 &rst
  ixpk= 1454, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 854, 858, 894,
 igr2= 871, 872,
 &end
#
#    0 AMB  20-2:1456     0 AMB  20-1:1456   5.50    (#   1456:20  Double Ambig)
 &rst
  ixpk= 1456, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 788,1845,
 igr2= 871, 872, 871, 872,
 &end
#
#   56 GLU  HA           56 GLU  HG+         3.50    (#   1457:20  Unique         2.34, 3.01 A)
 &rst
  ixpk= 1457, nxpk= 20, iat= 866,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 871, 872,
 &end
#
#   56 GLU  HA           56 GLU  HG-         2.60    (#   1458:20  Unique         2.34, 3.01 A)
 &rst
  ixpk= 1458, nxpk= 20, iat= 866,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 871, 872,
 &end
#
#    0 AMB  20-2:1459     0 AMB  20-1:1459   5.50    (#   1459:20  Double Ambig)
 &rst
  ixpk= 1459, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 848, 849, 796, 797,
 igr2= 871, 872, 871, 872,
 &end
#
#   55 PHE  HB+          56 GLU  HG-         5.50    (#   1460:20  Unique         3.02, 4.48 A)
 &rst
  ixpk= 1460, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 848, 849,
 igr2= 871, 872,
 &end
#
#   56 GLU  HB+          56 GLU  HG+         2.60    (#   1461:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 1461, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 868, 869,
 igr2= 871, 872,
 &end
#
#   56 GLU  HB-          56 GLU  HG+         2.60    (#   1462:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 1462, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 868, 869,
 igr2= 871, 872,
 &end
#
#   56 GLU  HB+          56 GLU  HG-         2.60    (#   1463:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 1463, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 868, 869,
 igr2= 871, 872,
 &end
#
#   56 GLU  HB-          56 GLU  HG-         2.60    (#   1464:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 1464, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 868, 869,
 igr2= 871, 872,
 &end
#
#   52 ARG  HG-          56 GLU  HG+         4.40    (#   1465:20  Unique         2.89, 4.77 A)
 &rst
  ixpk= 1465, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 793, 794,
 igr2= 871, 872,
 &end
#
#   58 VAL  HN           57 GLU  HA          4.40    (#   1468:20  Unique         3.54, 3.55 A)
 &rst
  ixpk= 1468, nxpk= 20, iat= 894, 881, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   57 GLU  HG-          57 GLU  HB+         5.50    (#   1475:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 1475, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 886, 887,
 igr2= 883, 884,
 &end
#
#    0 AMB  20-2:1476     0 AMB  20-1:1476   4.40    (#   1476:20  Double Ambig)
 &rst
  ixpk= 1476, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2644, 585,
 igr2=2634,2635, 886, 887,
 &end
#
#    0 AMB  20-2:1477     0 AMB  20-1:1477   5.50    (#   1477:20  Double Ambig)
 &rst
  ixpk= 1477, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.00, r4=11.75,
 igr1= 446, 454, 852, 860, 559, 567, 773, 782,
 igr2= 886, 887, 886, 887, 886, 887, 886, 887,
 &end
#
#    0 AMB  20-2:1479     0 AMB  20-1:1479   2.60    (#   1479:20  Double Ambig)
 &rst
  ixpk= 1479, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2582,2646,2629,
 igr2=2634,2635,2634,2635,2634,2635,2634,2635,
 &end
#
#   58 VAL  MGX          57 GLU  HG+         4.40    (#   1481:20  Unique         1.88, 6.06 A)
 &rst
  ixpk= 1481, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 900, 901, 902, 904, 905, 906,
 igr2= 886, 887,
 &end
#
#    0 AMB  20-2:1482     0 AMB  20-1:1482   5.50    (#   1482:20  Double Ambig)
 &rst
  ixpk= 1482, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 301, 302, 301, 302,
 igr2=2634,2635,2634,2635,
 &end
#
#  111 ILE  QG2          58 VAL  HA          4.40    (#   1483:20  Unique         2.39, 3.77 A)
 &rst
  ixpk= 1483, nxpk= 20, iat=  -1, 896, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1816,1817,1818,
 &end
#
#    0 AMB  20-2:1484    58 VAL  HA          2.60    (#   1484:20  Single Ambig)
 &rst
  ixpk= 1484, nxpk= 20, iat=  -1, 896, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,
 &end
#
#  113 MET  ME           58 VAL  HA          3.50    (#   1485:20  Unique         2.05, 3.38 A)
 &rst
  ixpk= 1485, nxpk= 20, iat=  -1, 896, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1854,1855,1856,
 &end
#
#    0 AMB  20-2:1486    58 VAL  HA          3.50    (#   1486:20  Single Ambig)
 &rst
  ixpk= 1486, nxpk= 20, iat=  -1, 896, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 898, 886, 887,
 &end
#
#  113 MET  HG-          58 VAL  HA          4.40    (#   1487:20  Unique         2.56, 3.96 A)
 &rst
  ixpk= 1487, nxpk= 20, iat=  -1, 896, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1850,1851,
 &end
#
#   58 VAL  HN           58 VAL  HA          3.50    (#   1488:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 1488, nxpk= 20, iat= 894, 896, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   59 GLY  HN           58 VAL  HA          4.40    (#   1489:20  Unique         3.02, 3.34 A)
 &rst
  ixpk= 1489, nxpk= 20, iat= 910, 896, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  160 GLU  HN          157 SER  HA          3.50    (#   1490:20  Unique         3.71, 3.87 A)
 &rst
  ixpk= 1490, nxpk= 20, iat=2644,2599, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1492     0 AMB  20-1:1492   4.40    (#   1492:20  Double Ambig)
 &rst
  ixpk= 1492, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.25, r4= 8.00,
 igr1= 467, 604, 605, 846,
 igr2= 472, 473, 592, 593, 898,
 &end
#
#    0 AMB  20-2:1494    58 VAL  MGX         4.40    (#   1494:20  Single Ambig)
 &rst
  ixpk= 1494, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.76, r4= 8.51,
 igr1= 886, 887, 898, 883, 884,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#   54 LEU  HA           58 VAL  MGX         3.50    (#   1495:20  Unique         2.28, 5.41 A)
 &rst
  ixpk= 1495, nxpk= 20, iat= 827,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1496     0 AMB  20-1:1496   2.60    (#   1496:20  Double Ambig)
 &rst
  ixpk= 1496, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2566,1812,
 igr2=2570,2571,2572,2574,2575,2576, 900, 901, 902, 904,
       905, 906,
 &end
#
#   20 GLY  HA-         155 VAL  MGX         2.60    (#   1497:20  Unique         2.00, 4.17 A)
 &rst
  ixpk= 1497, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 301, 302,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#   20 GLY  HA+         155 VAL  MGX         3.50    (#   1498:20  Unique         2.00, 4.17 A)
 &rst
  ixpk= 1498, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 301, 302,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:1499   155 VAL  MGX         3.50    (#   1499:20  Single Ambig)
 &rst
  ixpk= 1499, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2582,2610,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#   58 VAL  HA           58 VAL  MGX         2.60    (#   1500:20  Unique         1.95, 3.22 A)
 &rst
  ixpk= 1500, nxpk= 20, iat= 896,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1501     0 AMB  20-1:1501   3.50    (#   1501:20  Double Ambig)
 &rst
  ixpk= 1501, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 917,2639,2640,
 igr2= 900, 901, 902, 904, 905, 906,2570,2571,2572,2574,
      2575,2576,
 &end
#
#    0 AMB  20-2:1502    58 VAL  MGX         5.50    (#   1502:20  Single Ambig)
 &rst
  ixpk= 1502, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 852, 860, 773, 782,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1503     0 AMB  20-1:1503   4.40    (#   1503:20  Double Ambig)
 &rst
  ixpk= 1503, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.71, r4= 9.46,
 igr1=1715,1716,2058, 559, 567,
 igr2=2570,2571,2572,2574,2575,2576, 900, 901, 902, 904,
       905, 906,
 &end
#
#   58 VAL  HN           58 VAL  MGX         2.60    (#   1504:20  Unique         1.94, 3.91 A)
 &rst
  ixpk= 1504, nxpk= 20, iat= 894,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1505     0 AMB  20-1:1505   3.50    (#   1505:20  Double Ambig)
 &rst
  ixpk= 1505, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2564, 910,
 igr2=2570,2571,2572,2574,2575,2576, 900, 901, 902, 904,
       905, 906,
 &end
#
#    0 AMB  20-2:1506     0 AMB  20-1:1506   2.60    (#   1506:20  Double Ambig)
 &rst
  ixpk= 1506, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2564, 910,
 igr2=2570,2571,2572,2574,2575,2576, 900, 901, 902, 904,
       905, 906,
 &end
#
#  156 MET  HN          155 VAL  MGX         3.50    (#   1507:20  Unique         2.02, 4.37 A)
 &rst
  ixpk= 1507, nxpk= 20, iat=2580,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:1508    58 VAL  MGX         3.50    (#   1508:20  Single Ambig)
 &rst
  ixpk= 1508, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 879, 864,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#   58 VAL  HN           58 VAL  MGY         3.50    (#   1509:20  Unique         1.94, 3.91 A)
 &rst
  ixpk= 1509, nxpk= 20, iat= 894,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#   60 LEU  HN           58 VAL  MGY         4.40    (#   1511:20  Unique         1.86, 4.45 A)
 &rst
  ixpk= 1511, nxpk= 20, iat= 917,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#   58 VAL  HA           58 VAL  MGY         2.60    (#   1513:20  Unique         1.95, 3.22 A)
 &rst
  ixpk= 1513, nxpk= 20, iat= 896,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1514     0 AMB  20-1:1514   2.60    (#   1514:20  Double Ambig)
 &rst
  ixpk= 1514, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1519,1775,1845,
 igr2=1370,1371,1372,1374,1375,1376, 900, 901, 902, 904,
       905, 906,
 &end
#
#    0 AMB  20-2:1515     0 AMB  20-1:1515   4.40    (#   1515:20  Double Ambig)
 &rst
  ixpk= 1515, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.71, r4= 9.46,
 igr1=1268,1797, 812,  78,  79,
 igr2=1370,1371,1372,1374,1375,1376, 900, 901, 902, 904,
       905, 906,
 &end
#
#   81 LYS  HA           84 VAL  MGY         2.60    (#   1516:20  Unique         1.92, 3.95 A)
 &rst
  ixpk= 1516, nxpk= 20, iat=1301,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:1517     0 AMB  20-1:1517   2.60    (#   1517:20  Double Ambig)
 &rst
  ixpk= 1517, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1812,1366,
 igr2= 900, 901, 902, 904, 905, 906,1370,1371,1372,1374,
      1375,1376,
 &end
#
#  124 TRP  HB-          58 VAL  MGY         5.50    (#   1518:20  Unique         4.54, 7.71 A)
 &rst
  ixpk= 1518, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1999,2000,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#  113 MET  HG+          58 VAL  MGY         4.40    (#   1519:20  Unique         2.95, 6.32 A)
 &rst
  ixpk= 1519, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1850,1851,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1520    58 VAL  MGY         4.40    (#   1520:20  Single Ambig)
 &rst
  ixpk= 1520, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.76, r4= 8.51,
 igr1= 886, 887, 898, 883, 884,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1521    58 VAL  MGY         2.60    (#   1521:20  Single Ambig)
 &rst
  ixpk= 1521, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 350, 351, 352, 189, 190,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#  113 MET  ME           58 VAL  MGY         3.50    (#   1522:20  Unique         2.00, 5.08 A)
 &rst
  ixpk= 1522, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1854,1855,1856,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1523    58 VAL  MGY         2.60    (#   1523:20  Single Ambig)
 &rst
  ixpk= 1523, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1= 926, 927, 928, 930, 931, 932, 189, 190,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1524    58 VAL  MGY         2.60    (#   1524:20  Single Ambig)
 &rst
  ixpk= 1524, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1820,1821, 384, 385, 386,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#  111 ILE  QG2          58 VAL  MGY         2.60    (#   1525:20  Unique         1.99, 5.01 A)
 &rst
  ixpk= 1525, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1816,1817,1818,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#   84 VAL  MGX          79 LEU  MDY         4.40    (#   1526:20  Unique         1.98, 4.89 A)
 &rst
  ixpk= 1526, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=1370,1371,1372,1374,1375,1376,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#  111 ILE  QD1          58 VAL  MGY         4.40    (#   1527:20  Unique         2.05, 5.77 A)
 &rst
  ixpk= 1527, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1823,1824,1825,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:1528     0 AMB  20-1:1528   4.40    (#   1528:20  Double Ambig)
 &rst
  ixpk= 1528, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 900, 901, 902, 904, 905, 906,1883,1884,1885,
 igr2= 912, 913, 912, 913,
 &end
#
#    0 AMB  20-2:1529    59 GLY  HA-         3.50    (#   1529:20  Single Ambig)
 &rst
  ixpk= 1529, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 900, 901, 902, 904, 905, 906,1883,1884,1885,
 igr2= 912, 913,
 &end
#
#  112 ASN  HB+          59 GLY  HA+         4.40    (#   1530:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 1530, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1833,1834,
 igr2= 912, 913,
 &end
#
#  112 ASN  HB+          59 GLY  HA-         5.50    (#   1531:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 1531, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1833,1834,
 igr2= 912, 913,
 &end
#
#    0 AMB  20-2:1532     0 AMB  20-1:1532   3.50    (#   1532:20  Double Ambig)
 &rst
  ixpk= 1532, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 910,1838,1839,
 igr2= 912, 913, 912, 913,
 &end
#
#   59 GLY  HN           59 GLY  HA-         3.50    (#   1533:20  Unique         2.29, 2.55 A)
 &rst
  ixpk= 1533, nxpk= 20, iat= 910,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 912, 913,
 &end
#
#  112 ASN  HN           59 GLY  HA+         5.50    (#   1534:20  Unique         1.90, 3.24 A)
 &rst
  ixpk= 1534, nxpk= 20, iat=1829,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 912, 913,
 &end
#
#  112 ASN  HN           59 GLY  HA-         4.40    (#   1535:20  Unique         1.90, 3.24 A)
 &rst
  ixpk= 1535, nxpk= 20, iat=1829,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 912, 913,
 &end
#
#   61 SER  HN           60 LEU  HA          3.50    (#   1536:20  Unique         2.26, 2.31 A)
 &rst
  ixpk= 1536, nxpk= 20, iat= 936, 919, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1539     3 ASP  HA          4.40    (#   1539:20  Single Ambig)
 &rst
  ixpk= 1539, nxpk= 20, iat=  -1,  42, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=  23, 665, 666,   6,
 &end
#
#    0 AMB  20-2:1540     0 AMB  20-1:1540   5.50    (#   1540:20  Double Ambig)
 &rst
  ixpk= 1540, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 912, 913, 129, 130,
 igr2= 919,  42,
 &end
#
#    0 AMB  20-2:1541     0 AMB  20-1:1541   4.40    (#   1541:20  Double Ambig)
 &rst
  ixpk= 1541, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=  56,  57,1833,1834,
 igr2=  42, 919,
 &end
#
#   60 LEU  HG           60 LEU  HA          5.50    (#   1542:20  Unique         2.12, 3.43 A)
 &rst
  ixpk= 1542, nxpk= 20, iat= 924, 919, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   60 LEU  HB+          60 LEU  HA          5.50    (#   1543:20  Unique         2.63, 2.83 A)
 &rst
  ixpk= 1543, nxpk= 20, iat=  -1, 919, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 921, 922,
 &end
#
#    0 AMB  20-2:1546     0 AMB  20-1:1546   3.50    (#   1546:20  Double Ambig)
 &rst
  ixpk= 1546, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2= 921, 922, 921, 922,
 &end
#
#    0 AMB  20-2:1547    60 LEU  HB-         3.50    (#   1547:20  Single Ambig)
 &rst
  ixpk= 1547, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2= 921, 922,
 &end
#
#   60 LEU  HA           60 LEU  HB-         5.50    (#   1548:20  Unique         2.63, 2.83 A)
 &rst
  ixpk= 1548, nxpk= 20, iat= 919,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 921, 922,
 &end
#
#   78 LYS  HN           78 LYS  HG-         4.40    (#   1550:20  Unique         2.08, 3.45 A)
 &rst
  ixpk= 1550, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1251,1252,
 &end
#
#   79 LEU  HN           78 LYS  HG-         4.40    (#   1551:20  Unique         4.40, 4.76 A)
 &rst
  ixpk= 1551, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1251,1252,
 &end
#
#    0 AMB  20-2:1552    78 LYS  HG-         5.50    (#   1552:20  Single Ambig)
 &rst
  ixpk= 1552, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=  93,  98,1231,1240,
 igr2=1251,1252,
 &end
#
#    0 AMB  20-2:1553     0 AMB  20-1:1553   3.50    (#   1553:20  Double Ambig)
 &rst
  ixpk= 1553, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 919,1246,
 igr2= 924,1251,1252,
 &end
#
#   78 LYS  HE+          78 LYS  HG-         3.50    (#   1554:20  Unique         2.06, 3.21 A)
 &rst
  ixpk= 1554, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1257,1258,
 igr2=1251,1252,
 &end
#
#   78 LYS  HB+          78 LYS  HG-         3.50    (#   1555:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 1555, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1248,1249,
 igr2=1251,1252,
 &end
#
#    0 AMB  20-2:1557    78 LYS  HG-         2.60    (#   1557:20  Single Ambig)
 &rst
  ixpk= 1557, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1248,1249,1254,1255,
 igr2=1251,1252,
 &end
#
#    0 AMB  20-2:1559    60 LEU  HG          2.60    (#   1559:20  Single Ambig)
 &rst
  ixpk= 1559, nxpk= 20, iat=  -1, 924, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#    0 AMB  20-2:1560    60 LEU  MDX         2.60    (#   1560:20  Single Ambig)
 &rst
  ixpk= 1560, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 921, 922, 350, 351, 352,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#   60 LEU  HG           60 LEU  MDX         2.60    (#   1561:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1561, nxpk= 20, iat= 924,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  104 LEU  MDX          60 LEU  MDX         2.60    (#   1562:20  Unique         1.98, 4.76 A)
 &rst
  ixpk= 1562, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  111 ILE  QD1          60 LEU  MDX         5.50    (#   1563:20  Unique         3.71, 6.34 A)
 &rst
  ixpk= 1563, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1823,1824,1825,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  111 ILE  QG2          60 LEU  MDX         5.50    (#   1564:20  Unique         3.07, 6.47 A)
 &rst
  ixpk= 1564, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1816,1817,1818,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#   64 ASP  HB+          60 LEU  MDX         4.40    (#   1565:20  Unique         1.99, 4.28 A)
 &rst
  ixpk= 1565, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 997, 998,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#   58 VAL  HB           60 LEU  MDX         5.50    (#   1566:20  Unique         1.98, 5.34 A)
 &rst
  ixpk= 1566, nxpk= 20, iat= 898,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  111 ILE  HA           60 LEU  MDX         5.50    (#   1567:20  Unique         1.98, 3.93 A)
 &rst
  ixpk= 1567, nxpk= 20, iat=1812,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#   93 ILE  HA           93 ILE  HG1+        4.40    (#   1568:20  Unique         3.55, 3.88 A)
 &rst
  ixpk= 1568, nxpk= 20, iat=1519,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1527,1528,
 &end
#
#    7 TYR  HE           93 ILE  HG1+        5.50    (#   1569:20  Unique         2.22, 4.13 A)
 &rst
  ixpk= 1569, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  93,  98,
 igr2=1527,1528,
 &end
#
#   60 LEU  HN           60 LEU  MDX         3.50    (#   1570:20  Unique         2.54, 4.65 A)
 &rst
  ixpk= 1570, nxpk= 20, iat= 917,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#    0 AMB  20-2:1571     0 AMB  20-1:1571   5.50    (#   1571:20  Double Ambig)
 &rst
  ixpk= 1571, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1536,1795,
 igr2=1527,1528, 926, 927, 928, 930, 931, 932,
 &end
#
#    0 AMB  20-2:1572     0 AMB  20-1:1572   5.50    (#   1572:20  Double Ambig)
 &rst
  ixpk= 1572, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=  76, 947,
 igr2=1527,1528, 926, 927, 928, 930, 931, 932,
 &end
#
#   61 SER  HN           60 LEU  MDY         3.50    (#   1573:20  Unique         1.94, 4.01 A)
 &rst
  ixpk= 1573, nxpk= 20, iat= 936,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  102 LEU  HN          101 LEU  MDX         3.50    (#   1574:20  Unique         1.94, 4.25 A)
 &rst
  ixpk= 1574, nxpk= 20, iat=1684,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:1575   101 LEU  MDX         5.50    (#   1575:20  Single Ambig)
 &rst
  ixpk= 1575, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 198, 323,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:1576     0 AMB  20-1:1576   4.40    (#   1576:20  Double Ambig)
 &rst
  ixpk= 1576, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=1766,1665,
 igr2= 926, 927, 928, 930, 931, 932,1674,1675,1676,1678,
      1679,1680,
 &end
#
#  112 ASN  HN           60 LEU  MDY         5.50    (#   1577:20  Unique         2.81, 5.31 A)
 &rst
  ixpk= 1577, nxpk= 20, iat=1829,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#   69 ALA  HN          101 LEU  MDX         4.40    (#   1578:20  Unique         2.36, 4.90 A)
 &rst
  ixpk= 1578, nxpk= 20, iat=1083,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:1579     0 AMB  20-1:1579   5.50    (#   1579:20  Double Ambig)
 &rst
  ixpk= 1579, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1795,2507,
 igr2= 926, 927, 928, 930, 931, 932,1674,1675,1676,1678,
      1679,1680,
 &end
#
#    0 AMB  20-2:1580     0 AMB  20-1:1580   5.50    (#   1580:20  Double Ambig)
 &rst
  ixpk= 1580, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2564,1005,
 igr2=1674,1675,1676,1678,1679,1680, 926, 927, 928, 930,
       931, 932,
 &end
#
#  111 ILE  HN           60 LEU  MDY         5.50    (#   1581:20  Unique         2.58, 4.38 A)
 &rst
  ixpk= 1581, nxpk= 20, iat=1810,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  151 PHE  HD          101 LEU  MDX         3.50    (#   1582:20  Unique         2.46, 5.47 A)
 &rst
  ixpk= 1582, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2515,2523,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#   60 LEU  HN           60 LEU  MDY         3.50    (#   1583:20  Unique         2.54, 4.65 A)
 &rst
  ixpk= 1583, nxpk= 20, iat= 917,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  101 LEU  HA          101 LEU  MDX         2.60    (#   1584:20  Unique         1.96, 3.75 A)
 &rst
  ixpk= 1584, nxpk= 20, iat=1667,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  110 GLU  HA           60 LEU  MDY         4.40    (#   1586:20  Unique         3.93, 5.35 A)
 &rst
  ixpk= 1586, nxpk= 20, iat=1797,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  111 ILE  HA           60 LEU  MDY         3.50    (#   1587:20  Unique         1.98, 3.93 A)
 &rst
  ixpk= 1587, nxpk= 20, iat=1812,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#   64 ASP  HB+          60 LEU  MDY         3.50    (#   1588:20  Unique         1.99, 4.28 A)
 &rst
  ixpk= 1588, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 997, 998,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#    0 AMB  20-2:1589     0 AMB  20-1:1589   2.60    (#   1589:20  Double Ambig)
 &rst
  ixpk= 1589, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2552,1009, 202,
 igr2=1674,1675,1676,1678,1679,1680, 926, 927, 928, 930,
       931, 932,
 &end
#
#  110 GLU  HB+          60 LEU  MDY         3.50    (#   1590:20  Unique         2.00, 3.36 A)
 &rst
  ixpk= 1590, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1799,1800,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  110 GLU  HB-          60 LEU  MDY         3.50    (#   1591:20  Unique         2.00, 3.36 A)
 &rst
  ixpk= 1591, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1799,1800,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#   60 LEU  HG           60 LEU  MDY         2.60    (#   1592:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1592, nxpk= 20, iat= 924,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#    0 AMB  20-2:1593     0 AMB  20-1:1593   2.60    (#   1593:20  Double Ambig)
 &rst
  ixpk= 1593, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 921, 922,1087,1088,1089,
 igr2= 926, 927, 928, 930, 931, 932,1674,1675,1676,1678,
      1679,1680,
 &end
#
#    0 AMB  20-2:1594     0 AMB  20-1:1594   2.60    (#   1594:20  Double Ambig)
 &rst
  ixpk= 1594, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.48, r4= 7.23,
 igr1=1729,1730,1731,1733,1734,1735,1669,1670,2554,2555,
      2556,2558,2559,2560,1073,1074,1075,1077,1078,1079,
      
 igr2= 926, 927, 928, 930, 931, 932,1674,1675,1676,1678,
      1679,1680,
 &end
#
#  111 ILE  QG2          60 LEU  MDY         4.40    (#   1595:20  Unique         3.07, 6.47 A)
 &rst
  ixpk= 1595, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1816,1817,1818,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  111 ILE  QD1          60 LEU  MDY         4.40    (#   1596:20  Unique         3.71, 6.34 A)
 &rst
  ixpk= 1596, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1823,1824,1825,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  101 LEU  HB-         101 LEU  MDX         3.50    (#   1597:20  Unique         1.98, 3.36 A)
 &rst
  ixpk= 1597, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1669,1670,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:1598     0 AMB  20-1:1598   3.50    (#   1598:20  Double Ambig)
 &rst
  ixpk= 1598, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 978, 979, 978, 979,
 igr2= 940, 941, 940, 941,
 &end
#
#    0 AMB  20-2:1599    61 SER  HB-         3.50    (#   1599:20  Single Ambig)
 &rst
  ixpk= 1599, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 978, 979, 978, 979,
 igr2= 940, 941,
 &end
#
#    0 AMB  20-2:1600     0 AMB  20-1:1600   3.50    (#   1600:20  Double Ambig)
 &rst
  ixpk= 1600, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 921, 922, 924, 951, 952,
 igr2= 940, 941, 940, 941, 940, 941,
 &end
#
#    0 AMB  20-2:1601    61 SER  HB-         4.40    (#   1601:20  Single Ambig)
 &rst
  ixpk= 1601, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.46, r4= 7.21,
 igr1= 921, 922, 924, 951, 952,
 igr2= 940, 941,
 &end
#
#   51 TYR  HB+          61 SER  HB-         5.50    (#   1602:20  Unique         7.72, 9.53 A)
 &rst
  ixpk= 1602, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 769, 770,
 igr2= 940, 941,
 &end
#
#    0 AMB  20-2:1603     0 AMB  20-1:1603   5.50    (#   1603:20  Double Ambig)
 &rst
  ixpk= 1603, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 984, 985, 769, 770,
 igr2= 940, 941, 940, 941,
 &end
#
#   61 SER  HA           61 SER  HB+         2.60    (#   1604:20  Unique         2.25, 2.66 A)
 &rst
  ixpk= 1604, nxpk= 20, iat= 938,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 940, 941,
 &end
#
#   55 PHE  HD           61 SER  HB+         4.40    (#   1608:20  Unique         4.12, 7.53 A)
 &rst
  ixpk= 1608, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 852, 860,
 igr2= 940, 941,
 &end
#
#   63 LYS  HN           61 SER  HB+         3.50    (#   1609:20  Unique         2.51, 3.38 A)
 &rst
  ixpk= 1609, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 940, 941,
 &end
#
#   63 LYS  HN           61 SER  HB-         3.50    (#   1610:20  Unique         2.51, 3.38 A)
 &rst
  ixpk= 1610, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 940, 941,
 &end
#
#   62 ARG  HN           61 SER  HB+         2.60    (#   1611:20  Unique         2.29, 3.23 A)
 &rst
  ixpk= 1611, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 940, 941,
 &end
#
#   62 ARG  HN           61 SER  HB-         2.60    (#   1612:20  Unique         2.29, 3.23 A)
 &rst
  ixpk= 1612, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 940, 941,
 &end
#
#   61 SER  HN           61 SER  HB+         3.50    (#   1613:20  Unique         2.13, 3.09 A)
 &rst
  ixpk= 1613, nxpk= 20, iat= 936,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 940, 941,
 &end
#
#   61 SER  HN           61 SER  HB-         3.50    (#   1614:20  Unique         2.13, 3.09 A)
 &rst
  ixpk= 1614, nxpk= 20, iat= 936,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 940, 941,
 &end
#
#   62 ARG  HN           62 ARG  HA          3.50    (#   1615:20  Unique         2.78, 2.82 A)
 &rst
  ixpk= 1615, nxpk= 20, iat= 947, 949, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   63 LYS  HN           62 ARG  HA          5.50    (#   1616:20  Unique         3.48, 3.52 A)
 &rst
  ixpk= 1616, nxpk= 20, iat= 971, 949, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   65 VAL  HN           62 ARG  HA          4.40    (#   1617:20  Unique         3.71, 4.02 A)
 &rst
  ixpk= 1617, nxpk= 20, iat=1005, 949, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   51 TYR  HE           62 ARG  HA          2.60    (#   1619:20  Unique         2.60, 4.71 A)
 &rst
  ixpk= 1619, nxpk= 20, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 775, 780,
 &end
#
#    0 AMB  20-2:1621    62 ARG  HA          3.50    (#   1621:20  Single Ambig)
 &rst
  ixpk= 1621, nxpk= 20, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 769, 770, 957, 958,
 &end
#
#   62 ARG  HB+          62 ARG  HA          2.60    (#   1622:20  Unique         2.34, 2.45 A)
 &rst
  ixpk= 1622, nxpk= 20, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 951, 952,
 &end
#
#    0 AMB  20-2:1623    62 ARG  HA          3.50    (#   1623:20  Single Ambig)
 &rst
  ixpk= 1623, nxpk= 20, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 954, 955, 978, 979,
 &end
#
#   65 VAL  MGX          62 ARG  HA          2.60    (#   1624:20  Unique         2.07, 5.07 A)
 &rst
  ixpk= 1624, nxpk= 20, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1011,1012,1013,1015,1016,1017,
 &end
#
#   54 LEU  MDX          62 ARG  HA          4.40    (#   1625:20  Unique         3.33, 5.18 A)
 &rst
  ixpk= 1625, nxpk= 20, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 834, 835, 836, 838, 839, 840,
 &end
#
#  140 LYS  HG+         140 LYS  HD+         2.60    (#   1626:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1626, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2301,2302,
 igr2=2304,2305,
 &end
#
#   62 ARG  HG-          62 ARG  HB+         2.60    (#   1627:20  Unique         2.33, 2.72 A)
 &rst
  ixpk= 1627, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 954, 955,
 igr2= 951, 952,
 &end
#
#    0 AMB  20-2:1628     0 AMB  20-1:1628   2.60    (#   1628:20  Double Ambig)
 &rst
  ixpk= 1628, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2301,2302,2253,2254,2255,2257,2258,2259, 954, 955,
      
 igr2=2304,2305,2304,2305, 951, 952,
 &end
#
#   62 ARG  HG+          62 ARG  HB+         2.60    (#   1629:20  Unique         2.33, 2.72 A)
 &rst
  ixpk= 1629, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 954, 955,
 igr2= 951, 952,
 &end
#
#    0 AMB  20-2:1630     0 AMB  20-1:1630   2.60    (#   1630:20  Double Ambig)
 &rst
  ixpk= 1630, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2298,2299, 954, 955,
 igr2=2304,2305, 951, 952,
 &end
#
#    0 AMB  20-2:1631     0 AMB  20-1:1631   2.60    (#   1631:20  Double Ambig)
 &rst
  ixpk= 1631, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 957, 958, 769, 770,
 igr2= 951, 952, 951, 952,
 &end
#
#    0 AMB  20-2:1632    62 ARG  HB-         2.60    (#   1632:20  Single Ambig)
 &rst
  ixpk= 1632, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 957, 958, 769, 770,
 igr2= 951, 952,
 &end
#
#  140 LYS  HE-         140 LYS  HD+         5.50    (#   1633:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 1633, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2307,2308,
 igr2=2304,2305,
 &end
#
#    0 AMB  20-2:1634     0 AMB  20-1:1634   5.50    (#   1634:20  Double Ambig)
 &rst
  ixpk= 1634, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=2307,2308, 769, 770,
 igr2=2304,2305, 951, 952,
 &end
#
#   62 ARG  HA           62 ARG  HB-         3.50    (#   1635:20  Unique         2.34, 2.45 A)
 &rst
  ixpk= 1635, nxpk= 20, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#   62 ARG  HA           62 ARG  HB+         2.60    (#   1636:20  Unique         2.34, 2.45 A)
 &rst
  ixpk= 1636, nxpk= 20, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 951, 952,
 &end
#
#   51 TYR  HE           62 ARG  HB+         5.50    (#   1639:20  Unique         1.94, 4.38 A)
 &rst
  ixpk= 1639, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 775, 780,
 igr2= 951, 952,
 &end
#
#   51 TYR  HE           62 ARG  HB-         5.50    (#   1640:20  Unique         1.94, 4.38 A)
 &rst
  ixpk= 1640, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 775, 780,
 igr2= 951, 952,
 &end
#
#   63 LYS  HN           62 ARG  HB+         3.50    (#   1641:20  Unique         3.49, 3.82 A)
 &rst
  ixpk= 1641, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#    0 AMB  20-2:1642     0 AMB  20-1:1642   3.50    (#   1642:20  Double Ambig)
 &rst
  ixpk= 1642, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2247, 971,
 igr2=2304,2305, 951, 952,
 &end
#
#   62 ARG  HN           62 ARG  HB+         3.50    (#   1643:20  Unique         2.53, 3.15 A)
 &rst
  ixpk= 1643, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#   62 ARG  HN           62 ARG  HB-         3.50    (#   1644:20  Unique         2.53, 3.15 A)
 &rst
  ixpk= 1644, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#   62 ARG  HB+          62 ARG  HG+         2.60    (#   1645:20  Unique         2.33, 2.72 A)
 &rst
  ixpk= 1645, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 951, 952,
 igr2= 954, 955,
 &end
#
#   62 ARG  HB+          62 ARG  HG-         2.60    (#   1646:20  Unique         2.33, 2.72 A)
 &rst
  ixpk= 1646, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 951, 952,
 igr2= 954, 955,
 &end
#
#   62 ARG  HD+          62 ARG  HG+         2.60    (#   1647:20  Unique         2.22, 2.61 A)
 &rst
  ixpk= 1647, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 957, 958,
 igr2= 954, 955,
 &end
#
#   62 ARG  HD+          62 ARG  HG-         2.60    (#   1648:20  Unique         2.22, 2.61 A)
 &rst
  ixpk= 1648, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 957, 958,
 igr2= 954, 955,
 &end
#
#   62 ARG  HA           62 ARG  HG+         4.40    (#   1649:20  Unique         3.70, 3.74 A)
 &rst
  ixpk= 1649, nxpk= 20, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 954, 955,
 &end
#
#   62 ARG  HA           62 ARG  HG-         3.50    (#   1650:20  Unique         3.70, 3.74 A)
 &rst
  ixpk= 1650, nxpk= 20, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 954, 955,
 &end
#
#   51 TYR  HE           62 ARG  HG+         5.50    (#   1653:20  Unique         4.38, 6.61 A)
 &rst
  ixpk= 1653, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 775, 780,
 igr2= 954, 955,
 &end
#
#   51 TYR  HE           62 ARG  HG-         4.40    (#   1654:20  Unique         4.38, 6.61 A)
 &rst
  ixpk= 1654, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 775, 780,
 igr2= 954, 955,
 &end
#
#   63 LYS  HN           62 ARG  HG-         5.50    (#   1655:20  Unique         1.94, 2.52 A)
 &rst
  ixpk= 1655, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 954, 955,
 &end
#
#    0 AMB  20-2:1656     0 AMB  20-1:1656   5.50    (#   1656:20  Double Ambig)
 &rst
  ixpk= 1656, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 844, 721,
 igr2= 954, 955, 954, 955,
 &end
#
#   62 ARG  HN           62 ARG  HG-         4.40    (#   1657:20  Unique         1.91, 2.42 A)
 &rst
  ixpk= 1657, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 954, 955,
 &end
#
#   62 ARG  HN           62 ARG  HG+         3.50    (#   1658:20  Unique         1.91, 2.42 A)
 &rst
  ixpk= 1658, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 954, 955,
 &end
#
#   62 ARG  HN           62 ARG  HD+         4.40    (#   1659:20  Unique         4.02, 4.37 A)
 &rst
  ixpk= 1659, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 957, 958,
 &end
#
#   63 LYS  HN           62 ARG  HD+         5.50    (#   1660:20  Unique         4.13, 4.57 A)
 &rst
  ixpk= 1660, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 957, 958,
 &end
#
#   51 TYR  HD           62 ARG  HD+         5.50    (#   1661:20  Unique         2.77, 6.19 A)
 &rst
  ixpk= 1661, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782,
 igr2= 957, 958,
 &end
#
#   62 ARG  HE           62 ARG  HD+         2.60    (#   1663:20  Unique         2.28, 2.68 A)
 &rst
  ixpk= 1663, nxpk= 20, iat= 960,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 957, 958,
 &end
#
#   51 TYR  HE           62 ARG  HD+         3.50    (#   1664:20  Unique         2.81, 6.47 A)
 &rst
  ixpk= 1664, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 775, 780,
 igr2= 957, 958,
 &end
#
#   62 ARG  HA           62 ARG  HD+         4.40    (#   1665:20  Unique         4.53, 5.11 A)
 &rst
  ixpk= 1665, nxpk= 20, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 957, 958,
 &end
#
#   62 ARG  HB+          62 ARG  HD+         2.60    (#   1666:20  Unique         2.17, 3.17 A)
 &rst
  ixpk= 1666, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 951, 952,
 igr2= 957, 958,
 &end
#
#   62 ARG  HG+          62 ARG  HD+         2.60    (#   1667:20  Unique         2.22, 2.61 A)
 &rst
  ixpk= 1667, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 954, 955,
 igr2= 957, 958,
 &end
#
#   62 ARG  HG-          62 ARG  HD+         2.60    (#   1669:20  Unique         2.22, 2.61 A)
 &rst
  ixpk= 1669, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 954, 955,
 igr2= 957, 958,
 &end
#
#    0 AMB  20-2:1670    63 LYS  HA          4.40    (#   1670:20  Single Ambig)
 &rst
  ixpk= 1670, nxpk= 20, iat=  -1, 973, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 954, 955,1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:1671     0 AMB  20-1:1671   4.40    (#   1671:20  Double Ambig)
 &rst
  ixpk= 1671, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.14, r4= 8.89,
 igr1=1745,1746,1747,1749,1750,1751, 224, 225, 185, 186,
       187, 227, 228, 229, 834, 835, 836, 838, 839, 840,
      
 igr2= 973, 341,
 &end
#
#    0 AMB  20-2:1672     0 AMB  20-1:1672   3.50    (#   1672:20  Double Ambig)
 &rst
  ixpk= 1672, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1= 978, 979, 978, 979, 350, 351, 352,
 igr2= 973, 341,
 &end
#
#    0 AMB  20-2:1673    63 LYS  HA          4.40    (#   1673:20  Single Ambig)
 &rst
  ixpk= 1673, nxpk= 20, iat=  -1, 973, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 951, 952, 951, 952, 921, 922,
 &end
#
#    0 AMB  20-2:1674     0 AMB  20-1:1674   2.97    (#   1674:20  Double Ambig)
 &rst
  ixpk= 1674, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 981, 982, 224, 225,
 igr2= 973, 341,
 &end
#
#    0 AMB  20-2:1675    63 LYS  HA          2.60    (#   1675:20  Single Ambig)
 &rst
  ixpk= 1675, nxpk= 20, iat=  -1, 973, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 975, 976, 975, 976,
 &end
#
#   63 LYS  HN           63 LYS  HA          3.50    (#   1676:20  Unique         2.83, 2.87 A)
 &rst
  ixpk= 1676, nxpk= 20, iat= 971, 973, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   24 TRP  HN           23 MET  HA          4.40    (#   1677:20  Unique         2.14, 2.22 A)
 &rst
  ixpk= 1677, nxpk= 20, iat= 356, 341, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   22 VAL  HN           21 GLN  HB+         5.50    (#   1678:20  Unique         1.93, 3.05 A)
 &rst
  ixpk= 1678, nxpk= 20, iat= 323,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 310, 311,
 &end
#
#   22 VAL  HN           21 GLN  HB+         4.40    (#   1679:20  Unique         1.93, 3.05 A)
 &rst
  ixpk= 1679, nxpk= 20, iat= 323,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 310, 311,
 &end
#
#   63 LYS  HN           63 LYS  HB-         2.60    (#   1680:20  Unique         2.38, 3.05 A)
 &rst
  ixpk= 1680, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 975, 976,
 &end
#
#   63 LYS  HN           63 LYS  HB+         2.60    (#   1681:20  Unique         2.38, 3.05 A)
 &rst
  ixpk= 1681, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 975, 976,
 &end
#
#   63 LYS  HA           63 LYS  HB+         2.60    (#   1682:20  Unique         2.34, 2.45 A)
 &rst
  ixpk= 1682, nxpk= 20, iat= 973,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 975, 976,
 &end
#
#   63 LYS  HA           63 LYS  HB-         2.60    (#   1683:20  Unique         2.34, 2.45 A)
 &rst
  ixpk= 1683, nxpk= 20, iat= 973,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 975, 976,
 &end
#
#    0 AMB  20-2:1684     0 AMB  20-1:1684   2.60    (#   1684:20  Double Ambig)
 &rst
  ixpk= 1684, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 978, 979, 978, 979, 978, 979,
 igr2= 975, 976, 975, 976, 975, 976,
 &end
#
#    0 AMB  20-2:1685    63 LYS  HB-         2.60    (#   1685:20  Single Ambig)
 &rst
  ixpk= 1685, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 978, 979, 978, 979,
 igr2= 975, 976,
 &end
#
#   63 LYS  HN           63 LYS  HG+         2.60    (#   1686:20  Unique         2.21, 2.84 A)
 &rst
  ixpk= 1686, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2= 978, 979,
 &end
#
#   63 LYS  HN           63 LYS  HG-         3.50    (#   1687:20  Unique         2.21, 2.84 A)
 &rst
  ixpk= 1687, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 978, 979,
 &end
#
#   63 LYS  HA           63 LYS  HG+         3.50    (#   1690:20  Unique         3.59, 3.92 A)
 &rst
  ixpk= 1690, nxpk= 20, iat= 973,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 978, 979,
 &end
#
#   63 LYS  HA            0 AMB  20-1:1691   4.40    (#   1691:20  Single Ambig)
 &rst
  ixpk= 1691, nxpk= 20, iat= 973,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr2= 978, 979, 978, 979,
 &end
#
#   61 SER  HB-           0 AMB  20-1:1693   4.40    (#   1693:20  Single Ambig)
 &rst
  ixpk= 1693, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 940, 941,
 igr2= 978, 979, 978, 979,
 &end
#
#    0 AMB  20-2:1694     0 AMB  20-1:1694   2.60    (#   1694:20  Double Ambig)
 &rst
  ixpk= 1694, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 984, 985, 984, 985,
 igr2= 978, 979, 978, 979,
 &end
#
#   63 LYS  HE+          63 LYS  HG-         2.60    (#   1695:20  Unique         2.02, 3.10 A)
 &rst
  ixpk= 1695, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 984, 985,
 igr2= 978, 979,
 &end
#
#    0 AMB  20-2:1696     0 AMB  20-1:1696   2.60    (#   1696:20  Double Ambigcnoe_amber.rst)
 &rst
  ixpk= 1696, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 975, 976, 975, 976, 975, 976,
 igr2= 978, 979, 978, 979, 978, 979,
 &end
#
#    0 AMB  20-2:1697    63 LYS  HG-         2.60    (#   1697:20  Single Ambig)
 &rst
  ixpk= 1697, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1= 975, 976, 975, 976,
 igr2= 978, 979,
 &end
#
#   63 LYS  HD+          63 LYS  HG+         2.60    (#   1698:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 1698, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 981, 982,
 igr2= 978, 979,
 &end
#
#   63 LYS  HD+          63 LYS  HG-         2.60    (#   1699:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 1699, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 981, 982,
 igr2= 978, 979,
 &end
#
#    0 AMB  20-2:1700     0 AMB  20-1:1700   2.60    (#   1700:20  Double Ambig)
 &rst
  ixpk= 1700, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 978, 979, 978, 979,
 igr2= 981, 982, 981, 982,
 &end
#
#   63 LYS  HB-          63 LYS  HD+         2.60    (#   1701:20  Unique         2.00, 3.23 A)
 &rst
  ixpk= 1701, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 975, 976,
 igr2= 981, 982,
 &end
#
#   63 LYS  HE+          63 LYS  HD+         2.60    (#   1702:20  Unique         2.26, 2.67 A)
 &rst
  ixpk= 1702, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 984, 985,
 igr2= 981, 982,
 &end
#
#   63 LYS  HA           63 LYS  HD+         5.50    (#   1703:20  Unique         3.72, 4.21 A)
 &rst
  ixpk= 1703, nxpk= 20, iat= 973,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 981, 982,
 &end
#
#   63 LYS  HN           63 LYS  HD+         4.40    (#   1704:20  Unique         4.23, 4.53 A)
 &rst
  ixpk= 1704, nxpk= 20, iat= 971,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 981, 982,
 &end
#
#    0 AMB  20-2:1705     0 AMB  20-1:1705   4.40    (#   1705:20  Double Ambig)
 &rst
  ixpk= 1705, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1=2470,1490,1506,1380,
 igr2=2483,2484,1467,1468,1467,1468,1467,1468,
 &end
#
#    0 AMB  20-2:1706     0 AMB  20-1:1706   4.40    (#   1706:20  Double Ambig)
 &rst
  ixpk= 1706, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2294,2274,
 igr2=2307,2308,2307,2308,
 &end
#
#    0 AMB  20-2:1707     0 AMB  20-1:1707   4.40    (#   1707:20  Double Ambig)
 &rst
  ixpk= 1707, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2316,1755, 294, 295,
 igr2=2307,2308, 984, 985,2714,2715,
 &end
#
#    7 TYR  HD           78 LYS  HE+         4.40    (#   1708:20  Unique         4.21, 8.63 A)
 &rst
  ixpk= 1708, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=  91, 100,
 igr2=1257,1258,
 &end
#
#    0 AMB  20-2:1709     0 AMB  20-1:1709   3.55    (#   1709:20  Double Ambig)
 &rst
  ixpk= 1709, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.02, r4= 5.77,
 igr1=2697,2472,
 igr2=2714,2715,2483,2484,
 &end
#
#    0 AMB  20-2:1710     0 AMB  20-1:1710   2.60    (#   1710:20  Double Ambig)
 &rst
  ixpk= 1710, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.95, r4= 6.70,
 igr1= 790, 791,2480,2481,1254,1255,1309,1310,1248,1249,
       975, 976,
 igr2= 796, 797,2483,2484,1257,1258,1312,1313,1257,1258,
       984, 985,
 &end
#
#    0 AMB  20-2:1712     0 AMB  20-1:1712   2.60    (#   1712:20  Double Ambig)
 &rst
  ixpk= 1712, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 978, 979,1461,1462,
 igr2= 984, 985,1467,1468,
 &end
#
#  140 LYS  HG+         140 LYS  HE+         2.60    (#   1713:20  Unique         1.95, 3.27 A)
 &rst
  ixpk= 1713, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2301,2302,
 igr2=2307,2308,
 &end
#
#   61 SER  HN           64 ASP  HB+         4.40    (#   1714:20  Unique         2.07, 3.01 A)
 &rst
  ixpk= 1714, nxpk= 20, iat= 936,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 997, 998,
 &end
#
#   64 ASP  HN           64 ASP  HB+         3.50    (#   1715:20  Unique         2.24, 2.97 A)
 &rst
  ixpk= 1715, nxpk= 20, iat= 993,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 997, 998,
 &end
#
#  104 LEU  MDX          64 ASP  HB+         4.40    (#   1716:20  Unique         2.85, 5.80 A)
 &rst
  ixpk= 1716, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2= 997, 998,
 &end
#
#    0 AMB  20-2:1717     0 AMB  20-1:1717   3.50    (#   1717:20  Double Ambig)
 &rst
  ixpk= 1717, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1011,1012,1013,1015,1016,1017,1745,1746,1747,1749,
      1750,1751,
 igr2= 997, 998, 997, 998,
 &end
#
#    0 AMB  20-2:1718     0 AMB  20-1:1718   3.50    (#   1718:20  Double Ambig)
 &rst
  ixpk= 1718, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2= 997, 998, 997, 998,
 &end
#
#  105 VAL  HN           65 VAL  HA          3.50    (#   1719:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 1719, nxpk= 20, iat=1739,1007, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   66 ARG  HN           65 VAL  HA          2.60    (#   1720:20  Unique         2.17, 2.27 A)
 &rst
  ixpk= 1720, nxpk= 20, iat=1021,1007, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   65 VAL  HN           65 VAL  HA          4.40    (#   1721:20  Unique         2.90, 2.91 A)
 &rst
  ixpk= 1721, nxpk= 20, iat=1005,1007, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  104 LEU  HA           65 VAL  HA          3.50    (#   1722:20  Unique         2.66, 2.97 A)
 &rst
  ixpk= 1722, nxpk= 20, iat=1722,1007, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   65 VAL  HB           65 VAL  HA          2.60    (#   1723:20  Unique         2.48, 2.63 A)
 &rst
  ixpk= 1723, nxpk= 20, iat=1009,1007, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   66 ARG  HB+          65 VAL  HA          4.40    (#   1724:20  Unique         4.12, 4.90 A)
 &rst
  ixpk= 1724, nxpk= 20, iat=  -1,1007, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1025,1026,
 &end
#
#    0 AMB  20-2:1725    65 VAL  HA          5.50    (#   1725:20  Single Ambig)
 &rst
  ixpk= 1725, nxpk= 20, iat=  -1,1007, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1028,1029,1727, 921, 922, 924,
 &end
#
#  102 LEU  HB-          65 VAL  HA          5.50    (#   1726:20  Unique         3.77, 4.88 A)
 &rst
  ixpk= 1726, nxpk= 20, iat=  -1,1007, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1688,1689,
 &end
#
#    0 AMB  20-2:1727    65 VAL  HA          2.60    (#   1727:20  Single Ambig)
 &rst
  ixpk= 1727, nxpk= 20, iat=  -1,1007, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1011,1012,1013,1015,1016,1017,1011,1012,1013,1015,
      1016,1017,1745,1746,1747,1749,1750,1751,
 &end
#
#  105 VAL  MGX          65 VAL  HA          2.60    (#   1728:20  Unique         2.01, 4.50 A)
 &rst
  ixpk= 1728, nxpk= 20, iat=  -1,1007, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:1729    65 VAL  HB          2.60    (#   1729:20  Single Ambig)
 &rst
  ixpk= 1729, nxpk= 20, iat=  -1,1009, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1011,1012,1013,1015,1016,1017,1011,1012,1013,1015,
      1016,1017,
 &end
#
#    0 AMB  20-2:1730    65 VAL  HB          3.50    (#   1730:20  Single Ambig)
 &rst
  ixpk= 1730, nxpk= 20, iat=  -1,1009, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1= 834, 835, 836, 838, 839, 840, 834, 835, 836, 838,
       839, 840, 227, 228, 229,1745,1746,1747,1749,1750,
      1751,
 &end
#
#  102 LEU  HB-          65 VAL  HB          4.40    (#   1731:20  Unique         3.05, 4.90 A)
 &rst
  ixpk= 1731, nxpk= 20, iat=  -1,1009, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1688,1689,
 &end
#
#    0 AMB  20-2:1732     0 AMB  20-1:1732   3.50    (#   1732:20  Double Ambig)
 &rst
  ixpk= 1732, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1688,1689, 752, 753, 755, 756, 224, 225,
 igr2=1009, 713, 714,
 &end
#
#   65 VAL  HA           65 VAL  HB          3.50    (#   1735:20  Unique         2.48, 2.63 A)
 &rst
  ixpk= 1735, nxpk= 20, iat=1007,1009, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   66 ARG  HN           65 VAL  HB          3.50    (#   1736:20  Unique         3.27, 3.98 A)
 &rst
  ixpk= 1736, nxpk= 20, iat=1021,1009, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1737    65 VAL  MGX         3.50    (#   1737:20  Single Ambig)
 &rst
  ixpk= 1737, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 954, 955, 978, 979, 752, 753,1820,1821,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:1738    65 VAL  MGX         4.40    (#   1738:20  Single Ambig)
 &rst
  ixpk= 1738, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1703,1045,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:1739     0 AMB  20-1:1739   4.40    (#   1739:20  Double Ambig)
 &rst
  ixpk= 1739, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=1703,1045,
 igr2=1011,1012,1013,1015,1016,1017,1745,1746,1747,1749,
      1750,1751,
 &end
#
#  105 VAL  HN          105 VAL  MGY         2.60    (#   1740:20  Unique         1.95, 3.67 A)
 &rst
  ixpk= 1740, nxpk= 20, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:1741     0 AMB  20-1:1741   5.50    (#   1741:20  Double Ambig)
 &rst
  ixpk= 1741, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.70, r4=10.45,
 igr1=1720, 864,
 igr2=1011,1012,1013,1015,1016,1017,1883,1884,1885,1745,
      1746,1747,1749,1750,1751,
 &end
#
#   66 ARG  HN            0 AMB  20-1:1742   3.50    (#   1742:20  Single Ambig)
 &rst
  ixpk= 1742, nxpk= 20, iat=1021,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr2=1011,1012,1013,1015,1016,1017,1745,1746,1747,1749,
      1750,1751,
 &end
#
#  114 GLN  HN          115 THR  MG2         3.50    (#   1743:20  Unique         4.25, 5.58 A)
 &rst
  ixpk= 1743, nxpk= 20, iat=1860,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1883,1884,1885,
 &end
#
#  116 SER  HN          115 THR  MG2         4.40    (#   1744:20  Unique         4.16, 4.70 A)
 &rst
  ixpk= 1744, nxpk= 20, iat=1891,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1883,1884,1885,
 &end
#
#    0 AMB  20-2:1745     0 AMB  20-1:1745   2.60    (#   1745:20  Double Ambig)
 &rst
  ixpk= 1745, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1877, 993,
 igr2=1883,1884,1885,1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:1746     0 AMB  20-1:1746   2.60    (#   1746:20  Double Ambig)
 &rst
  ixpk= 1746, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.90, r4= 5.65,
 igr1=1838,1839,1005,
 igr2=1883,1884,1885,1011,1012,1013,1015,1016,1017,1745,
      1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:1747     0 AMB  20-1:1747   3.50    (#   1747:20  Double Ambig)
 &rst
  ixpk= 1747, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1755, 854, 858,
 igr2=1745,1746,1747,1749,1750,1751,1883,1884,1885,
 &end
#
#    0 AMB  20-2:1748     0 AMB  20-1:1748   3.50    (#   1748:20  Double Ambig)
 &rst
  ixpk= 1748, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1034, 852, 860,
 igr2=1745,1746,1747,1749,1750,1751,1883,1884,1885,
 &end
#
#  112 ASN  HD2-        115 THR  MG2         3.50    (#   1749:20  Unique         2.13, 4.30 A)
 &rst
  ixpk= 1749, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1838,1839,
 igr2=1883,1884,1885,
 &end
#
#    0 AMB  20-2:1750     0 AMB  20-1:1750   5.50    (#   1750:20  Double Ambig)
 &rst
  ixpk= 1750, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.29, r4=12.04,
 igr1=1872,1873,1715,1716, 960,
 igr2=1883,1884,1885,1745,1746,1747,1749,1750,1751,1011,
      1012,1013,1015,1016,1017,
 &end
#
#   65 VAL  HA            0 AMB  20-1:1751   2.60    (#   1751:20  Single Ambig)
 &rst
  ixpk= 1751, nxpk= 20, iat=1007,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1011,1012,1013,1015,1016,1017,1745,1746,1747,1749,
      1750,1751,
 &end
#
#  105 VAL  HA          105 VAL  MGY         2.60    (#   1753:20  Unique         2.26, 3.31 A)
 &rst
  ixpk= 1753, nxpk= 20, iat=1741,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#   59 GLY  HA-         115 THR  MG2         3.50    (#   1754:20  Unique         4.39, 5.83 A)
 &rst
  ixpk= 1754, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 912, 913,
 igr2=1883,1884,1885,
 &end
#
#   66 ARG  HD+         105 VAL  MGY         3.50    (#   1755:20  Unique         2.00, 4.95 A)
 &rst
  ixpk= 1755, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1031,1032,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:1756     0 AMB  20-1:1756   3.50    (#   1756:20  Double Ambig)
 &rst
  ixpk= 1756, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 997, 998, 997, 998,
 igr2=1011,1012,1013,1015,1016,1017,1745,1746,1747,1749,
      1750,1751,
 &end
#
#    0 AMB  20-2:1757     0 AMB  20-1:1757   3.50    (#   1757:20  Double Ambig)
 &rst
  ixpk= 1757, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1833,1834, 769, 770,
 igr2=1883,1884,1885,1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:1758     0 AMB  20-1:1758   3.50    (#   1758:20  Double Ambig55)
 &rst
  ixpk= 1758, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.77, r4= 8.52,
 igr1=1710,1711, 868, 869, 829, 830,1710,1711,
 igr2=1745,1746,1747,1749,1750,1751,1883,1884,1885,1011,
      1012,1013,1015,1016,1017,
 &end
#
#  105 VAL  HB          105 VAL  MGY         2.60    (#   1759:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1759, nxpk= 20, iat=1743,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#  102 LEU  HG           65 VAL  MGY         4.40    (#   1760:20  Unique         3.04, 4.80 A)
 &rst
  ixpk= 1760, nxpk= 20, iat=1691,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#   66 ARG  HB+         105 VAL  MGY         3.50    (#   1761:20  Unique         2.68, 5.86 A)
 &rst
  ixpk= 1761, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1025,1026,
 igr2=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:1762     0 AMB  20-1:1762   3.50    (#   1762:20  Double Ambig)
 &rst
  ixpk= 1762, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.77, r4= 8.52,
 igr1= 978, 979, 954, 955, 752, 753,1820,1821,1068,1069,
      
 igr2=1745,1746,1747,1749,1750,1751,1011,1012,1013,1015,
      1016,1017,
 &end
#
#    0 AMB  20-2:1763    65 VAL  MGY         2.60    (#   1763:20  Single Ambig)
 &rst
  ixpk= 1763, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:1766    66 ARG  HA          2.60    (#   1766:20  Single Ambig)
 &rst
  ixpk= 1766, nxpk= 20, iat=  -1,1023, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1025,1026,1055,1056,
 &end
#
#   66 ARG  HN           66 ARG  HA          4.40    (#   1767:20  Unique         2.92, 2.93 A)
 &rst
  ixpk= 1767, nxpk= 20, iat=1021,1023, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:1769     0 AMB  20-1:1769   3.50    (#   1769:20  Double Ambig)
 &rst
  ixpk= 1769, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1745,1746,1747,1749,1750,1751,1073,1074,1075,1077,
      1078,1079,
 igr2=1025,1026,1025,1026,
 &end
#
#  105 VAL  MGY          66 ARG  HB+         3.50    (#   1770:20  Unique         2.68, 5.86 A)
 &rst
  ixpk= 1770, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1745,1746,1747,1749,1750,1751,
 igr2=1025,1026,
 &end
#
#    0 AMB  20-2:1771     0 AMB  20-1:1771   2.60    (#   1771:20  Double Ambig)
 &rst
  ixpk= 1771, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2708,2709,1028,1029,
 igr2=2705,2706,1025,1026,
 &end
#
#   66 ARG  HD+          66 ARG  HB+         3.50    (#   1772:20  Unique         2.24, 3.42 A)
 &rst
  ixpk= 1772, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1031,1032,
 igr2=1025,1026,
 &end
#
#   89 LYS  HA           89 LYS  HB+         2.60    (#   1773:20  Unique         2.27, 2.48 A)
 &rst
  ixpk= 1773, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1458,1459,
 &end
#
#   66 ARG  HA           66 ARG  HB+         3.50    (#   1774:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 1774, nxpk= 20, iat=1023,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1025,1026,
 &end
#
#   89 LYS  HN           89 LYS  HB+         3.50    (#   1775:20  Unique         2.13, 2.79 A)
 &rst
  ixpk= 1775, nxpk= 20, iat=1454,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1458,1459,
 &end
#
#   66 ARG  HN           66 ARG  HB+         4.40    (#   1776:20  Unique         2.98, 3.49 A)
 &rst
  ixpk= 1776, nxpk= 20, iat=1021,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1025,1026,
 &end
#
#   67 ILE  HN           66 ARG  HB+         3.50    (#   1777:20  Unique         2.88, 3.61 A)
 &rst
  ixpk= 1777, nxpk= 20, iat=1045,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1025,1026,
 &end
#
#    0 AMB  20-2:1778     0 AMB  20-1:1778   3.50    (#   1778:20  Double Ambig)
 &rst
  ixpk= 1778, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1703,1045,
 igr2=1028,1029,1028,1029,
 &end
#
#   83 LEU  HN           82 ARG  HG-         4.40    (#   1779:20  Unique         2.20, 3.20 A)
 &rst
  ixpk= 1779, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1328,1329,
 &end
#
#   66 ARG  HE           66 ARG  HG+         5.50    (#   1780:20  Unique         2.68, 3.55 A)
 &rst
  ixpk= 1780, nxpk= 20, iat=1034,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1028,1029,
 &end
#
#   66 ARG  HA           66 ARG  HG-         3.50    (#   1781:20  Unique         3.54, 3.89 A)
 &rst
  ixpk= 1781, nxpk= 20, iat=1023,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1028,1029,
 &end
#
#   66 ARG  HA           66 ARG  HG+         3.50    (#   1782:20  Unique         3.54, 3.89 A)
 &rst
  ixpk= 1782, nxpk= 20, iat=1023,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1028,1029,
 &end
#
#    0 AMB  20-2:1783     0 AMB  20-1:1783   3.50    (#   1783:20  Double Ambig)
 &rst
  ixpk= 1783, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1347,1066,1295,
 igr2=1328,1329,1028,1029,
 &end
#
#   82 ARG  HA           82 ARG  HG-         3.50    (#   1784:20  Unique         3.58, 3.73 A)
 &rst
  ixpk= 1784, nxpk= 20, iat=1323,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1328,1329,
 &end
#
#   66 ARG  HD+          66 ARG  HG+         2.60    (#   1785:20  Unique         2.22, 2.65 A)
 &rst
  ixpk= 1785, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1031,1032,
 igr2=1028,1029,
 &end
#
#    0 AMB  20-2:1787     0 AMB  20-1:1787   2.60    (#   1787:20  Double Ambig)
 &rst
  ixpk= 1787, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=1073,1074,1075,1077,1078,1079,2617,2618,2619,2621,
      2622,2623,
 igr2=1028,1029, 265, 266,
 &end
#
#    0 AMB  20-2:1788    82 ARG  HG-         2.60    (#   1788:20  Single Ambig)
 &rst
  ixpk= 1788, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1328,1329,
 &end
#
#    0 AMB  20-2:1789     0 AMB  20-1:1789   2.60    (#   1789:20  Double Ambig)
 &rst
  ixpk= 1789, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=1073,1074,1075,1077,1078,1079,1745,1746,1747,1749,
      1750,1751,
 igr2=1031,1032,1031,1032,
 &end
#
#  105 VAL  MGY          66 ARG  HD+         2.60    (#   1790:20  Unique         2.00, 4.95 A)
 &rst
  ixpk= 1790, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1745,1746,1747,1749,1750,1751,
 igr2=1031,1032,
 &end
#
#  133 VAL  MGX           0 AMB  20-1:1791   3.50    (#   1791:20  Single Ambig)
 &rst
  ixpk= 1791, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2180,2181,2182,2184,2185,2186,
 igr2=2326,2327,2200,2201,
 &end
#
#    0 AMB  20-2:1792     0 AMB  20-1:1792   2.60    (#   1792:20  Double Ambig)
 &rst
  ixpk= 1792, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2194,2195,1025,1026,
 igr2=2200,2201,1031,1032,
 &end
#
#   66 ARG  HG-          66 ARG  HD+         2.60    (#   1793:20  Unique         2.22, 2.65 A)
 &rst
  ixpk= 1793, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1028,1029,
 igr2=1031,1032,
 &end
#
#    0 AMB  20-2:1794     0 AMB  20-1:1794   2.60    (#   1794:20  Double Ambig)
 &rst
  ixpk= 1794, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2323,2324,2197,2198,
 igr2=2326,2327,2200,2201,
 &end
#
#    0 AMB  20-2:1795     0 AMB  20-1:1795   4.40    (#   1795:20  Double Ambig)
 &rst
  ixpk= 1795, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2307,2308,2143,2144,2143,2144,
 igr2=2326,2327,2200,2201,2200,2201,
 &end
#
#  134 ARG  HA            0 AMB  20-1:1796   2.60    (#   1796:20  Single Ambig)
 &rst
  ixpk= 1796, nxpk= 20, iat=2192,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr2=2200,2201,2326,2327,
 &end
#
#   66 ARG  HA           66 ARG  HD+         4.40    (#   1797:20  Unique         3.76, 4.32 A)
 &rst
  ixpk= 1797, nxpk= 20, iat=1023,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1031,1032,
 &end
#
#    0 AMB  20-2:1798     0 AMB  20-1:1798   2.60    (#   1798:20  Double Ambig)
 &rst
  ixpk= 1798, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.20, r4= 5.95,
 igr1=2226,2227, 294, 295,1040,1041,1040,1041,
 igr2=2200,2201, 268, 269,1031,1032, 268, 269,
 &end
#
#   66 ARG  HE           66 ARG  HD+         2.60    (#   1799:20  Unique         2.27, 2.57 A)
 &rst
  ixpk= 1799, nxpk= 20, iat=1034,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1031,1032,
 &end
#
#   66 ARG  HN           66 ARG  HD+         4.40    (#   1800:20  Unique         1.90, 2.53 A)
 &rst
  ixpk= 1800, nxpk= 20, iat=1021,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1031,1032,
 &end
#
#  103 GLN  HN           66 ARG  HD+         3.50    (#   1801:20  Unique         2.45, 3.33 A)
 &rst
  ixpk= 1801, nxpk= 20, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1031,1032,
 &end
#
#   67 ILE  HB           67 ILE  HA          5.50    (#   1802:20  Unique         3.01, 3.02 A)
 &rst
  ixpk= 1802, nxpk= 20, iat=1049,1047, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:1803    67 ILE  HA          2.60    (#   1803:20  Single Ambig)
 &rst
  ixpk= 1803, nxpk= 20, iat=  -1,1047, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1688,1689,1055,1056,
 &end
#
#    0 AMB  20-2:1805    67 ILE  HB          2.60    (#   1805:20  Single Ambig)
 &rst
  ixpk= 1805, nxpk= 20, iat=  -1,1049, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1055,1056,1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:1806    67 ILE  HB          2.60    (#   1806:20  Single Ambig)
 &rst
  ixpk= 1806, nxpk= 20, iat=  -1,1049, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1=1058,1059,1060,1693,1694,1695,1697,1698,1699,
 &end
#
#   67 ILE  QG2          67 ILE  HB          2.60    (#   1807:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1807, nxpk= 20, iat=  -1,1049, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1051,1052,1053,
 &end
#
#   67 ILE  HG1-         67 ILE  HB          3.50    (#   1808:20  Unique         2.41, 2.74 A)
 &rst
  ixpk= 1808, nxpk= 20, iat=  -1,1049, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1055,1056,
 &end
#
#   67 ILE  HA           67 ILE  HB          5.50    (#   1809:20  Unique         3.01, 3.02 A)
 &rst
  ixpk= 1809, nxpk= 20, iat=1047,1049, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:1810    67 ILE  HB          5.50    (#   1810:20  Single Ambig)
 &rst
  ixpk= 1810, nxpk= 20, iat=  -1,1049, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1023,1647,
 &end
#
#   67 ILE  HN           67 ILE  HB          3.50    (#   1811:20  Unique         2.49, 2.57 A)
 &rst
  ixpk= 1811, nxpk= 20, iat=1045,1049, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   67 ILE  HN           67 ILE  HG1-        4.40    (#   1813:20  Unique         1.96, 2.75 A)
 &rst
  ixpk= 1813, nxpk= 20, iat=1045,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1055,1056,
 &end
#
#   82 ARG  HN           82 ARG  HG+         3.50    (#   1814:20  Unique         2.00, 2.31 A)
 &rst
  ixpk= 1814, nxpk= 20, iat=1321,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1328,1329,
 &end
#
#   73 ASN  HN           72 ARG  HG-         4.40    (#   1815:20  Unique         3.10, 4.58 A)
 &rst
  ixpk= 1815, nxpk= 20, iat=1142,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1125,1126,
 &end
#
#   27 ARG  HD+          27 ARG  HG-         4.40    (#   1816:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 1816, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 424, 425,
 igr2= 421, 422,
 &end
#
#    0 AMB  20-2:1818     0 AMB  20-1:1818   2.60    (#   1818:20  Double Ambig)
 &rst
  ixpk= 1818, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1693,1694,1695,1697,1698,1699,1058,1059,1060,
 igr2=1055,1056,1055,1056,
 &end
#
#   67 ILE  QG2          67 ILE  HG1+        4.40    (#   1819:20  Unique         2.36, 3.51 A)
 &rst
  ixpk= 1819, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1051,1052,1053,
 igr2=1055,1056,
 &end
#
#   67 ILE  HB           67 ILE  HG1+        4.40    (#   1821:20  Unique         2.41, 2.74 A)
 &rst
  ixpk= 1821, nxpk= 20, iat=1049,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1055,1056,
 &end
#
#   66 ARG  HA           67 ILE  HG1+        5.50    (#   1822:20  Unique         3.49, 4.19 A)
 &rst
  ixpk= 1822, nxpk= 20, iat=1023,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1055,1056,
 &end
#
#   67 ILE  HN           67 ILE  HG1+        5.50    (#   1823:20  Unique         1.96, 2.75 A)
 &rst
  ixpk= 1823, nxpk= 20, iat=1045,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1055,1056,
 &end
#
#   67 ILE  HN           67 ILE  QD1         3.50    (#   1824:20  Unique         3.88, 4.46 A)
 &rst
  ixpk= 1824, nxpk= 20, iat=1045,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1058,1059,1060,
 &end
#
#    0 AMB  20-2:1825    67 ILE  QD1         5.50    (#   1825:20  Single Ambig)
 &rst
  ixpk= 1825, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=1083, 172,1621,
 igr2=1058,1059,1060,
 &end
#
#  100 PHE  HD           67 ILE  QD1         3.50    (#   1826:20  Unique         1.99, 4.80 A)
 &rst
  ixpk= 1826, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1653,1661,
 igr2=1058,1059,1060,
 &end
#
#   51 TYR  HE           67 ILE  QD1         3.50    (#   1827:20  Unique         2.16, 5.18 A)
 &rst
  ixpk= 1827, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 775, 780,
 igr2=1058,1059,1060,
 &end
#
#    0 AMB  20-2:1829    67 ILE  QD1         4.40    (#   1829:20  Single Ambig)
 &rst
  ixpk= 1829, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1047, 767,
 igr2=1058,1059,1060,
 &end
#
#    0 AMB  20-2:1830    67 ILE  QD1         3.50    (#   1830:20  Single Ambig)
 &rst
  ixpk= 1830, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 713, 714, 710, 711,
 igr2=1058,1059,1060,
 &end
#
#    0 AMB  20-2:1831    67 ILE  QD1         2.60    (#   1831:20  Single Ambig)
 &rst
  ixpk= 1831, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1=1049, 710, 711,
 igr2=1058,1059,1060,
 &end
#
#   67 ILE  HG1-         67 ILE  QD1         2.60    (#   1832:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1832, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1055,1056,
 igr2=1058,1059,1060,
 &end
#
#   67 ILE  QG2          67 ILE  QD1         2.60    (#   1833:20  Unique         1.98, 3.59 A)
 &rst
  ixpk= 1833, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1=1051,1052,1053,
 igr2=1058,1059,1060,
 &end
#
#   50 MET  ME           67 ILE  QD1         2.60    (#   1834:20  Unique         1.99, 3.65 A)
 &rst
  ixpk= 1834, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1= 759, 760, 761,
 igr2=1058,1059,1060,
 &end
#
#    0 AMB  20-2:1835    67 ILE  QG2         2.60    (#   1835:20  Single Ambig)
 &rst
  ixpk= 1835, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1693,1694,1695,1697,1698,1699,1055,1056,
 igr2=1051,1052,1053,
 &end
#
#   50 MET  ME           67 ILE  QG2         4.40    (#   1836:20  Unique         3.91, 5.69 A)
 &rst
  ixpk= 1836, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1= 759, 760, 761,
 igr2=1051,1052,1053,
 &end
#
#    0 AMB  20-2:1837    67 ILE  QG2         2.60    (#   1837:20  Single Ambig)
 &rst
  ixpk= 1837, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,
 igr1=1058,1059,1060,1693,1694,1695,1697,1698,1699,
 igr2=1051,1052,1053,
 &end
#
#    0 AMB  20-2:1838    67 ILE  QG2         5.50    (#   1838:20  Single Ambig)
 &rst
  ixpk= 1838, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.64, r4= 9.39,
 igr1=1068,1069,1087,1088,1089,
 igr2=1051,1052,1053,
 &end
#
#   68 LEU  HB-          67 ILE  QG2         5.50    (#   1839:20  Unique         4.62, 6.17 A)
 &rst
  ixpk= 1839, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1068,1069,
 igr2=1051,1052,1053,
 &end
#
#    0 AMB  20-2:1840    67 ILE  QG2         2.60    (#   1840:20  Single Ambig)
 &rst
  ixpk= 1840, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1055,1056,1688,1689,
 igr2=1051,1052,1053,
 &end
#
#   67 ILE  HB           67 ILE  QG2         2.60    (#   1841:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1841, nxpk= 20, iat=1049,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1051,1052,1053,
 &end
#
#  100 PHE  HB+          67 ILE  QG2         4.40    (#   1842:20  Unique         2.82, 5.19 A)
 &rst
  ixpk= 1842, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1649,1650,
 igr2=1051,1052,1053,
 &end
#
#   67 ILE  HA           67 ILE  QG2         3.50    (#   1843:20  Unique         2.44, 3.07 A)
 &rst
  ixpk= 1843, nxpk= 20, iat=1047,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1051,1052,1053,
 &end
#
#   69 ALA  HA           67 ILE  QG2         4.40    (#   1844:20  Unique         3.52, 4.64 A)
 &rst
  ixpk= 1844, nxpk= 20, iat=1085,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1051,1052,1053,
 &end
#
#    0 AMB  20-2:1845    67 ILE  QG2         4.40    (#   1845:20  Single Ambig)
 &rst
  ixpk= 1845, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1647,1023,
 igr2=1051,1052,1053,
 &end
#
#  102 LEU  HA           67 ILE  QG2         4.40    (#   1846:20  Unique         3.91, 4.98 A)
 &rst
  ixpk= 1846, nxpk= 20, iat=1686,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1051,1052,1053,
 &end
#
#   51 TYR  HE           67 ILE  QG2         5.50    (#   1847:20  Unique         5.23, 8.00 A)
 &rst
  ixpk= 1847, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 775, 780,
 igr2=1051,1052,1053,
 &end
#
#  100 PHE  HD           67 ILE  QG2         2.60    (#   1848:20  Unique         1.99, 4.73 A)
 &rst
  ixpk= 1848, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1653,1661,
 igr2=1051,1052,1053,
 &end
#
#   69 ALA  HN           67 ILE  QG2         2.60    (#   1849:20  Unique         2.50, 3.57 A)
 &rst
  ixpk= 1849, nxpk= 20, iat=1083,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1051,1052,1053,
 &end
#
#  101 LEU  HN           67 ILE  QG2         4.40    (#   1850:20  Unique         3.10, 4.21 A)
 &rst
  ixpk= 1850, nxpk= 20, iat=1665,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1051,1052,1053,
 &end
#
#    0 AMB  20-2:1851    67 ILE  QG2         4.40    (#   1851:20  Single Ambig)
 &rst
  ixpk= 1851, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1045,1703,
 igr2=1051,1052,1053,
 &end
#
#   68 LEU  HN           67 ILE  QG2         3.50    (#   1852:20  Unique         2.33, 3.47 A)
 &rst
  ixpk= 1852, nxpk= 20, iat=1064,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1051,1052,1053,
 &end
#
#   20 GLY  HN           19 GLN  HA          3.50    (#   1853:20  Unique         3.19, 3.33 A)
 &rst
  ixpk= 1853, nxpk= 20, iat= 299, 284, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   19 GLN  HE2+         19 GLN  HA          5.50    (#   1854:20  Unique         2.77, 3.43 A)
 &rst
  ixpk= 1854, nxpk= 20, iat=  -1, 284, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 294, 295,
 &end
#
#   68 LEU  MDX          68 LEU  HA          5.50    (#   1855:20  Unique         2.21, 4.00 A)
 &rst
  ixpk= 1855, nxpk= 20, iat=  -1,1066, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1073,1074,1075,1077,1078,1079,
 &end
#
#  101 LEU  MDY          68 LEU  HA          5.50    (#   1856:20  Unique         4.66, 6.97 A)
 &rst
  ixpk= 1856, nxpk= 20, iat=  -1,1066, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:1857     0 AMB  20-1:1857   4.40    (#   1857:20  Double Ambig)
 &rst
  ixpk= 1857, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.60, r4=10.35,
 igr1=2443,2444,2445,2447,2448,2449,1823,1824,1825,
 igr2=1189,1190,1191,1193,1194,1195,1729,1730,1731,1733,
      1734,1735,
 &end
#
#    0 AMB  20-2:1858     0 AMB  20-1:1858   2.60    (#   1858:20  Double Ambig)
 &rst
  ixpk= 1858, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.37, r4= 7.12,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,1674,1675,1676,1678,1679,1680,
 igr2=1729,1730,1731,1733,1734,1735,1073,1074,1075,1077,
      1078,1079,
 &end
#
#   65 VAL  MGY         104 LEU  MDX         2.60    (#   1860:20  Unique         2.27, 6.63 A)
 &rst
  ixpk= 1860, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1011,1012,1013,1015,1016,1017,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:1861   104 LEU  MDX         2.60    (#   1861:20  Single Ambig)
 &rst
  ixpk= 1861, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1724,1725, 350, 351, 352,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:1862     0 AMB  20-1:1862   3.50    (#   1862:20  Double Ambig)
 &rst
  ixpk= 1862, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1028,1029, 924,
 igr2=1073,1074,1075,1077,1078,1079,1729,1730,1731,1733,
      1734,1735,
 &end
#
#    0 AMB  20-2:1863     0 AMB  20-1:1863   2.60    (#   1863:20  Double Ambig)
 &rst
  ixpk= 1863, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1724,1725,2356,1799,1800,
 igr2=1729,1730,1731,1733,1734,1735,1189,1190,1191,1193,
      1194,1195,
 &end
#
#    0 AMB  20-2:1864     0 AMB  20-1:1864   3.50    (#   1864:20  Double Ambig)
 &rst
  ixpk= 1864, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1146,1147, 997, 998,
 igr2=1189,1190,1191,1193,1194,1195,1729,1730,1731,1733,
      1734,1735,
 &end
#
#    0 AMB  20-2:1865     0 AMB  20-1:1865   4.40    (#   1865:20  Double Ambig)
 &rst
  ixpk= 1865, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2415, 940, 941,
 igr2=1189,1190,1191,1193,1194,1195,1729,1730,1731,1733,
      1734,1735,
 &end
#
#  107 GLY  HA-         104 LEU  MDX         4.40    (#   1866:20  Unique         2.07, 4.90 A)
 &rst
  ixpk= 1866, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1768,1769,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  105 VAL  HA            0 AMB  20-1:1867   4.40    (#   1867:20  Single Ambig)
 &rst
  ixpk= 1867, nxpk= 20, iat=1741,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr2=1729,1730,1731,1733,1734,1735,1073,1074,1075,1077,
      1078,1079,
 &end
#
#   65 VAL  HA          104 LEU  MDX         5.50    (#   1869:20  Unique         3.22, 5.85 A)
 &rst
  ixpk= 1869, nxpk= 20, iat=1007,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#   99 TRP  HD1          75 LEU  MDY         3.50    (#   1870:20  Unique         2.00, 4.80 A)
 &rst
  ixpk= 1870, nxpk= 20, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  106 SER  HN          104 LEU  MDX         3.50    (#   1871:20  Unique         3.27, 5.07 A)
 &rst
  ixpk= 1871, nxpk= 20, iat=1755,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:1872   104 LEU  MDX         4.40    (#   1872:20  Single Ambig)
 &rst
  ixpk= 1872, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1773,1766,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  105 VAL  HN          104 LEU  MDX         3.50    (#   1873:20  Unique         2.07, 4.71 A)
 &rst
  ixpk= 1873, nxpk= 20, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#   68 LEU  HN           68 LEU  HB-         5.50    (#   1876:20  Unique         2.64, 3.23 A)
 &rst
  ixpk= 1876, nxpk= 20, iat=1064,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1068,1069,
 &end
#
#   69 ALA  HN           68 LEU  HB-         4.40    (#   1877:20  Unique         2.46, 3.30 A)
 &rst
  ixpk= 1877, nxpk= 20, iat=1083,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1068,1069,
 &end
#
#   68 LEU  HA           68 LEU  HB-         3.50    (#   1878:20  Unique         2.30, 2.67 Acnoe_amber.rst)
 &rst
  ixpk= 1878, nxpk= 20, iat=1066,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1068,1069,
 &end
#
#    0 AMB  20-2:1883     0 AMB  20-1:1883   5.50    (#   1883:20  Double Ambig)
 &rst
  ixpk= 1883, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1028,1029,1691,
 igr2=1068,1069,1068,1069,
 &end
#
#   68 LEU  HA           68 LEU  HB+         4.40    (#   1884:20  Unique         2.30, 2.67 A)
 &rst
  ixpk= 1884, nxpk= 20, iat=1066,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1068,1069,
 &end
#
#   68 LEU  HN           68 LEU  HB+         5.50    (#   1885:20  Unique         2.64, 3.23 A)
 &rst
  ixpk= 1885, nxpk= 20, iat=1064,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1068,1069,
 &end
#
#    0 AMB  20-2:1886     0 AMB  20-1:1886   4.40    (#   1886:20  Double Ambig)
 &rst
  ixpk= 1886, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.21, r4= 9.96,
 igr1=2554,2555,2556,2558,2559,2560,1073,1074,1075,1077,
      1078,1079,1669,1670,
 igr2=1068,1069,1068,1069,1068,1069,
 &end
#
#    0 AMB  20-2:1887    68 LEU  HB-         5.50    (#   1887:20  Single Ambig)
 &rst
  ixpk= 1887, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.58, r4=10.33,
 igr1=2554,2555,2556,2558,2559,2560,1073,1074,1075,1077,
      1078,1079,1669,1670,
 igr2=1068,1069,
 &end
#
#    0 AMB  20-2:1888     0 AMB  20-1:1888   2.60    (#   1888:20  Double Ambig)
 &rst
  ixpk= 1888, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.53, r4= 5.28,
 igr1=1674,1675,1676,1678,1679,1680,1071,
 igr2=1068,1069,1068,1069,
 &end
#
#  154 VAL  MGY          68 LEU  HB+         3.50    (#   1889:20  Unique         2.00, 3.71 A)
 &rst
  ixpk= 1889, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2554,2555,2556,2558,2559,2560,
 igr2=1068,1069,
 &end
#
#    0 AMB  20-2:1890    68 LEU  HB-         3.50    (#   1890:20  Single Ambig)
 &rst
  ixpk= 1890, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=1674,1675,1676,1678,1679,1680,1071,
 igr2=1068,1069,
 &end
#
#   68 LEU  MDY          68 LEU  HB-         3.50    (#   1891:20  Unique         2.10, 3.26 A)
 &rst
  ixpk= 1891, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1073,1074,1075,1077,1078,1079,
 igr2=1068,1069,
 &end
#
#   68 LEU  MDY          68 LEU  HG          2.60    (#   1892:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 1892, nxpk= 20, iat=  -1,1071, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1073,1074,1075,1077,1078,1079,
 &end
#
#   68 LEU  MDX          68 LEU  HG          2.60    (#   1893:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 1893, nxpk= 20, iat=  -1,1071, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1073,1074,1075,1077,1078,1079,
 &end
#
#   68 LEU  HB-          68 LEU  HG          2.60    (#   1894:20  Unique         2.40, 2.76 A)
 &rst
  ixpk= 1894, nxpk= 20, iat=  -1,1071, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1068,1069,
 &end
#
#   68 LEU  HB+          68 LEU  HG          2.60    (#   1895:20  Unique         2.40, 2.76 A)
 &rst
  ixpk= 1895, nxpk= 20, iat=  -1,1071, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1068,1069,
 &end
#
#   66 ARG  HG+          68 LEU  HG          2.60    (#   1896:20  Unique         2.97, 3.92 A)
 &rst
  ixpk= 1896, nxpk= 20, iat=  -1,1071, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1028,1029,
 &end
#
#  103 GLN  HB+          68 LEU  HG          3.50    (#   1897:20  Unique         2.76, 3.55 A)
 &rst
  ixpk= 1897, nxpk= 20, iat=  -1,1071, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1707,1708,
 &end
#
#  103 GLN  HB-          68 LEU  HG          2.60    (#   1898:20  Unique         2.76, 3.55 A)
 &rst
  ixpk= 1898, nxpk= 20, iat=  -1,1071, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1707,1708,
 &end
#
#  103 GLN  HG+          68 LEU  HG          5.50    (#   1899:20  Unique         4.99, 5.61 A)
 &rst
  ixpk= 1899, nxpk= 20, iat=  -1,1071, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1710,1711,
 &end
#
#   68 LEU  HA           68 LEU  HG          3.50    (#   1900:20  Unique         3.13, 3.25 A)
 &rst
  ixpk= 1900, nxpk= 20, iat=1066,1071, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  103 GLN  HA           68 LEU  HG          4.40    (#   1901:20  Unique         4.45, 4.69 A)
 &rst
  ixpk= 1901, nxpk= 20, iat=1705,1071, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  102 LEU  HA           68 LEU  HG          5.50    (#   1902:20  Unique         2.07, 2.44 A)
 &rst
  ixpk= 1902, nxpk= 20, iat=1686,1071, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   69 ALA  HN           68 LEU  HG          4.40    (#   1904:20  Unique         3.77, 3.95 A)
 &rst
  ixpk= 1904, nxpk= 20, iat=1083,1071, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  103 GLN  HN           68 LEU  HG          3.50    (#   1905:20  Unique         2.03, 2.39 A)
 &rst
  ixpk= 1905, nxpk= 20, iat=1703,1071, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   68 LEU  HN           68 LEU  HG          4.40    (#   1906:20  Unique         1.95, 2.36 A)
 &rst
  ixpk= 1906, nxpk= 20, iat=1064,1071, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  102 LEU  HN           68 LEU  HG          5.50    (#   1907:20  Unique         4.52, 4.98 A)
 &rst
  ixpk= 1907, nxpk= 20, iat=1684,1071, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   68 LEU  HN           68 LEU  MDY         3.50    (#   1908:20  Unique         3.40, 4.41 A)
 &rst
  ixpk= 1908, nxpk= 20, iat=1064,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#  103 GLN  HN           68 LEU  MDY         3.50    (#   1909:20  Unique         2.21, 3.75 A)
 &rst
  ixpk= 1909, nxpk= 20, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#    0 AMB  20-2:1910    68 LEU  MDY         5.50    (#   1910:20  Single Ambig)
 &rst
  ixpk= 1910, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1021,1665,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   69 ALA  HN           68 LEU  MDY         4.40    (#   1911:20  Unique         4.44, 5.51 A)
 &rst
  ixpk= 1911, nxpk= 20, iat=1083,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   66 ARG  HE           68 LEU  MDY         5.50    (#   1912:20  Unique         4.29, 6.40 A)
 &rst
  ixpk= 1912, nxpk= 20, iat=1034,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#  103 GLN  HE2-         68 LEU  MDY         5.50    (#   1913:20  Unique         1.97, 5.74 A)
 &rst
  ixpk= 1913, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1715,1716,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#  102 LEU  HA           68 LEU  MDY         5.50    (#   1914:20  Unique         2.91, 4.54 A)
 &rst
  ixpk= 1914, nxpk= 20, iat=1686,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#  103 GLN  HA           68 LEU  MDY         5.50    (#   1915:20  Unique         3.07, 5.14 A)
 &rst
  ixpk= 1915, nxpk= 20, iat=1705,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   68 LEU  HA           68 LEU  MDY         2.60    (#   1917:20  Unique         2.21, 4.00 A)
 &rst
  ixpk= 1917, nxpk= 20, iat=1066,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   67 ILE  HA           68 LEU  MDY         4.40    (#   1918:20  Unique         3.88, 5.62 A)
 &rst
  ixpk= 1918, nxpk= 20, iat=1047,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   66 ARG  HD+          68 LEU  MDY         3.50    (#   1919:20  Unique         1.99, 4.89 Acnoe_amber.rst)
 &rst
  ixpk= 1919, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1031,1032,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   68 LEU  HB+          68 LEU  MDY         2.60    (#   1920:20  Unique         2.10, 3.26 A)
 &rst
  ixpk= 1920, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1068,1069,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   68 LEU  HB-          68 LEU  MDY         2.60    (#   1921:20  Unique         2.10, 3.26 A)
 &rst
  ixpk= 1921, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1068,1069,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   66 ARG  HG+          68 LEU  MDY         2.60    (#   1922:20  Unique         1.96, 4.29 A)
 &rst
  ixpk= 1922, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1028,1029,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#    0 AMB  20-2:1925    69 ALA  HA          3.50    (#   1925:20  Single Ambig)
 &rst
  ixpk= 1925, nxpk= 20, iat=  -1,1085, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1051,1052,1053,1669,1670,
 &end
#
#   69 ALA  MB           69 ALA  HA          2.60    (#   1926:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1926, nxpk= 20, iat=  -1,1085, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1087,1088,1089,
 &end
#
#  151 PHE  HD           69 ALA  HA          4.40    (#   1927:20  Unique         4.17, 7.14 A)
 &rst
  ixpk= 1927, nxpk= 20, iat=  -1,1085, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2515,2523,
 &end
#
#   69 ALA  HN           69 ALA  HA          3.50    (#   1928:20  Unique         2.85, 2.89 A)
 &rst
  ixpk= 1928, nxpk= 20, iat=1083,1085, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   70 SER  HN           69 ALA  HA          2.60    (#   1929:20  Unique         2.22, 2.26 A)
 &rst
  ixpk= 1929, nxpk= 20, iat=1093,1085, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   68 LEU  HN           69 ALA  HA          5.50    (#   1930:20  Unique         4.50, 4.70 A)
 &rst
  ixpk= 1930, nxpk= 20, iat=1064,1085, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  HB-          69 ALA  MB          3.50    (#   1931:20  Unique         1.98, 4.28 A)
 &rst
  ixpk= 1931, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1669,1670,
 igr2=1087,1088,1089,
 &end
#
#  101 LEU  MDY          69 ALA  MB          2.60    (#   1932:20  Unique         2.18, 5.50 A)
 &rst
  ixpk= 1932, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=1087,1088,1089,
 &end
#
#  101 LEU  MDX          69 ALA  MB          2.60    (#   1933:20  Unique         2.18, 5.50 A)
 &rst
  ixpk= 1933, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=1087,1088,1089,
 &end
#
#  154 VAL  MGY          69 ALA  MB          2.60    (#   1934:20  Unique         1.97, 4.03 A)
 &rst
  ixpk= 1934, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=2554,2555,2556,2558,2559,2560,
 igr2=1087,1088,1089,
 &end
#
#    0 AMB  20-2:1935    69 ALA  MB          2.60    (#   1935:20  Single Ambig)
 &rst
  ixpk= 1935, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2554,2555,2556,2558,2559,2560,1669,1670,
 igr2=1087,1088,1089,
 &end
#
#  154 VAL  HB           69 ALA  MB          3.50    (#   1936:20  Unique         2.77, 4.73 A)
 &rst
  ixpk= 1936, nxpk= 20, iat=2552,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1087,1088,1089,
 &end
#
#  151 PHE  HB+          69 ALA  MB          4.40    (#   1937:20  Unique         3.22, 6.01 A)
 &rst
  ixpk= 1937, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2511,2512,
 igr2=1087,1088,1089,
 &end
#
#   69 ALA  HA           69 ALA  MB          2.60    (#   1938:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1938, nxpk= 20, iat=1085,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1087,1088,1089,
 &end
#
#  151 PHE  HA           69 ALA  MB          4.40    (#   1940:20  Unique         2.44, 3.68 A)
 &rst
  ixpk= 1940, nxpk= 20, iat=2509,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1087,1088,1089,
 &end
#
#   70 SER  HA           69 ALA  MB          4.40    (#   1941:20  Unique         4.07, 4.92 A)
 &rst
  ixpk= 1941, nxpk= 20, iat=1095,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1087,1088,1089,
 &end
#
#  151 PHE  HD           69 ALA  MB          2.60    (#   1942:20  Unique         1.97, 5.51 A)
 &rst
  ixpk= 1942, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2515,2523,
 igr2=1087,1088,1089,
 &end
#
#   69 ALA  HN           69 ALA  MB          3.50    (#   1943:20  Unique         2.75, 3.43 A)
 &rst
  ixpk= 1943, nxpk= 20, iat=1083,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1087,1088,1089,
 &end
#
#   70 SER  HN           69 ALA  MB          2.60    (#   1944:20  Unique         2.55, 3.56 A)
 &rst
  ixpk= 1944, nxpk= 20, iat=1093,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1087,1088,1089,
 &end
#
#  101 LEU  HN           69 ALA  MB          4.40    (#   1945:20  Unique         3.72, 5.14 A)
 &rst
  ixpk= 1945, nxpk= 20, iat=1665,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1087,1088,1089,
 &end
#
#   68 LEU  HN           69 ALA  MB          5.50    (#   1947:20  Unique         4.47, 5.36 A)
 &rst
  ixpk= 1947, nxpk= 20, iat=1064,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1087,1088,1089,
 &end
#
#   71 THR  HN           70 SER  HA          3.50    (#   1948:20  Unique         2.32, 2.34 A)
 &rst
  ixpk= 1948, nxpk= 20, iat=1104,1095, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  101 LEU  HN           70 SER  HA          4.40    (#   1949:20  Unique         2.87, 3.04 A)
 &rst
  ixpk= 1949, nxpk= 20, iat=1665,1095, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   70 SER  HN           70 SER  HA          4.40    (#   1950:20  Unique         2.92, 2.92 A)
 &rst
  ixpk= 1950, nxpk= 20, iat=1093,1095, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:1951    70 SER  HA          5.50    (#   1951:20  Single Ambig)
 &rst
  ixpk= 1951, nxpk= 20, iat=  -1,1095, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1083,1621,
 &end
#
#  151 PHE  HD           70 SER  HA          4.40    (#   1952:20  Unique         3.94, 5.44 A)
 &rst
  ixpk= 1952, nxpk= 20, iat=  -1,1095, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2515,2523,
 &end
#
#   69 ALA  HA           70 SER  HA          4.40    (#   1954:20  Unique         4.44, 4.45 A)
 &rst
  ixpk= 1954, nxpk= 20, iat=1085,1095, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   70 SER  HB+          70 SER  HA          3.50    (#   1955:20  Unique         2.24, 2.48 A)
 &rst
  ixpk= 1955, nxpk= 20, iat=  -1,1095, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1097,1098,
 &end
#
#   70 SER  HB-          70 SER  HA          3.50    (#   1956:20  Unique         2.24, 2.48 A)
 &rst
  ixpk= 1956, nxpk= 20, iat=  -1,1095, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1097,1098,
 &end
#
#    0 AMB  20-2:1957    70 SER  HA          4.40    (#   1957:20  Single Ambig)
 &rst
  ixpk= 1957, nxpk= 20, iat=  -1,1095, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1649,1650,2439,
 &end
#
#   69 ALA  MB           70 SER  HA          4.40    (#   1958:20  Unique         4.07, 4.92 A)
 &rst
  ixpk= 1958, nxpk= 20, iat=  -1,1095, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1087,1088,1089,
 &end
#
#   71 THR  MG2          70 SER  HA          4.40    (#   1959:20  Unique         3.46, 4.39 A)
 &rst
  ixpk= 1959, nxpk= 20, iat=  -1,1095, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1110,1111,1112,
 &end
#
#   67 ILE  QG2          70 SER  HB-         5.50    (#   1960:20  Unique         2.76, 4.40 A)
 &rst
  ixpk= 1960, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1051,1052,1053,
 igr2=1097,1098,
 &end
#
#    0 AMB  20-2:1961     0 AMB  20-1:1961   4.40    (#   1961:20  Double Ambig)
 &rst
  ixpk= 1961, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.25, r4=11.00,
 igr1=1669,1670,2554,2555,2556,2558,2559,2560, 162, 163,
       164, 166, 167, 168,1189,1190,1191,1193,1194,1195,
      
 igr2=1097,1098,1097,1098,1097,1098,1097,1098,
 &end
#
#    0 AMB  20-2:1962     0 AMB  20-1:1962   3.50    (#   1962:20  Double Ambig)
 &rst
  ixpk= 1962, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=1058,1059,1060,1609,1610,
 igr2=1097,1098,1097,1098,
 &end
#
#   70 SER  HA           70 SER  HB+         3.50    (#   1964:20  Unique         2.24, 2.48 A)
 &rst
  ixpk= 1964, nxpk= 20, iat=1095,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1097,1098,
 &end
#
#   70 SER  HA           70 SER  HB-         3.50    (#   1966:20  Unique         2.24, 2.48 A)
 &rst
  ixpk= 1966, nxpk= 20, iat=1095,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1097,1098,
 &end
#
#  151 PHE  HD           70 SER  HB-         5.50    (#   1967:20  Unique         6.10, 7.69 A)
 &rst
  ixpk= 1967, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2515,2523,
 igr2=1097,1098,
 &end
#
#  100 PHE  HD           70 SER  HB-         4.40    (#   1968:20  Unique         2.68, 4.03 A)
 &rst
  ixpk= 1968, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1653,1661,
 igr2=1097,1098,
 &end
#
#  100 PHE  HD           70 SER  HB+         3.50    (#   1969:20  Unique         2.68, 4.03 A)
 &rst
  ixpk= 1969, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1653,1661,
 igr2=1097,1098,
 &end
#
#  151 PHE  HD           70 SER  HB+         5.50    (#   1970:20  Unique         6.10, 7.69 A)
 &rst
  ixpk= 1970, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2515,2523,
 igr2=1097,1098,
 &end
#
#   70 SER  HN           70 SER  HB+         4.40    (#   1971:20  Unique         2.69, 3.61 A)
 &rst
  ixpk= 1971, nxpk= 20, iat=1093,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1097,1098,
 &end
#
#   70 SER  HN           70 SER  HB-         5.50    (#   1972:20  Unique         2.69, 3.61 A)
 &rst
  ixpk= 1972, nxpk= 20, iat=1093,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1097,1098,
 &end
#
#   71 THR  HN           70 SER  HB+         3.50    (#   1973:20  Unique         2.59, 3.19 A)
 &rst
  ixpk= 1973, nxpk= 20, iat=1104,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1097,1098,
 &end
#
#   71 THR  HN           70 SER  HB-         3.50    (#   1974:20  Unique         2.59, 3.19 A)
 &rst
  ixpk= 1974, nxpk= 20, iat=1104,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1097,1098,
 &end
#
#  101 LEU  HN           70 SER  HB-         5.50    (#   1975:20  Unique         3.52, 4.32 A)
 &rst
  ixpk= 1975, nxpk= 20, iat=1665,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1097,1098,
 &end
#
#   71 THR  MG2          71 THR  HA          2.60    (#   1976:20  Unique         2.32, 3.23 A)
 &rst
  ixpk= 1976, nxpk= 20, iat=  -1,1106, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1110,1111,1112,
 &end
#
#   71 THR  HB           71 THR  HA          2.60    (#   1977:20  Unique         2.33, 2.36 A)
 &rst
  ixpk= 1977, nxpk= 20, iat=1108,1106, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  151 PHE  HD           71 THR  HA          5.50    (#   1979:20  Unique         5.33, 7.05 A)
 &rst
  ixpk= 1979, nxpk= 20, iat=  -1,1106, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#   71 THR  HN           71 THR  HA          4.40    (#   1981:20  Unique         2.90, 2.90 A)
 &rst
  ixpk= 1981, nxpk= 20, iat=1104,1106, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   72 ARG  HN           71 THR  HA          2.60    (#   1982:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1982, nxpk= 20, iat=1118,1106, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   72 ARG  HN           71 THR  HB          4.40    (#   1983:20  Unique         3.33, 3.37 A)
 &rst
  ixpk= 1983, nxpk= 20, iat=1118,1108, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   73 ASN  HN           71 THR  HB          4.40    (#   1986:20  Unique         2.77, 3.01 A)
 &rst
  ixpk= 1986, nxpk= 20, iat=1142,1108, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   73 ASN  HD2-         71 THR  HB          5.50    (#   1987:20  Unique         3.46, 5.53 A)
 &rst
  ixpk= 1987, nxpk= 20, iat=  -1,1108, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1151,1152,
 &end
#
#   71 THR  HA           71 THR  HB          2.60    (#   1989:20  Unique         2.33, 2.36 A)
 &rst
  ixpk= 1989, nxpk= 20, iat=1106,1108, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   71 THR  MG2          71 THR  HB          2.60    (#   1990:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 1990, nxpk= 20, iat=  -1,1108, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1110,1111,1112,
 &end
#
#  147 VAL  MGY          71 THR  MG2         3.50    (#   1991:20  Unique         2.02, 4.95 A)
 &rst
  ixpk= 1991, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=1110,1111,1112,
 &end
#
#  147 VAL  MGX          71 THR  MG2         3.50    (#   1992:20  Unique         2.02, 4.95 A)
 &rst
  ixpk= 1992, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=1110,1111,1112,
 &end
#
#  150 GLU  HB-          71 THR  MG2         3.50    (#   1993:20  Unique         2.62, 4.21 A)
 &rst
  ixpk= 1993, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2496,2497,
 igr2=1110,1111,1112,
 &end
#
#    0 AMB  20-2:1994    71 THR  MG2         3.50    (#   1994:20  Single Ambig)
 &rst
  ixpk= 1994, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2496,2497,1187,
 igr2=1110,1111,1112,
 &end
#
#  150 GLU  HG-          71 THR  MG2         4.40    (#   1995:20  Unique         3.19, 5.21 A)
 &rst
  ixpk= 1995, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2499,2500,
 igr2=1110,1111,1112,
 &end
#
#  150 GLU  HG+          71 THR  MG2         3.50    (#   1996:20  Unique         3.19, 5.21 A)
 &rst
  ixpk= 1996, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2499,2500,
 igr2=1110,1111,1112,
 &end
#
#  147 VAL  HA           71 THR  MG2         4.40    (#   1997:20  Unique         2.11, 3.43 A)
 &rst
  ixpk= 1997, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1110,1111,1112,
 &end
#
#   99 TRP  HB-          71 THR  MG2         3.50    (#   1998:20  Unique         1.97, 3.56 A)
 &rst
  ixpk= 1998, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1625,1626,
 igr2=1110,1111,1112,
 &end
#
#   99 TRP  HB+          71 THR  MG2         3.50    (#   1999:20  Unique         1.97, 3.56 A)
 &rst
  ixpk= 1999, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1625,1626,
 igr2=1110,1111,1112,
 &end
#
#   71 THR  HA           71 THR  MG2         2.60    (#   2000:20  Unique         2.32, 3.23 A)
 &rst
  ixpk= 2000, nxpk= 20, iat=1106,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1110,1111,1112,
 &end
#
#   71 THR  HB           71 THR  MG2         2.60    (#   2001:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2001, nxpk= 20, iat=1108,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1110,1111,1112,
 &end
#
#   70 SER  HA           71 THR  MG2         4.40    (#   2003:20  Unique         3.46, 4.39 A)
 &rst
  ixpk= 2003, nxpk= 20, iat=1095,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1110,1111,1112,
 &end
#
#   99 TRP  HA           71 THR  MG2         5.50    (#   2004:20  Unique         4.60, 5.70 A)
 &rst
  ixpk= 2004, nxpk= 20, iat=1623,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1110,1111,1112,
 &end
#
#  151 PHE  HD           71 THR  MG2         4.40    (#   2005:20  Unique         3.87, 5.43 A)
 &rst
  ixpk= 2005, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2515,2523,
 igr2=1110,1111,1112,
 &end
#
#    0 AMB  20-2:2007    71 THR  MG2         3.50    (#   2007:20  Single Ambig)
 &rst
  ixpk= 2007, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1151,1152,1131,
 igr2=1110,1111,1112,
 &end
#
#   99 TRP  HN           71 THR  MG2         3.50    (#   2008:20  Unique         3.22, 4.61 A)
 &rst
  ixpk= 2008, nxpk= 20, iat=1621,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1110,1111,1112,
 &end
#
#    0 AMB  20-2:2009    71 THR  MG2         5.50    (#   2009:20  Single Ambig)
 &rst
  ixpk= 2009, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=2437,1093,2453,
 igr2=1110,1111,1112,
 &end
#
#   73 ASN  HN           71 THR  MG2         4.40    (#   2010:20  Unique         4.92, 5.47 A)
 &rst
  ixpk= 2010, nxpk= 20, iat=1142,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1110,1111,1112,
 &end
#
#   71 THR  HN           71 THR  MG2         3.50    (#   2011:20  Unique         2.02, 3.01 A)
 &rst
  ixpk= 2011, nxpk= 20, iat=1104,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1110,1111,1112,
 &end
#
#   72 ARG  HN           71 THR  MG2         3.50    (#   2012:20  Unique         4.37, 5.13 A)
 &rst
  ixpk= 2012, nxpk= 20, iat=1118,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1110,1111,1112,
 &end
#
#   99 TRP  HE1          71 THR  MG2         5.50    (#   2013:20  Unique         5.02, 6.37 A)
 &rst
  ixpk= 2013, nxpk= 20, iat=1631,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1110,1111,1112,
 &end
#
#   72 ARG  HN           72 ARG  HA          3.50    (#   2015:20  Unique         2.84, 2.89 A)
 &rst
  ixpk= 2015, nxpk= 20, iat=1118,1120, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2016    72 ARG  HA          3.50    (#   2016:20  Single Ambig)
 &rst
  ixpk= 2016, nxpk= 20, iat=  -1,1120, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1142,1156,
 &end
#
#   73 ASN  HA           72 ARG  HA          5.50    (#   2017:20  Unique         4.51, 4.57 A)
 &rst
  ixpk= 2017, nxpk= 20, iat=1144,1120, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   72 ARG  HD+          72 ARG  HA          4.40    (#   2019:20  Unique         3.92, 4.63 A)
 &rst
  ixpk= 2019, nxpk= 20, iat=  -1,1120, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1128,1129,
 &end
#
#   72 ARG  HB+          72 ARG  HA          2.60    (#   2020:20  Unique         2.23, 2.71 A)
 &rst
  ixpk= 2020, nxpk= 20, iat=  -1,1120, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1122,1123,
 &end
#
#   72 ARG  HG+          72 ARG  HA          2.60    (#   2021:20  Unique         2.38, 2.96 A)
 &rst
  ixpk= 2021, nxpk= 20, iat=  -1,1120, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1125,1126,
 &end
#
#   72 ARG  HD+          72 ARG  HB+         2.60    (#   2023:20  Unique         2.16, 2.96 A)
 &rst
  ixpk= 2023, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1128,1129,
 igr2=1122,1123,
 &end
#
#   72 ARG  HA           72 ARG  HB+         2.60    (#   2024:20  Unique         2.23, 2.71 A)
 &rst
  ixpk= 2024, nxpk= 20, iat=1120,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1122,1123,
 &end
#
#    0 AMB  20-2:2025     0 AMB  20-1:2025   2.60    (#   2025:20  Double Ambig)
 &rst
  ixpk= 2025, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2192,2216,
 igr2=2194,2195,2320,2321,2194,2195,
 &end
#
#  134 ARG  HN          134 ARG  HB+         3.50    (#   2026:20  Unique         2.11, 2.78 A)
 &rst
  ixpk= 2026, nxpk= 20, iat=2190,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2194,2195,
 &end
#
#  148 MET  HN          148 MET  HB+         5.50    (#   2027:20  Unique         2.27, 3.03 A)
 &rst
  ixpk= 2027, nxpk= 20, iat=2453,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2457,2458,
 &end
#
#    0 AMB  20-2:2028     0 AMB  20-1:2028   3.50    (#   2028:20  Double Ambig)
 &rst
  ixpk= 2028, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1142,2263,
 igr2=1122,1123,2320,2321,
 &end
#
#   72 ARG  HN           72 ARG  HB+         2.60    (#   2029:20  Unique         2.14, 3.05 A)
 &rst
  ixpk= 2029, nxpk= 20, iat=1118,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1122,1123,
 &end
#
#   72 ARG  HN           72 ARG  HG+         3.50    (#   2030:20  Unique         1.99, 2.95 A)
 &rst
  ixpk= 2030, nxpk= 20, iat=1118,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1125,1126,
 &end
#
#    0 AMB  20-2:2031     0 AMB  20-1:2031   5.50    (#   2031:20  Double Ambig)
 &rst
  ixpk= 2031, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1142,2263,
 igr2=1125,1126,2323,2324,
 &end
#
#    0 AMB  20-2:2032     0 AMB  20-1:2032   4.40    (#   2032:20  Double Ambig)
 &rst
  ixpk= 2032, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1151,1152,1131,
 igr2=1125,1126,1125,1126,
 &end
#
#   72 ARG  HA           72 ARG  HG-         2.60    (#   2033:20  Unique         2.38, 2.96 A)
 &rst
  ixpk= 2033, nxpk= 20, iat=1120,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1125,1126,
 &end
#
#    0 AMB  20-2:2034     0 AMB  20-1:2034   2.60    (#   2034:20  Double Ambig)
 &rst
  ixpk= 2034, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1120,2267,2268,
 igr2=1125,1126,2323,2324,
 &end
#
#   72 ARG  HD+          72 ARG  HG+         2.60    (#   2035:20  Unique         2.26, 2.67 A)
 &rst
  ixpk= 2035, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1128,1129,
 igr2=1125,1126,
 &end
#
#   72 ARG  HD+          72 ARG  HG-         2.60    (#   2036:20  Unique         2.26, 2.67 A)
 &rst
  ixpk= 2036, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1128,1129,
 igr2=1125,1126,
 &end
#
#    0 AMB  20-2:2037     0 AMB  20-1:2037   2.60    (#   2037:20  Double Ambig)
 &rst
  ixpk= 2037, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2320,2321,1122,1123,
 igr2=2323,2324,1125,1126,
 &end
#
#    0 AMB  20-2:2038     0 AMB  20-1:2038   2.60    (#   2038:20  Double Ambig)
 &rst
  ixpk= 2038, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2194,2195,1122,1123,1049,
 igr2=2197,2198,1125,1126,1055,1056,
 &end
#
#   72 ARG  HB+          72 ARG  HD+         2.60    (#   2039:20  Unique         2.16, 2.96 A)
 &rst
  ixpk= 2039, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1122,1123,
 igr2=1128,1129,
 &end
#
#    0 AMB  20-2:2040     0 AMB  20-1:2040   2.60    (#   2040:20  Double Ambig)
 &rst
  ixpk= 2040, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2420,2421,1125,1126,
 igr2=2423,2424,1128,1129,
 &end
#
#    0 AMB  20-2:2041     0 AMB  20-1:2041   2.60    (#   2041:20  Double Ambig)
 &rst
  ixpk= 2041, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1125,1126,2396,2397,
 igr2=1128,1129,2423,2424,
 &end
#
#    0 AMB  20-2:2042    73 ASN  HA          2.60    (#   2042:20  Single Ambig)
 &rst
  ixpk= 2042, nxpk= 20, iat=  -1,1144, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1156,1142,
 &end
#
#   73 ASN  HD2-         73 ASN  HA          5.50    (#   2043:20  Unique         2.93, 3.84 A)
 &rst
  ixpk= 2043, nxpk= 20, iat=  -1,1144, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1151,1152,
 &end
#
#   73 ASN  HB+          73 ASN  HA          2.60    (#   2044:20  Unique         2.31, 2.70 A)
 &rst
  ixpk= 2044, nxpk= 20, iat=  -1,1144, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1146,1147,
 &end
#
#   73 ASN  HB-          73 ASN  HA          3.50    (#   2045:20  Unique         2.31, 2.70 A)
 &rst
  ixpk= 2045, nxpk= 20, iat=  -1,1144, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1146,1147,
 &end
#
#   72 ARG  HB+          73 ASN  HB+         5.50    (#   2046:20  Unique         4.22, 5.68 A)
 &rst
  ixpk= 2046, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1122,1123,
 igr2=1146,1147,
 &end
#
#   72 ARG  HB+          73 ASN  HB-         4.40    (#   2047:20  Unique         4.22, 5.68 A)
 &rst
  ixpk= 2047, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1122,1123,
 igr2=1146,1147,
 &end
#
#   75 LEU  MDY          73 ASN  HB-         4.40    (#   2048:20  Unique         2.67, 5.48 A)
 &rst
  ixpk= 2048, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1189,1190,1191,1193,1194,1195,
 igr2=1146,1147,
 &end
#
#   73 ASN  HA           73 ASN  HB+         2.60    (#   2049:20  Unique         2.31, 2.70 A)
 &rst
  ixpk= 2049, nxpk= 20, iat=1144,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1146,1147,
 &end
#
#   73 ASN  HA           73 ASN  HB-         2.60    (#   2050:20  Unique         2.31, 2.70 A)
 &rst
  ixpk= 2050, nxpk= 20, iat=1144,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1146,1147,
 &end
#
#   73 ASN  HD2-         73 ASN  HB+         5.50    (#   2051:20  Unique         2.21, 3.39 A)
 &rst
  ixpk= 2051, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1151,1152,
 igr2=1146,1147,
 &end
#
#   73 ASN  HD2-         73 ASN  HB-         5.50    (#   2052:20  Unique         2.21, 3.39 A)
 &rst
  ixpk= 2052, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1151,1152,
 igr2=1146,1147,
 &end
#
#   73 ASN  HD2+         73 ASN  HB-         3.50    (#   2053:20  Unique         2.21, 3.39 A)
 &rst
  ixpk= 2053, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1151,1152,
 igr2=1146,1147,
 &end
#
#   73 ASN  HD2+         73 ASN  HB+         4.40    (#   2054:20  Unique         2.21, 3.39 A)
 &rst
  ixpk= 2054, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1151,1152,
 igr2=1146,1147,
 &end
#
#    0 AMB  20-2:2055     0 AMB  20-1:2055   2.60    (#   2055:20  Double Ambig)
 &rst
  ixpk= 2055, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1142,1156,
 igr2=1146,1147,1146,1147,
 &end
#
#    0 AMB  20-2:2056    73 ASN  HB-         2.60    (#   2056:20  Single Ambig)
 &rst
  ixpk= 2056, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1142,1156,
 igr2=1146,1147,
 &end
#
#   94 GLY  HN            7 TYR  HA          5.50    (#   2057:20  Unique         3.26, 3.48 A)
 &rst
  ixpk= 2057, nxpk= 20, iat=1536,  85, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:2058     0 AMB  20-1:2058   4.40    (#   2058:20  Double Ambig)
 &rst
  ixpk= 2058, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.37, r4= 8.12,
 igr1=  27,  28,  29,1570,1571, 329, 330, 331, 333, 334,
       335,
 igr2=  85,2117,
 &end
#
#   73 ASN  HD2+         73 ASN  HB+         4.40    (#   2059:20  Unique         2.21, 3.39 A)
 &rst
  ixpk= 2059, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1151,1152,
 igr2=1146,1147,
 &end
#
#   75 LEU  MDX          74 TRP  HA          3.50    (#   2060:20  Unique         3.37, 5.64 A)
 &rst
  ixpk= 2060, nxpk= 20, iat=  -1,1158, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1189,1190,1191,1193,1194,1195,
 &end
#
#   74 TRP  HB+          74 TRP  HA          3.50    (#   2061:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 2061, nxpk= 20, iat=  -1,1158, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1160,1161,
 &end
#
#    0 AMB  20-2:2062     0 AMB  20-1:2062   3.50    (#   2062:20  Double Ambig)
 &rst
  ixpk= 2062, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1164,2134,
 igr2=1158,2117,
 &end
#
#   74 TRP  HN           74 TRP  HA          3.50    (#   2063:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 2063, nxpk= 20, iat=1156,1158, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   75 LEU  HN           74 TRP  HA          3.50    (#   2064:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 2064, nxpk= 20, iat=1180,1158, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   74 TRP  HA           74 TRP  HB+         5.50    (#   2065:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 2065, nxpk= 20, iat=1158,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1160,1161,
 &end
#
#   96 LYS  HA           74 TRP  HB+         5.50    (#   2066:20  Unique         3.79, 4.84 A)
 &rst
  ixpk= 2066, nxpk= 20, iat=1562,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1160,1161,
 &end
#
#   74 TRP  HN           74 TRP  HB+         5.50    (#   2067:20  Unique         2.45, 3.07 A)
 &rst
  ixpk= 2067, nxpk= 20, iat=1156,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1160,1161,
 &end
#
#   75 LEU  HN           75 LEU  HB+         5.50    (#   2084:20  Unique         2.47, 3.16 A)
 &rst
  ixpk= 2084, nxpk= 20, iat=1180,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1184,1185,
 &end
#
#   75 LEU  HN           75 LEU  HB-         5.50    (#   2085:20  Unique         2.47, 3.16 A)
 &rst
  ixpk= 2085, nxpk= 20, iat=1180,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1184,1185,
 &end
#
#    0 AMB  20-2:2086    75 LEU  HB-         4.40    (#   2086:20  Single Ambig)
 &rst
  ixpk= 2086, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1199,1223,
 igr2=1184,1185,
 &end
#
#    0 AMB  20-2:2087     0 AMB  20-1:2087   5.50    (#   2087:20  Double Ambig)
 &rst
  ixpk= 2087, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1199,1223,
 igr2=1184,1185,1184,1185,
 &end
#
#    0 AMB  20-2:2089     0 AMB  20-1:2089   2.60    (#   2089:20  Double Ambig)
 &rst
  ixpk= 2089, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1187,1586,1587,
 igr2=1184,1185,1184,1185,
 &end
#
#    0 AMB  20-2:2090    75 LEU  HB-         2.60    (#   2090:20  Single Ambig)
 &rst
  ixpk= 2090, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1187,1586,1587,
 igr2=1184,1185,
 &end
#
#   75 LEU  MDX          75 LEU  HB+         2.60    (#   2091:20  Unique         1.99, 3.28 A)
 &rst
  ixpk= 2091, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1189,1190,1191,1193,1194,1195,
 igr2=1184,1185,
 &end
#
#   75 LEU  MDX          75 LEU  HB-         2.60    (#   2092:20  Unique         1.99, 3.28 A)
 &rst
  ixpk= 2092, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1189,1190,1191,1193,1194,1195,
 igr2=1184,1185,
 &end
#
#    0 AMB  20-2:2093    75 LEU  HG          2.60    (#   2093:20  Single Ambig)
 &rst
  ixpk= 2093, nxpk= 20, iat=  -1,1187, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1189,1190,1191,1193,1194,1195,1189,1190,1191,1193,
      1194,1195,
 &end
#
#    0 AMB  20-2:2094     0 AMB  20-1:2094   3.50    (#   2094:20  Double Ambig)
 &rst
  ixpk= 2094, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2480,2481,1125,1126,
 igr2=2496,2497,2496,2497,
 &end
#
#  147 VAL  HA           75 LEU  HG          5.50    (#   2095:20  Unique         4.21, 4.73 A)
 &rst
  ixpk= 2095, nxpk= 20, iat=2439,1187, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:2097    75 LEU  HG          5.50    (#   2097:20  Single Ambig)
 &rst
  ixpk= 2097, nxpk= 20, iat=  -1,1187, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1199,1223,
 &end
#
#   75 LEU  HN           75 LEU  HG          3.50    (#   2098:20  Unique         1.93, 2.20 A)
 &rst
  ixpk= 2098, nxpk= 20, iat=1180,1187, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   75 LEU  HN           75 LEU  MDX         3.50    (#   2099:20  Unique         2.44, 4.10 A)
 &rst
  ixpk= 2099, nxpk= 20, iat=1180,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#   99 TRP  HE1          75 LEU  MDX         3.50    (#   2100:20  Unique         1.97, 5.14 A)
 &rst
  ixpk= 2100, nxpk= 20, iat=1631,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#   76 ARG  HN           75 LEU  MDX         4.40    (#   2101:20  Unique         4.43, 6.14 A)
 &rst
  ixpk= 2101, nxpk= 20, iat=1199,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2102    75 LEU  MDX         4.40    (#   2102:20  Single Ambig)
 &rst
  ixpk= 2102, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1156,1142,2470,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  147 VAL  HN           75 LEU  MDX         4.40    (#   2103:20  Unique         2.52, 4.36 A)
 &rst
  ixpk= 2103, nxpk= 20, iat=2437,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2104    75 LEU  MDX         4.40    (#   2104:20  Single Ambig)
 &rst
  ixpk= 2104, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1621,2352,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  146 ARG  HN           75 LEU  MDX         4.40    (#   2105:20  Unique         3.72, 5.56 A)
 &rst
  ixpk= 2105, nxpk= 20, iat=2413,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#   99 TRP  HD1          75 LEU  MDX         2.60    (#   2106:20  Unique         2.00, 4.80 A)
 &rst
  ixpk= 2106, nxpk= 20, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2108    75 LEU  MDX         3.50    (#   2108:20  Single Ambig)
 &rst
  ixpk= 2108, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1158,1108,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#   71 THR  HA           75 LEU  MDX         5.50    (#   2109:20  Unique         5.77, 7.29 A)
 &rst
  ixpk= 2109, nxpk= 20, iat=1106,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  143 VAL  HA           75 LEU  MDX         4.40    (#   2110:20  Unique         2.12, 4.21 A)
 &rst
  ixpk= 2110, nxpk= 20, iat=2354,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  146 ARG  HD+          75 LEU  MDX         3.50    (#   2111:20  Unique         3.97, 5.99 A)
 &rst
  ixpk= 2111, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2423,2424,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2112    75 LEU  MDX         5.50    (#   2112:20  Single Ambig)
 &rst
  ixpk= 2112, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1146,1147,1625,1626,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  147 VAL  HA           75 LEU  MDX         3.50    (#   2113:20  Unique         2.57, 4.70 A)
 &rst
  ixpk= 2113, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2114    75 LEU  MDX         4.40    (#   2114:20  Single Ambig)
 &rst
  ixpk= 2114, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=1586,1587,2499,2500,1589,1590,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  143 VAL  HB           75 LEU  MDX         4.40    (#   2115:20  Unique         2.61, 5.45 A)
 &rst
  ixpk= 2115, nxpk= 20, iat=2356,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2116    75 LEU  MDX         2.60    (#   2116:20  Single Ambig)
 &rst
  ixpk= 2116, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=2417,2418,1187,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#   75 LEU  HB-          75 LEU  MDX         2.60    (#   2117:20  Unique         1.99, 3.28 A)
 &rst
  ixpk= 2117, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1184,1185,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  147 VAL  MGX          75 LEU  MDX         4.40    (#   2118:20  Unique         1.93, 5.77 A)
 &rst
  ixpk= 2118, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  147 VAL  MGY          75 LEU  MDX         2.60    (#   2119:20  Unique         1.93, 5.77 A)
 &rst
  ixpk= 2119, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  147 VAL  MGY          75 LEU  MDY         2.60    (#   2120:20  Unique         1.93, 5.77 A)
 &rst
  ixpk= 2120, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#   75 LEU  HB-          75 LEU  MDY         2.60    (#   2121:20  Unique         1.99, 3.28 A)
 &rst
  ixpk= 2121, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1184,1185,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2122    75 LEU  MDY         2.60    (#   2122:20  Single Ambig)
 &rst
  ixpk= 2122, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=2417,2418,1187,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  147 VAL  HA           75 LEU  MDY         4.40    (#   2123:20  Unique         2.57, 4.70 A)
 &rst
  ixpk= 2123, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  146 ARG  HD+          75 LEU  MDY         3.50    (#   2124:20  Unique         3.97, 5.99 A)
 &rst
  ixpk= 2124, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2423,2424,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  143 VAL  HA           75 LEU  MDY         4.40    (#   2125:20  Unique         2.12, 4.21 A)
 &rst
  ixpk= 2125, nxpk= 20, iat=2354,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2126    75 LEU  MDY         4.40    (#   2126:20  Single Ambig)
 &rst
  ixpk= 2126, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1158,1108,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  147 VAL  HN           75 LEU  MDY         4.40    (#   2127:20  Unique         2.52, 4.36 A)
 &rst
  ixpk= 2127, nxpk= 20, iat=2437,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    0 AMB  20-2:2128     0 AMB  20-1:2128   5.50    (#   2128:20  Double Ambig)
 &rst
  ixpk= 2128, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=1621,1083,2352,
 igr2=1189,1190,1191,1193,1194,1195,1073,1074,1075,1077,
      1078,1079,
 &end
#
#   75 LEU  HN           75 LEU  MDY         4.40    (#   2129:20  Unique         2.44, 4.10 A)
 &rst
  ixpk= 2129, nxpk= 20, iat=1180,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#   99 TRP  HE1          75 LEU  MDY         5.50    (#   2130:20  Unique         1.97, 5.14 A)
 &rst
  ixpk= 2130, nxpk= 20, iat=1631,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#   76 ARG  HG+          76 ARG  HA          5.50    (#   2131:20  Unique         2.35, 3.74 A)
 &rst
  ixpk= 2131, nxpk= 20, iat=  -1,1201, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1206,1207,
 &end
#
#   76 ARG  HN           76 ARG  HA          3.50    (#   2132:20  Unique         2.91, 2.94 A)
 &rst
  ixpk= 2132, nxpk= 20, iat=1199,1201, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   84 VAL  MGX          84 VAL  HB          2.60    (#   2133:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2133, nxpk= 20, iat=  -1,1368, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2134     0 AMB  20-1:2134   2.60    (#   2134:20  Double Ambig)
 &rst
  ixpk= 2134, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.99, r4= 5.74,
 igr1=1567,1568,1567,1568,1370,1371,1372,1374,1375,1376,
      
 igr2=1203,1204,1203,1204,1368,
 &end
#
#    0 AMB  20-2:2135    76 ARG  HB-         5.50    (#   2135:20  Single Ambig)
 &rst
  ixpk= 2135, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1206,1207,1570,1571,
 igr2=1203,1204,
 &end
#
#    0 AMB  20-2:2137     0 AMB  20-1:2137   2.60    (#   2137:20  Double Ambig)
 &rst
  ixpk= 2137, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1206,1207,2218,2219,
 igr2=1203,1204,2221,2222,
 &end
#
#    0 AMB  20-2:2138     0 AMB  20-1:2138   2.60    (#   2138:20  Double Ambig)
 &rst
  ixpk= 2138, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1206,1207,2218,2219,
 igr2=1203,1204,2167,2168,2221,2222,
 &end
#
#  135 GLN  HB+         135 GLN  HG+         3.50    (#   2139:20  Unique         2.32, 2.55 A)
 &rst
  ixpk= 2139, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2218,2219,
 igr2=2221,2222,
 &end
#
#    0 AMB  20-2:2140     0 AMB  20-1:2140   3.50    (#   2140:20  Double Ambig)
 &rst
  ixpk= 2140, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2218,2219,2218,2219,
 igr2=2167,2168,2221,2222,
 &end
#
#    0 AMB  20-2:2141     0 AMB  20-1:2141   3.50    (#   2141:20  Double Ambig)
 &rst
  ixpk= 2141, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1209,1210,2170,
 igr2=1203,1204,2221,2222,2167,2168,
 &end
#
#    0 AMB  20-2:2142     0 AMB  20-1:2142   5.50    (#   2142:20  Double Ambig)
 &rst
  ixpk= 2142, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1209,1210,2170,
 igr2=1203,1204,2221,2222,
 &end
#
#    0 AMB  20-2:2143     0 AMB  20-1:2143   4.40    (#   2143:20  Double Ambig)
 &rst
  ixpk= 2143, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1366, 514, 515,
 igr2=1368,2221,2222,
 &end
#
#   81 LYS  HA           84 VAL  HB          4.40    (#   2144:20  Unique         2.08, 2.33 A)
 &rst
  ixpk= 2144, nxpk= 20, iat=1301,1368, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:2145     0 AMB  20-1:2145   5.50    (#   2145:20  Double Ambig)
 &rst
  ixpk= 2145, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2216,2192,
 igr2=2221,2222,2221,2222,
 &end
#
#    0 AMB  20-2:2146     0 AMB  20-1:2146   5.50    (#   2146:20  Double Ambig)
 &rst
  ixpk= 2146, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2216,2192,
 igr2=2221,2222,2167,2168,
 &end
#
#    0 AMB  20-2:2147     0 AMB  20-1:2147   2.60    (#   2147:20  Double Ambig)
 &rst
  ixpk= 2147, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2214,1364,
 igr2=2221,2222,1368,
 &end
#
#  135 GLN  HN            0 AMB  20-1:2148   3.50    (#   2148:20  Single Ambig)
 &rst
  ixpk= 2148, nxpk= 20, iat=2214,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2221,2222,2167,2168,
 &end
#
#  135 GLN  HE2-        135 GLN  HG+         4.40    (#   2149:20  Unique         2.13, 3.19 A)
 &rst
  ixpk= 2149, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2226,2227,
 igr2=2221,2222,
 &end
#
#    0 AMB  20-2:2150     0 AMB  20-1:2150   4.40    (#   2150:20  Double Ambig)
 &rst
  ixpk= 2150, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=2226,2227,2376,2385,
 igr2=2221,2222,2167,2168,
 &end
#
#   86 TRP  HZ2          84 VAL  HB          4.60    (#   2151:20  Unique         2.41, 2.47 A)
 &rst
  ixpk= 2151, nxpk= 20, iat=1417,1368, r1= 0.00, r2= 1.80, r3= 4.60, r4= 5.35,  &end
#
#    0 AMB  20-2:2152     0 AMB  20-1:2152   4.40    (#   2152:20  Double Ambig)
 &rst
  ixpk= 2152, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1199,1223,
 igr2=1203,1204,1203,1204,
 &end
#
#    0 AMB  20-2:2153    76 ARG  HB-         4.40    (#   2153:20  Single Ambig)
 &rst
  ixpk= 2153, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1199,1223,
 igr2=1203,1204,
 &end
#
#   86 TRP  HE1          84 VAL  HB          4.40    (#   2154:20  Unique         3.07, 3.18 A)
 &rst
  ixpk= 2154, nxpk= 20, iat=1414,1368, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   24 TRP  HZ2         135 GLN  HB-         5.50    (#   2155:20  Unique         4.48, 8.71 A)
 &rst
  ixpk= 2155, nxpk= 20, iat= 369,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2218,2219,
 &end
#
#   76 ARG  HN           76 ARG  HD+         4.40    (#   2158:20  Unique         3.55, 4.36 A)
 &rst
  ixpk= 2158, nxpk= 20, iat=1199,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1209,1210,
 &end
#
#   77 TYR  HN           76 ARG  HD-         5.50    (#   2159:20  Unique         1.88, 4.11 A)
 &rst
  ixpk= 2159, nxpk= 20, iat=1223,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1209,1210,
 &end
#
#    7 TYR  HD           76 ARG  HD+         5.50    (#   2160:20  Unique         4.08, 7.15 A)
 &rst
  ixpk= 2160, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  91, 100,
 igr2=1209,1210,
 &end
#
#    7 TYR  HE           76 ARG  HD-         5.50    (#   2161:20  Unique         2.49, 6.13 A)
 &rst
  ixpk= 2161, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  93,  98,
 igr2=1209,1210,
 &end
#
#   76 ARG  HA           76 ARG  HD-         5.50    (#   2162:20  Unique         2.37, 4.35 A)
 &rst
  ixpk= 2162, nxpk= 20, iat=1201,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1209,1210,
 &end
#
#   76 ARG  HB+          76 ARG  HD+         3.50    (#   2163:20  Unique         2.00, 3.06 A)
 &rst
  ixpk= 2163, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1203,1204,
 igr2=1209,1210,
 &end
#
#   76 ARG  HB+          76 ARG  HD-         4.40    (#   2164:20  Unique         2.00, 3.06 A)
 &rst
  ixpk= 2164, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1203,1204,
 igr2=1209,1210,
 &end
#
#   76 ARG  HB-          76 ARG  HD-         3.50    (#   2165:20  Unique         2.00, 3.06 A)
 &rst
  ixpk= 2165, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1203,1204,
 igr2=1209,1210,
 &end
#
#    0 AMB  20-2:2166     0 AMB  20-1:2166   2.60    (#   2166:20  Double Ambig)
 &rst
  ixpk= 2166, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1203,1204,1251,1252,
 igr2=1209,1210,1209,1210,
 &end
#
#    0 AMB  20-2:2167     0 AMB  20-1:2167   3.50    (#   2167:20  Double Ambig)
 &rst
  ixpk= 2167, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1206,1207,1570,1571,
 igr2=1209,1210,1209,1210,
 &end
#
#    0 AMB  20-2:2168    76 ARG  HD-         3.50    (#   2168:20  Single Ambig)
 &rst
  ixpk= 2168, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1206,1207,1570,1571,
 igr2=1209,1210,
 &end
#
#   76 ARG  HG+          76 ARG  HD-         3.50    (#   2169:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 2169, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1206,1207,
 igr2=1209,1210,
 &end
#
#  143 VAL  MGY          77 TYR  HA          4.40    (#   2170:20  Unique         6.16, 8.80 A)
 &rst
  ixpk= 2170, nxpk= 20, iat=  -1,1225, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#   78 LYS  HD+          77 TYR  HA          4.40    (#   2171:20  Unique         2.60, 3.89 A)
 &rst
  ixpk= 2171, nxpk= 20, iat=  -1,1225, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1254,1255,
 &end
#
#   77 TYR  HB-          77 TYR  HA          2.60    (#   2172:20  Unique         2.38, 2.47 A)
 &rst
  ixpk= 2172, nxpk= 20, iat=  -1,1225, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1227,1228,
 &end
#
#    0 AMB  20-2:2173    77 TYR  HA          2.60    (#   2173:20  Single Ambig)
 &rst
  ixpk= 2173, nxpk= 20, iat=  -1,1225, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1227,1228,1227,1228,
 &end
#
#   77 TYR  HE           77 TYR  HA          5.50    (#   2175:20  Unique         4.33, 6.28 A)
 &rst
  ixpk= 2175, nxpk= 20, iat=  -1,1225, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1233,1238,
 &end
#
#    0 AMB  20-2:2176    77 TYR  HA          2.60    (#   2176:20  Single Ambig)
 &rst
  ixpk= 2176, nxpk= 20, iat=  -1,1225, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1244,1223,
 &end
#
#    0 AMB  20-2:2177    77 TYR  HB-         5.50    (#   2177:20  Single Ambig)
 &rst
  ixpk= 2177, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2358,2359,2360,2362,2363,2364,1189,1190,1191,1193,
      1194,1195,
 igr2=1227,1228,
 &end
#
#    0 AMB  20-2:2178     0 AMB  20-1:2178   5.50    (#   2178:20  Double Ambig)
 &rst
  ixpk= 2178, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1550,1551,1209,1210,
 igr2=1227,1228,1227,1228,
 &end
#
#   77 TYR  HA           77 TYR  HB+         3.50    (#   2179:20  Unique         2.38, 2.47 A)
 &rst
  ixpk= 2179, nxpk= 20, iat=1225,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1227,1228,
 &end
#
#   77 TYR  HA           77 TYR  HB-         3.50    (#   2180:20  Unique         2.38, 2.47 A)
 &rst
  ixpk= 2180, nxpk= 20, iat=1225,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1227,1228,
 &end
#
#   77 TYR  HE           77 TYR  HB-         4.40    (#   2181:20  Unique         4.62, 5.05 A)
 &rst
  ixpk= 2181, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1233,1238,
 igr2=1227,1228,
 &end
#
#    0 AMB  20-2:2184    77 TYR  HB-         3.50    (#   2184:20  Single Ambig)
 &rst
  ixpk= 2184, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1244,1223,
 igr2=1227,1228,
 &end
#
#   78 LYS  HN           77 TYR  HB+         3.50    (#   2185:20  Unique         2.07, 3.42 A)
 &rst
  ixpk= 2185, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1227,1228,
 &end
#
#    0 AMB  20-2:2186     0 AMB  20-1:2186   5.50    (#   2186:20  Double Ambig)
 &rst
  ixpk= 2186, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1634,2274,
 igr2=1227,1228,1227,1228,
 &end
#
#   94 GLY  HA-          77 TYR  HB+         5.50    (#   2187:20  Unique         4.75, 8.18 A)
 &rst
  ixpk= 2187, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1538,1539,
 igr2=1227,1228,
 &end
#
#    0 AMB  20-2:2188     0 AMB  20-1:2188   5.50    (#   2188:20  Double Ambig)
 &rst
  ixpk= 2188, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1=2358,2359,2360,2362,2363,2364,1189,1190,1191,1193,
      1194,1195,
 igr2=1227,1228,1227,1228,
 &end
#
#   78 LYS  HN           78 LYS  HA          3.50    (#   2190:20  Unique         2.90, 2.93 A)
 &rst
  ixpk= 2190, nxpk= 20, iat=1244,1246, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   78 LYS  HB+          78 LYS  HA          5.50    (#   2191:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 2191, nxpk= 20, iat=  -1,1246, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1248,1249,
 &end
#
#   78 LYS  HG+          78 LYS  HA          5.50    (#   2192:20  Unique         2.44, 3.02 A)
 &rst
  ixpk= 2192, nxpk= 20, iat=  -1,1246, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1251,1252,
 &end
#
#    0 AMB  20-2:2193    78 LYS  HA          3.50    (#   2193:20  Single Ambig)
 &rst
  ixpk= 2193, nxpk= 20, iat=  -1,1246, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1248,1249,1254,1255,
 &end
#
#   78 LYS  HG-          78 LYS  HA          5.50    (#   2194:20  Unique         2.44, 3.02 A)
 &rst
  ixpk= 2194, nxpk= 20, iat=  -1,1246, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1251,1252,
 &end
#
#    0 AMB  20-2:2195     0 AMB  20-1:2195   5.50    (#   2195:20  Double Ambig)
 &rst
  ixpk= 2195, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.41, r4=11.16,
 igr1=1275,1276,1277,1279,1280,1281,1745,1746,1747,1749,
      1750,1751, 227, 228, 229, 224, 225,1693,1694,1695,
      1697,1698,1699,
 igr2=1246,1722,
 &end
#
#   66 ARG  HG-          66 ARG  HB+         2.60    (#   2196:20  Unique         2.26, 2.61 A)
 &rst
  ixpk= 2196, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1028,1029,
 igr2=1025,1026,
 &end
#
#   78 LYS  HG-          78 LYS  HB+         3.50    (#   2197:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 2197, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1251,1252,
 igr2=1248,1249,
 &end
#
#   78 LYS  HG+          78 LYS  HB+         2.60    (#   2198:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 2198, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1251,1252,
 igr2=1248,1249,
 &end
#
#    0 AMB  20-2:2199     0 AMB  20-1:2199   2.60    (#   2199:20  Double Ambig)
 &rst
  ixpk= 2199, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1251,1252,2026,2027,
 igr2=1248,1249,2023,2024,
 &end
#
#   78 LYS  HE+          78 LYS  HB-         4.40    (#   2201:20  Unique         2.29, 3.75 A)
 &rst
  ixpk= 2201, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1257,1258,
 igr2=1248,1249,
 &end
#
#    0 AMB  20-2:2202     0 AMB  20-1:2202   5.50    (#   2202:20  Double Ambig)
 &rst
  ixpk= 2202, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2098,2099, 237, 238,2119,2120,
 igr2= 313, 314, 313, 314, 313, 314,
 &end
#
#   90 PRO  HD+          90 PRO  HB-         3.50    (#   2203:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2203, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1477,1478,
 igr2=1483,1484,
 &end
#
#    0 AMB  20-2:2204     0 AMB  20-1:2204   2.60    (#   2204:20  Double Ambig)
 &rst
  ixpk= 2204, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1486,1246,
 igr2=1483,1484,1248,1249,
 &end
#
#   78 LYS  HA           78 LYS  HB-         2.60    (#   2205:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 2205, nxpk= 20, iat=1246,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1248,1249,
 &end
#
#   77 TYR  HA           78 LYS  HB+         5.50    (#   2206:20  Unique         4.64, 5.21 A)
 &rst
  ixpk= 2206, nxpk= 20, iat=1225,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1248,1249,
 &end
#
#   77 TYR  HA           78 LYS  HB-         5.50    (#   2207:20  Unique         4.64, 5.21 A)
 &rst
  ixpk= 2207, nxpk= 20, iat=1225,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1248,1249,
 &end
#
#   79 LEU  HN           78 LYS  HB+         5.50    (#   2208:20  Unique         2.82, 3.45 A)
 &rst
  ixpk= 2208, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1248,1249,
 &end
#
#   79 LEU  HN           78 LYS  HB-         3.50    (#   2209:20  Unique         2.82, 3.45 A)
 &rst
  ixpk= 2209, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1248,1249,
 &end
#
#  126 TRP  HN          125 ARG  HB-         4.40    (#   2210:20  Unique         3.14, 4.05 A)
 &rst
  ixpk= 2210, nxpk= 20, iat=2043,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2023,2024,
 &end
#
#   78 LYS  HN           78 LYS  HB-         3.50    (#   2211:20  Unique         2.56, 3.17 A)
 &rst
  ixpk= 2211, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1248,1249,
 &end
#
#   78 LYS  HN           78 LYS  HB+         3.50    (#   2212:20  Unique         2.56, 3.17 A)
 &rst
  ixpk= 2212, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1248,1249,
 &end
#
#   78 LYS  HN           78 LYS  HG+         5.50    (#   2215:20  Unique         2.08, 3.45 A)
 &rst
  ixpk= 2215, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1251,1252,
 &end
#
#    0 AMB  20-2:2217     0 AMB  20-1:2217   5.50    (#   2217:20  Double Ambig)
 &rst
  ixpk= 2217, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 786,1266,1995, 748,
 igr2= 793, 794,1251,1252,2026,2027,
 &end
#
#   60 LEU  HN           54 LEU  HG          5.50    (#   2218:20  Unique         2.45, 2.97 A)
 &rst
  ixpk= 2218, nxpk= 20, iat= 917, 832, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:2219     0 AMB  20-1:2219   4.40    (#   2219:20  Double Ambig)
 &rst
  ixpk= 2219, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.63, r4= 9.38,
 igr1= 189, 190, 926, 927, 928, 930, 931, 932, 926, 927,
       928, 930, 931, 932, 192, 193, 194,1527,1528,
 igr2= 832,1251,1252,
 &end
#
#   78 LYS  HB+          78 LYS  HG+         2.60    (#   2220:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 2220, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1248,1249,
 igr2=1251,1252,
 &end
#
#   78 LYS  HA           78 LYS  HG+         4.40    (#   2221:20  Unique         2.44, 3.02 A)
 &rst
  ixpk= 2221, nxpk= 20, iat=1246,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1251,1252,
 &end
#
#   19 GLN  HE2+         18 ARG  HB-         5.50    (#   2223:20  Unique         1.98, 3.35 A)
 &rst
  ixpk= 2223, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 294, 295,
 igr2= 262, 263,
 &end
#
#  159 GLN  HE2-         18 ARG  HB-         5.50    (#   2224:20  Unique         8.06, 9.22 A)
 &rst
  ixpk= 2224, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2639,2640,
 igr2= 262, 263,
 &end
#
#   78 LYS  HA           78 LYS  HD+         3.50    (#   2225:20  Unique         2.57, 4.23 A)
 &rst
  ixpk= 2225, nxpk= 20, iat=1246,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1254,1255,
 &end
#
#    0 AMB  20-2:2227     0 AMB  20-1:2227   2.60    (#   2227:20  Double Ambig)
 &rst
  ixpk= 2227, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1251,1252, 265, 266,
 igr2=1254,1255, 262, 263,
 &end
#
#    0 AMB  20-2:2228     0 AMB  20-1:2228   4.40    (#   2228:20  Double Ambig)
 &rst
  ixpk= 2228, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.66, r4=10.41,
 igr1=2617,2618,2619,2621,2622,2623,1370,1371,1372,1374,
      1375,1376,1527,1528,
 igr2= 262, 263,1384,1385,1309,1310,1254,1255,
 &end
#
#    0 AMB  20-2:2229     0 AMB  20-1:2229   4.40    (#   2229:20  Double Ambig)
 &rst
  ixpk= 2229, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.60, r4=10.35,
 igr1=1496,1497,1498,1500,1501,1502,1189,1190,1191,1193,
      1194,1195,2180,2181,2182,2184,2185,2186,
 igr2=1467,1468,2483,2484,2483,2484,
 &end
#
#    0 AMB  20-2:2230     0 AMB  20-1:2230   2.60    (#   2230:20  Double Ambig)
 &rst
  ixpk= 2230, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.60, r4= 6.35,
 igr1=2477,2478,1251,1252, 793, 794,1464,1465,2711,2712,
      
 igr2=2483,2484,1257,1258, 796, 797,1467,1468,2714,2715,
      
 &end
#
#    0 AMB  20-2:2231     0 AMB  20-1:2231   2.60    (#   2231:20  Double Ambig)
 &rst
  ixpk= 2231, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.60, r4= 6.35,
 igr1= 790, 791,2477,2478,2705,2706, 793, 794,2480,2481,
      
 igr2= 796, 797,2483,2484,2714,2715, 796, 797,2483,2484,
      
 &end
#
#    0 AMB  20-2:2232     0 AMB  20-1:2232   2.60    (#   2232:20  Double Ambig)
 &rst
  ixpk= 2232, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 790, 791,2474,2475,
 igr2= 796, 797,2483,2484,
 &end
#
#    0 AMB  20-2:2233     0 AMB  20-1:2233   4.40    (#   2233:20  Double Ambig)
 &rst
  ixpk= 2233, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2415,1538,1539,
 igr2=2483,2484,1257,1258,
 &end
#
#   79 LEU  HN           79 LEU  HA          4.40    (#   2235:20  Unique         2.91, 2.93 A)
 &rst
  ixpk= 2235, nxpk= 20, iat=1266,1268, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:2237    79 LEU  HA          5.50    (#   2237:20  Single Ambig)
 &rst
  ixpk= 2237, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1555,1556,2282,2290,
 &end
#
#   80 PRO  HD+          79 LEU  HA          2.60    (#   2238:20  Unique         2.25, 2.29 A)
 &rst
  ixpk= 2238, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1286,1287,
 &end
#
#   80 PRO  HD-          79 LEU  HA          3.50    (#   2239:20  Unique         2.25, 2.29 A)
 &rst
  ixpk= 2239, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1286,1287,
 &end
#
#   80 PRO  HB+          79 LEU  HA          5.50    (#   2240:20  Unique         4.83, 5.19 A)
 &rst
  ixpk= 2240, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1292,1293,
 &end
#
#   80 PRO  HG+          79 LEU  HA          5.50    (#   2241:20  Unique         4.39, 4.43 A)
 &rst
  ixpk= 2241, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1289,1290,
 &end
#
#    0 AMB  20-2:2242    79 LEU  HA          4.40    (#   2242:20  Single Ambig)
 &rst
  ixpk= 2242, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1248,1249,1292,1293,1254,1255,
 &end
#
#   79 LEU  HG           79 LEU  HA          4.40    (#   2243:20  Unique         3.45, 3.58 A)
 &rst
  ixpk= 2243, nxpk= 20, iat=1273,1268, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   79 LEU  HB+          79 LEU  HA          3.50    (#   2244:20  Unique         2.23, 2.46 A)
 &rst
  ixpk= 2244, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1270,1271,
 &end
#
#    0 AMB  20-2:2245    79 LEU  HA          3.50    (#   2245:20  Single Ambig)
 &rst
  ixpk= 2245, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,1275,1276,1277,1279,1280,1281,
 &end
#
#   79 LEU  MDX          79 LEU  HA          4.40    (#   2246:20  Unique         3.42, 4.71 A)
 &rst
  ixpk= 2246, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#   79 LEU  MDX          79 LEU  HB+         3.50    (#   2247:20  Unique         1.96, 3.26 A)
 &rst
  ixpk= 2247, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1270,1271,
 &end
#
#   79 LEU  MDX          79 LEU  HB-         2.60    (#   2248:20  Unique         1.96, 3.26 A)
 &rst
  ixpk= 2248, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1270,1271,
 &end
#
#    0 AMB  20-2:2249     0 AMB  20-1:2249   2.60    (#   2249:20  Double Ambig)
 &rst
  ixpk= 2249, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=1275,1276,1277,1279,1280,1281,1354,1355,1356,1358,
      1359,1360,1354,1355,1356,1358,1359,1360,1370,1371,
      1372,1374,1375,1376,
 igr2=1270,1271,1270,1271,1270,1271,1270,1271,
 &end
#
#    0 AMB  20-2:2250    79 LEU  HB-         2.60    (#   2250:20  Single Ambig)
 &rst
  ixpk= 2250, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1275,1276,1277,1279,1280,1281,1354,1355,1356,1358,
      1359,1360,1354,1355,1356,1358,1359,1360,
 igr2=1270,1271,
 &end
#
#   79 LEU  HG           79 LEU  HB+         3.50    (#   2251:20  Unique         2.41, 2.76 A)
 &rst
  ixpk= 2251, nxpk= 20, iat=1273,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1270,1271,
 &end
#
#   79 LEU  HG           79 LEU  HB-         3.50    (#   2252:20  Unique         2.41, 2.76 A)
 &rst
  ixpk= 2252, nxpk= 20, iat=1273,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1270,1271,
 &end
#
#   83 LEU  HB+          79 LEU  HB-         5.50    (#   2253:20  Unique         1.99, 3.56 A)
 &rst
  ixpk= 2253, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1349,1350,
 igr2=1270,1271,
 &end
#
#   83 LEU  HB-          79 LEU  HB+         5.50    (#   2254:20  Unique         1.99, 3.56 A)
 &rst
  ixpk= 2254, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1349,1350,
 igr2=1270,1271,
 &end
#
#   79 LEU  HA           79 LEU  HB+         4.40    (#   2255:20  Unique         2.23, 2.46 A)
 &rst
  ixpk= 2255, nxpk= 20, iat=1268,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1270,1271,
 &end
#
#   79 LEU  HN           79 LEU  HB+         4.40    (#   2256:20  Unique         3.10, 3.39 A)
 &rst
  ixpk= 2256, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1270,1271,
 &end
#
#   79 LEU  HN           79 LEU  HB-         4.40    (#   2257:20  Unique         3.10, 3.39 A)
 &rst
  ixpk= 2257, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1270,1271,
 &end
#
#   79 LEU  HN           79 LEU  HG          3.50    (#   2258:20  Unique         1.90, 1.98 A)
 &rst
  ixpk= 2258, nxpk= 20, iat=1266,1273, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   77 TYR  HE           79 LEU  HG          5.50    (#   2259:20  Unique         3.92, 6.35 A)
 &rst
  ixpk= 2259, nxpk= 20, iat=  -1,1273, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1233,1238,
 &end
#
#    0 AMB  20-2:2260    79 LEU  HG          3.50    (#   2260:20  Single Ambig)
 &rst
  ixpk= 2260, nxpk= 20, iat=  -1,1273, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1268,1538,1539,
 &end
#
#    0 AMB  20-2:2261    79 LEU  HG          4.40    (#   2261:20  Single Ambig)
 &rst
  ixpk= 2261, nxpk= 20, iat=  -1,1273, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1538,1539,1301,
 &end
#
#   79 LEU  HB-          79 LEU  HG          3.50    (#   2263:20  Unique         2.41, 2.76 A)
 &rst
  ixpk= 2263, nxpk= 20, iat=  -1,1273, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1270,1271,
 &end
#
#   79 LEU  MDY          79 LEU  HG          2.60    (#   2264:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 2264, nxpk= 20, iat=  -1,1273, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#   79 LEU  MDX          79 LEU  HG          2.60    (#   2265:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 2265, nxpk= 20, iat=  -1,1273, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#   84 VAL  MGX          79 LEU  MDX         4.40    (#   2266:20  Unique         1.98, 4.89 A)
 &rst
  ixpk= 2266, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=1370,1371,1372,1374,1375,1376,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   91 VAL  MGX          79 LEU  MDX         4.40    (#   2267:20  Unique         3.94, 7.21 A)
 &rst
  ixpk= 2267, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=1496,1497,1498,1500,1501,1502,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2269     0 AMB  20-1:2269   2.60    (#   2269:20  Double Ambig)
 &rst
  ixpk= 2269, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.95, r4= 6.70,
 igr1=1011,1012,1013,1015,1016,1017,1370,1371,1372,1374,
      1375,1376,
 igr2=1693,1694,1695,1697,1698,1699,1275,1276,1277,1279,
      1280,1281,
 &end
#
#    0 AMB  20-2:2270     0 AMB  20-1:2270   2.60    (#   2270:20  Double Ambig)
 &rst
  ixpk= 2270, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=1270,1271,1688,1689,
 igr2=1275,1276,1277,1279,1280,1281,1693,1694,1695,1697,
      1698,1699,
 &end
#
#   79 LEU  HG           79 LEU  MDX         2.60    (#   2271:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 2271, nxpk= 20, iat=1273,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2272   102 LEU  MDX         2.60    (#   2272:20  Single Ambig)
 &rst
  ixpk= 2272, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1691, 755, 756,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:2273   102 LEU  MDX         2.60    (#   2273:20  Single Ambig)
 &rst
  ixpk= 2273, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1055,1056,1688,1689,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:2274     0 AMB  20-1:2274   3.50    (#   2274:20  Double Ambig)
 &rst
  ixpk= 2274, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1049,1521, 218,
 igr2=1693,1694,1695,1697,1698,1699,1275,1276,1277,1279,
      1280,1281,
 &end
#
#  100 PHE  HB+         102 LEU  MDX         3.50    (#   2275:20  Unique         1.97, 4.34 A)
 &rst
  ixpk= 2275, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1649,1650,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:2276    79 LEU  MDX         5.50    (#   2276:20  Single Ambig)
 &rst
  ixpk= 2276, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1227,1228,1286,1287,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   84 VAL  HA           79 LEU  MDX         3.50    (#   2277:20  Unique         3.21, 4.95 A)
 &rst
  ixpk= 2277, nxpk= 20, iat=1366,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   93 ILE  HA           79 LEU  MDX         3.50    (#   2278:20  Unique         3.36, 5.44 A)
 &rst
  ixpk= 2278, nxpk= 20, iat=1519,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   94 GLY  HA-          79 LEU  MDX         4.40    (#   2279:20  Unique         3.24, 5.88 A)
 &rst
  ixpk= 2279, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1538,1539,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   67 ILE  HA          102 LEU  MDX         2.60    (#   2280:20  Unique         1.91, 4.17 A)
 &rst
  ixpk= 2280, nxpk= 20, iat=1047,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:2281     0 AMB  20-1:2281   4.40    (#   2281:20  Double Ambig)
 &rst
  ixpk= 2281, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=1295,1347,1066,
 igr2=1275,1276,1277,1279,1280,1281,1693,1694,1695,1697,
      1698,1699,
 &end
#
#  102 LEU  HA          102 LEU  MDX         2.60    (#   2283:20  Unique         1.98, 4.38 A)
 &rst
  ixpk= 2283, nxpk= 20, iat=1686,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:2284     0 AMB  20-1:2284   3.50    (#   2284:20  Double Ambig)
 &rst
  ixpk= 2284, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1653,1661,1364,
 igr2=1693,1694,1695,1697,1698,1699,1275,1276,1277,1279,
      1280,1281,
 &end
#
#    0 AMB  20-2:2285     0 AMB  20-1:2285   4.40    (#   2285:20  Double Ambig)
 &rst
  ixpk= 2285, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=1083,2352,
 igr2=1693,1694,1695,1697,1698,1699,2301,2302,
 &end
#
#   79 LEU  HN           79 LEU  MDX         3.50    (#   2286:20  Unique         1.94, 3.65 A)
 &rst
  ixpk= 2286, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2287     0 AMB  20-1:2287   4.40    (#   2287:20  Double Ambig)
 &rst
  ixpk= 2287, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=1380,2263,
 igr2=1275,1276,1277,1279,1280,1281,2301,2302,
 &end
#
#    0 AMB  20-2:2288     0 AMB  20-1:2288   4.40    (#   2288:20  Double Ambig)
 &rst
  ixpk= 2288, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.61, r4= 9.36,
 igr1=1645,1517,1223,1720,
 igr2=1693,1694,1695,1697,1698,1699,1275,1276,1277,1279,
      1280,1281,2301,2302,
 &end
#
#    0 AMB  20-2:2289   102 LEU  MDX         3.50    (#   2289:20  Single Ambig)
 &rst
  ixpk= 2289, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1045,1703,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   68 LEU  HN          102 LEU  MDX         3.50    (#   2290:20  Unique         2.60, 5.62 A)
 &rst
  ixpk= 2290, nxpk= 20, iat=1064,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#  102 LEU  HN          102 LEU  MDX         4.40    (#   2291:20  Unique         2.35, 4.04 A)
 &rst
  ixpk= 2291, nxpk= 20, iat=1684,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   79 LEU  HN           79 LEU  MDY         3.50    (#   2292:20  Unique         1.94, 3.65 A)
 &rst
  ixpk= 2292, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   95 GLN  HE2+         79 LEU  MDY         4.40    (#   2293:20  Unique         2.50, 5.13 A)
 &rst
  ixpk= 2293, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1555,1556,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   84 VAL  HN           79 LEU  MDY         3.50    (#   2295:20  Unique         3.90, 5.70 A)
 &rst
  ixpk= 2295, nxpk= 20, iat=1364,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   77 TYR  HE           79 LEU  MDY         3.50    (#   2296:20  Unique         2.92, 7.57 A)
 &rst
  ixpk= 2296, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1233,1238,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   78 LYS  HA           79 LEU  MDY         5.50    (#   2297:20  Unique         3.16, 5.34 A)
 &rst
  ixpk= 2297, nxpk= 20, iat=1246,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2298    79 LEU  MDY         3.50    (#   2298:20  Single Ambig)
 &rst
  ixpk= 2298, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1538,1539,1268,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2299    79 LEU  MDY         4.40    (#   2299:20  Single Ambig)
 &rst
  ixpk= 2299, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1538,1539,1301,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2300    79 LEU  MDY         2.90    (#   2300:20  Single Ambig)
 &rst
  ixpk= 2300, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.93, r4= 5.68,
 igr1=1227,1228,1286,1287,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   80 PRO  HD+          79 LEU  MDY         3.50    (#   2301:20  Unique         4.07, 5.84 A)
 &rst
  ixpk= 2301, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1286,1287,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   84 VAL  HA           79 LEU  MDY         4.40    (#   2302:20  Unique         3.21, 4.95 A)
 &rst
  ixpk= 2302, nxpk= 20, iat=1366,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2303    79 LEU  MDY         5.50    (#   2303:20  Single Ambig)
 &rst
  ixpk= 2303, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1550,1551,1209,1210,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   79 LEU  HG           79 LEU  MDY         2.60    (#   2305:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 2305, nxpk= 20, iat=1273,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   79 LEU  HB-          79 LEU  MDY         2.60    (#   2306:20  Unique         1.96, 3.26 A)
 &rst
  ixpk= 2306, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1270,1271,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   79 LEU  HB+          79 LEU  MDY         2.60    (#   2307:20  Unique         1.96, 3.26 A)
 &rst
  ixpk= 2307, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1270,1271,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2310    80 PRO  HA          5.50    (#   2310:20  Single Ambig)
 &rst
  ixpk= 2310, nxpk= 20, iat=  -1,1295, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1306,1307,1328,1329,1368,
 &end
#
#   80 PRO  HB-          80 PRO  HA          2.60    (#   2311:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2311, nxpk= 20, iat=  -1,1295, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1292,1293,
 &end
#
#    0 AMB  20-2:2312    80 PRO  HA          4.40    (#   2312:20  Single Ambig)
 &rst
  ixpk= 2312, nxpk= 20, iat=  -1,1295, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1303,1304,1303,1304,1325,1326,
 &end
#
#   80 PRO  HB+          80 PRO  HA          2.60    (#   2313:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2313, nxpk= 20, iat=  -1,1295, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1292,1293,
 &end
#
#   80 PRO  HD-          80 PRO  HA          5.50    (#   2314:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 2314, nxpk= 20, iat=  -1,1295, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1286,1287,
 &end
#
#   81 LYS  HA           80 PRO  HA          5.50    (#   2315:20  Unique         4.31, 4.31 A)
 &rst
  ixpk= 2315, nxpk= 20, iat=1301,1295, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  106 SER  HN          105 VAL  HA          4.40    (#   2316:20  Unique         3.45, 3.53 A)
 &rst
  ixpk= 2316, nxpk= 20, iat=1755,1741, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   81 LYS  HN           80 PRO  HA          2.60    (#   2317:20  Unique         2.33, 2.40 A)
 &rst
  ixpk= 2317, nxpk= 20, iat=1299,1295, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   81 LYS  HN           80 PRO  HB+         3.50    (#   2318:20  Unique         2.38, 3.04 A)
 &rst
  ixpk= 2318, nxpk= 20, iat=1299,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1292,1293,
 &end
#
#   81 LYS  HN           80 PRO  HB-         3.50    (#   2319:20  Unique         2.38, 3.04 A)
 &rst
  ixpk= 2319, nxpk= 20, iat=1299,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1292,1293,
 &end
#
#   80 PRO  HA           80 PRO  HB-         2.60    (#   2320:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2320, nxpk= 20, iat=1295,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1292,1293,
 &end
#
#   80 PRO  HA           80 PRO  HB+         2.60    (#   2321:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2321, nxpk= 20, iat=1295,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1292,1293,
 &end
#
#   80 PRO  HD-          80 PRO  HB+         5.50    (#   2322:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2322, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1286,1287,
 igr2=1292,1293,
 &end
#
#   80 PRO  HD+          80 PRO  HB+         5.50    (#   2323:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2323, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1286,1287,
 igr2=1292,1293,
 &end
#
#   80 PRO  HD-          80 PRO  HB-         5.50    (#   2324:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2324, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1286,1287,
 igr2=1292,1293,
 &end
#
#    0 AMB  20-2:2325     0 AMB  20-1:2325   3.50    (#   2325:20  Double Ambig)
 &rst
  ixpk= 2325, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1292,1293,1292,1293,
 &end
#
#    0 AMB  20-2:2326    80 PRO  HB-         3.50    (#   2326:20  Single Ambig)
 &rst
  ixpk= 2326, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,1275,1276,1277,1279,1280,1281,
 igr2=1292,1293,
 &end
#
#    0 AMB  20-2:2327     0 AMB  20-1:2327   3.50    (#   2327:20  Double Ambig)
 &rst
  ixpk= 2327, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1289,1290,1289,1290,
 &end
#
#    0 AMB  20-2:2328     0 AMB  20-1:2328   3.50    (#   2328:20  Double Ambig)
 &rst
  ixpk= 2328, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 igr2=2396,2397,2396,2397,
 &end
#
#    0 AMB  20-2:2329     0 AMB  20-1:2329   2.60    (#   2329:20  Double Ambig)
 &rst
  ixpk= 2329, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1331,1332,2423,2424,
 igr2=1289,1290,2420,2421,
 &end
#
#   80 PRO  HB+          80 PRO  HG+         2.60    (#   2330:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 2330, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1292,1293,
 igr2=1289,1290,
 &end
#
#   80 PRO  HB+          80 PRO  HG-         2.60    (#   2331:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 2331, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1292,1293,
 igr2=1289,1290,
 &end
#
#    0 AMB  20-2:2332     0 AMB  20-1:2332   3.50    (#   2332:20  Double Ambig)
 &rst
  ixpk= 2332, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1295,1347,2342,
 igr2=1289,1290,1289,1290,2420,2421,
 &end
#
#  145 ARG  HA          145 ARG  HG+         3.50    (#   2333:20  Unique         2.11, 2.72 A)
 &rst
  ixpk= 2333, nxpk= 20, iat=2391,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2396,2397,
 &end
#
#  145 ARG  HN          145 ARG  HG+         4.40    (#   2334:20  Unique         2.79, 3.96 A)
 &rst
  ixpk= 2334, nxpk= 20, iat=2389,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2396,2397,
 &end
#
#    0 AMB  20-2:2335     0 AMB  20-1:2335   5.50    (#   2335:20  Double Ambig)
 &rst
  ixpk= 2335, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1490,1506,
 igr2=1477,1478,1477,1478,
 &end
#
#   90 PRO  HA           90 PRO  HD+         3.50    (#   2337:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 2337, nxpk= 20, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1477,1478,
 &end
#
#   89 LYS  HA           90 PRO  HD+         4.00    (#   2338:20  Unique         2.49, 2.63 A)
 &rst
  ixpk= 2338, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 4.49, r4= 5.24,
 igr2=1477,1478,
 &end
#
#   90 PRO  HB+          90 PRO  HD+         3.50    (#   2339:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2339, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1483,1484,
 igr2=1477,1478,
 &end
#
#    0 AMB  20-2:2340     0 AMB  20-1:2340   2.60    (#   2340:20  Double Ambig)
 &rst
  ixpk= 2340, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1480,1481,1483,1484,
 igr2=1477,1478,1477,1478,
 &end
#
#   89 LYS  HB+          90 PRO  HD+         3.80    (#   2341:20  Unique         1.58, 3.00 A)
 &rst
  ixpk= 2341, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.79, r4= 5.54,
 igr1=1458,1459,
 igr2=1477,1478,
 &end
#
#   90 PRO  HG-          90 PRO  HD+         2.60    (#   2342:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2342, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1480,1481,
 igr2=1477,1478,
 &end
#
#    2 ILE  QD1          90 PRO  HD+         5.50    (#   2343:20  Unique         5.26, 6.35 A)
 &rst
  ixpk= 2343, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=  34,  35,  36,
 igr2=1477,1478,
 &end
#
#   84 VAL  MGX          81 LYS  HA          4.40    (#   2344:20  Unique         1.92, 3.95 A)
 &rst
  ixpk= 2344, nxpk= 20, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   84 VAL  MGY          81 LYS  HA          2.60    (#   2345:20  Unique         1.92, 3.95 A)
 &rst
  ixpk= 2345, nxpk= 20, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2346    81 LYS  HA          2.60    (#   2346:20  Single Ambig)
 &rst
  ixpk= 2346, nxpk= 20, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1368,1306,1307,
 &end
#
#    0 AMB  20-2:2347    81 LYS  HA          4.40    (#   2347:20  Single Ambig)
 &rst
  ixpk= 2347, nxpk= 20, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1309,1310,1292,1293,
 &end
#
#    0 AMB  20-2:2348    81 LYS  HA          2.60    (#   2348:20  Single Ambig)
 &rst
  ixpk= 2348, nxpk= 20, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1303,1304,1303,1304,
 &end
#
#   80 PRO  HB+          81 LYS  HA          5.50    (#   2349:20  Unique         4.56, 5.25 A)
 &rst
  ixpk= 2349, nxpk= 20, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1292,1293,
 &end
#
#    0 AMB  20-2:2351    81 LYS  HA          4.40    (#   2351:20  Single Ambig)
 &rst
  ixpk= 2351, nxpk= 20, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1295,1347,
 &end
#
#    0 AMB  20-2:2352    81 LYS  HA          4.40    (#   2352:20  Single Ambig)
 &rst
  ixpk= 2352, nxpk= 20, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1364,1419,
 &end
#
#   86 TRP  HZ2          81 LYS  HA          4.40    (#   2353:20  Unique         1.97, 2.30 A)
 &rst
  ixpk= 2353, nxpk= 20, iat=1417,1301, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   83 LEU  HN           81 LYS  HA          5.50    (#   2354:20  Unique         3.43, 3.55 A)
 &rst
  ixpk= 2354, nxpk= 20, iat=1345,1301, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   81 LYS  HN           81 LYS  HA          3.50    (#   2355:20  Unique         2.76, 2.81 A)
 &rst
  ixpk= 2355, nxpk= 20, iat=1299,1301, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 TRP  HE1          81 LYS  HA          5.50    (#   2356:20  Unique         2.74, 3.36 A)
 &rst
  ixpk= 2356, nxpk= 20, iat=1414,1301, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   79 LEU  MDX          81 LYS  HG+         5.50    (#   2358:20  Unique         5.74, 8.97 A)
 &rst
  ixpk= 2358, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1306,1307,
 &end
#
#    0 AMB  20-2:2359     0 AMB  20-1:2359   2.60    (#   2359:20  Double Ambig)
 &rst
  ixpk= 2359, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 790, 791,1309,1310,2480,2481,
 igr2= 793, 794,1306,1307,2477,2478,
 &end
#
#   81 LYS  HE+          81 LYS  HG+         3.50    (#   2361:20  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2361, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1312,1313,
 igr2=1306,1307,
 &end
#
#    0 AMB  20-2:2362     0 AMB  20-1:2362   5.50    (#   2362:20  Double Ambig)
 &rst
  ixpk= 2362, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1366,1408,1409,
 igr2=1306,1307,1306,1307,
 &end
#
#   81 LYS  HA           81 LYS  HG+         3.50    (#   2363:20  Unique         2.36, 2.98 A)
 &rst
  ixpk= 2363, nxpk= 20, iat=1301,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1306,1307,
 &end
#
#   81 LYS  HN           81 LYS  HG+         3.51    (#   2365:20  Unique         2.35, 3.35 A)
 &rst
  ixpk= 2365, nxpk= 20, iat=1299,  -1, r1= 0.00, r2= 1.80, r3= 3.94, r4= 4.69,
 igr2=1306,1307,
 &end
#
#   81 LYS  HN           81 LYS  HD+         4.40    (#   2366:20  Unique         1.88, 3.14 A)
 &rst
  ixpk= 2366, nxpk= 20, iat=1299,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1309,1310,
 &end
#
#   81 LYS  HA           81 LYS  HD+         4.40    (#   2368:20  Unique         3.12, 4.41 A)
 &rst
  ixpk= 2368, nxpk= 20, iat=1301,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1309,1310,
 &end
#
#    0 AMB  20-2:2369     0 AMB  20-1:2369   4.40    (#   2369:20  Double Ambig)
 &rst
  ixpk= 2369, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=1567,1568,1527,1528,
 igr2=1257,1258,1257,1258,
 &end
#
#    0 AMB  20-2:2370     0 AMB  20-1:2370   2.60    (#   2370:20  Double Ambig)
 &rst
  ixpk= 2370, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.20, r4= 5.95,
 igr1=2477,2478,1251,1252,1306,1307, 793, 794,
 igr2=2483,2484,1257,1258,1312,1313, 796, 797,
 &end
#
#   81 LYS  HN           81 LYS  HE+         5.50    (#   2371:20  Unique         1.94, 4.13 A)
 &rst
  ixpk= 2371, nxpk= 20, iat=1299,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1312,1313,
 &end
#
#   82 ARG  HN           82 ARG  HA          2.80    (#   2372:20  Unique         2.77, 2.80 A)
 &rst
  ixpk= 2372, nxpk= 20, iat=1321,1323, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   83 LEU  HN           82 ARG  HA          3.50    (#   2373:20  Unique         3.30, 3.41 A)
 &rst
  ixpk= 2373, nxpk= 20, iat=1345,1323, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   84 VAL  HN           82 ARG  HA          4.40    (#   2375:20  Unique         3.84, 4.21 A)
 &rst
  ixpk= 2375, nxpk= 20, iat=1364,1323, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  119 PRO  HD+         118 THR  HA          2.60    (#   2376:20  Unique         1.92, 2.17 A)
 &rst
  ixpk= 2376, nxpk= 20, iat=  -1,1915, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1928,1929,
 &end
#
#  119 PRO  HD-         118 THR  HA          2.60    (#   2377:20  Unique         1.92, 2.17 A)
 &rst
  ixpk= 2377, nxpk= 20, iat=  -1,1915, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1928,1929,
 &end
#
#   82 ARG  HB+          82 ARG  HA          2.60    (#   2378:20  Unique         2.27, 2.46 A)
 &rst
  ixpk= 2378, nxpk= 20, iat=  -1,1323, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1325,1326,
 &end
#
#   82 ARG  HB-          82 ARG  HA          2.60    (#   2379:20  Unique         2.27, 2.46 A)
 &rst
  ixpk= 2379, nxpk= 20, iat=  -1,1323, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1325,1326,
 &end
#
#    0 AMB  20-2:2380     0 AMB  20-1:2380   3.50    (#   2380:20  Double Ambig)
 &rst
  ixpk= 2380, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1306,1307,1328,1329,1931,1932,
 igr2=1323,1915,
 &end
#
#  118 THR  MG2         118 THR  HA          3.50    (#   2381:20  Unique         2.25, 2.88 A)
 &rst
  ixpk= 2381, nxpk= 20, iat=  -1,1915, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1919,1920,1921,
 &end
#
#    0 AMB  20-2:2382     0 AMB  20-1:2382   4.40    (#   2382:20  Double Ambig)
 &rst
  ixpk= 2382, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1325,1326,1325,1326,
 &end
#
#    0 AMB  20-2:2383    82 ARG  HB-         5.50    (#   2383:20  Single Ambig)
 &rst
  ixpk= 2383, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1325,1326,
 &end
#
#  149 LYS  HE+         149 LYS  HD+         2.60    (#   2384:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 2384, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2483,2484,
 igr2=2480,2481,
 &end
#
#   82 ARG  HD+          82 ARG  HB-         2.60    (#   2385:20  Unique         1.99, 3.21 A)
 &rst
  ixpk= 2385, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1331,1332,
 igr2=1325,1326,
 &end
#
#    0 AMB  20-2:2386     0 AMB  20-1:2386   3.50    (#   2386:20  Double Ambig)
 &rst
  ixpk= 2386, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2415,2541,2542,
 igr2=2480,2481,2480,2481,
 &end
#
#    0 AMB  20-2:2387     0 AMB  20-1:2387   5.50    (#   2387:20  Double Ambig)
 &rst
  ixpk= 2387, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1759,1760,2494,
 igr2=1799,1800,2480,2481,
 &end
#
#   82 ARG  HA           82 ARG  HB-         2.60    (#   2388:20  Unique         2.27, 2.46 A)
 &rst
  ixpk= 2388, nxpk= 20, iat=1323,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1325,1326,
 &end
#
#    0 AMB  20-2:2391     0 AMB  20-1:2391   4.40    (#   2391:20  Double Ambig)
 &rst
  ixpk= 2391, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1345,2673,
 igr2=1325,1326, 262, 263,
 &end
#
#   83 LEU  HN           82 ARG  HB-         5.50    (#   2392:20  Unique         3.67, 4.10 A)
 &rst
  ixpk= 2392, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1325,1326,
 &end
#
#   82 ARG  HN           82 ARG  HB-         2.60    (#   2393:20  Unique         2.53, 3.17 A)
 &rst
  ixpk= 2393, nxpk= 20, iat=1321,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1325,1326,
 &end
#
#   82 ARG  HN           82 ARG  HG-         3.50    (#   2394:20  Unique         2.00, 2.31 A)
 &rst
  ixpk= 2394, nxpk= 20, iat=1321,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1328,1329,
 &end
#
#   83 LEU  HN           82 ARG  HG+         4.40    (#   2395:20  Unique         2.20, 3.20 A)
 &rst
  ixpk= 2395, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1328,1329,
 &end
#
#    0 AMB  20-2:2397     0 AMB  20-1:2397   3.50    (#   2397:20  Double Ambig)
 &rst
  ixpk= 2397, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1323,2233,
 igr2=1328,1329,2323,2324,
 &end
#
#   82 ARG  HB+          82 ARG  HG+         2.60    (#   2398:20  Unique         2.23, 2.71 A)
 &rst
  ixpk= 2398, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1325,1326,
 igr2=1328,1329,
 &end
#
#    0 AMB  20-2:2399     0 AMB  20-1:2399   2.60    (#   2399:20  Double Ambig)
 &rst
  ixpk= 2399, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1325,1326,1864,1865,
 igr2=1328,1329,1931,1932,
 &end
#
#    0 AMB  20-2:2400     0 AMB  20-1:2400   2.60    (#   2400:20  Double Ambig)
 &rst
  ixpk= 2400, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1328,1329,1328,1329,
 &end
#
#   82 ARG  HB+          82 ARG  HD+         2.60    (#   2402:20  Unique         1.99, 3.21 A)
 &rst
  ixpk= 2402, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1325,1326,
 igr2=1331,1332,
 &end
#
#    0 AMB  20-2:2403     0 AMB  20-1:2403   2.60    (#   2403:20  Double Ambig)
 &rst
  ixpk= 2403, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1325,1326,1122,1123,
 igr2=1331,1332,1128,1129,
 &end
#
#   82 ARG  HG+          82 ARG  HD+         2.60    (#   2404:20  Unique         2.22, 2.62 A)
 &rst
  ixpk= 2404, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1328,1329,
 igr2=1331,1332,
 &end
#
#   82 ARG  HA           82 ARG  HD+         4.40    (#   2405:20  Unique         4.45, 5.01 A)
 &rst
  ixpk= 2405, nxpk= 20, iat=1323,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1331,1332,
 &end
#
#   73 ASN  HD2+         72 ARG  HD+         5.50    (#   2406:20  Unique         3.37, 5.25 A)
 &rst
  ixpk= 2406, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1151,1152,
 igr2=1128,1129,
 &end
#
#   83 LEU  HN           83 LEU  HA          3.50    (#   2407:20  Unique         2.93, 2.94 A)
 &rst
  ixpk= 2407, nxpk= 20, iat=1345,1347, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   84 VAL  HN           83 LEU  HA          3.50    (#   2408:20  Unique         3.27, 3.37 A)
 &rst
  ixpk= 2408, nxpk= 20, iat=1364,1347, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   83 LEU  HB+          83 LEU  HA          2.60    (#   2410:20  Unique         2.26, 2.70 A)
 &rst
  ixpk= 2410, nxpk= 20, iat=  -1,1347, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1349,1350,
 &end
#
#   83 LEU  HG           83 LEU  HA          3.50    (#   2411:20  Unique         2.20, 3.04 A)
 &rst
  ixpk= 2411, nxpk= 20, iat=1352,1347, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2412    83 LEU  HA          2.60    (#   2412:20  Single Ambig)
 &rst
  ixpk= 2412, nxpk= 20, iat=  -1,1347, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1349,1350,1328,1329,
 &end
#
#    0 AMB  20-2:2414    83 LEU  HA          2.60    (#   2414:20  Single Ambig)
 &rst
  ixpk= 2414, nxpk= 20, iat=  -1,1347, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 &end
#
#   79 LEU  MDX          83 LEU  HA          4.40    (#   2415:20  Unique         4.96, 6.72 A)
 &rst
  ixpk= 2415, nxpk= 20, iat=  -1,1347, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2416     0 AMB  20-1:2416   2.60    (#   2416:20  Double Ambig)
 &rst
  ixpk= 2416, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,1275,1276,1277,1279,1280,1281,
 igr2=1349,1350,1349,1350,1349,1350,
 &end
#
#    0 AMB  20-2:2417    83 LEU  HB-         2.60    (#   2417:20  Single Ambig)
 &rst
  ixpk= 2417, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,1275,1276,1277,1279,1280,1281,
 igr2=1349,1350,
 &end
#
#   79 LEU  MDX          83 LEU  HB+         5.50    (#   2418:20  Unique         2.31, 4.73 A)
 &rst
  ixpk= 2418, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1349,1350,
 &end
#
#   79 LEU  MDX          83 LEU  HB-         3.50    (#   2419:20  Unique         2.31, 4.73 A)
 &rst
  ixpk= 2419, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1349,1350,
 &end
#
#   82 ARG  HD+          83 LEU  HB+         5.50    (#   2420:20  Unique         4.52, 5.71 A)
 &rst
  ixpk= 2420, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1331,1332,
 igr2=1349,1350,
 &end
#
#   83 LEU  HA           83 LEU  HB+         3.50    (#   2421:20  Unique         2.26, 2.70 A)
 &rst
  ixpk= 2421, nxpk= 20, iat=1347,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1349,1350,
 &end
#
#   83 LEU  HA           83 LEU  HB-         3.50    (#   2422:20  Unique         2.26, 2.70 A)
 &rst
  ixpk= 2422, nxpk= 20, iat=1347,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1349,1350,
 &end
#
#   84 VAL  HN           83 LEU  HB-         5.50    (#   2423:20  Unique         3.16, 3.75 A)
 &rst
  ixpk= 2423, nxpk= 20, iat=1364,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1349,1350,
 &end
#
#   83 LEU  HN           83 LEU  HB+         3.50    (#   2424:20  Unique         2.26, 3.18 A)
 &rst
  ixpk= 2424, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1349,1350,
 &end
#
#   83 LEU  HN           83 LEU  HB-         3.50    (#   2425:20  Unique         2.26, 3.18 A)
 &rst
  ixpk= 2425, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1349,1350,
 &end
#
#   82 ARG  HN           83 LEU  HG          4.40    (#   2426:20  Unique         3.86, 4.74 A)
 &rst
  ixpk= 2426, nxpk= 20, iat=1321,1352, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   92 CYS  HB-           2 ILE  HG1-        5.50    (#   2427:20  Unique         1.94, 2.90 A)
 &rst
  ixpk= 2427, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1510,1511,
 igr2=  31,  32,
 &end
#
#   83 LEU  HN           83 LEU  MDX         3.50    (#   2429:20  Unique         2.75, 4.38 A)
 &rst
  ixpk= 2429, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   82 ARG  HN           83 LEU  MDX         5.50    (#   2430:20  Unique         3.79, 5.97 A)
 &rst
  ixpk= 2430, nxpk= 20, iat=1321,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   84 VAL  HN           83 LEU  MDX         5.50    (#   2432:20  Unique         4.58, 5.77 A)
 &rst
  ixpk= 2432, nxpk= 20, iat=1364,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   83 LEU  HA           83 LEU  MDX         3.50    (#   2434:20  Unique         2.28, 4.04 A)
 &rst
  ixpk= 2434, nxpk= 20, iat=1347,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   79 LEU  HA           83 LEU  MDX         3.50    (#   2435:20  Unique         3.21, 5.51 A)
 &rst
  ixpk= 2435, nxpk= 20, iat=1268,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#    0 AMB  20-2:2436    83 LEU  MDX         5.50    (#   2436:20  Single Ambig)
 &rst
  ixpk= 2436, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1366,2278,2279,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   80 PRO  HD+          83 LEU  MDX         3.50    (#   2437:20  Unique         1.94, 4.33 A)
 &rst
  ixpk= 2437, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1286,1287,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#    0 AMB  20-2:2438     0 AMB  20-1:2438   3.50    (#   2438:20  Double Ambig)
 &rst
  ixpk= 2438, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=1286,1287,2278,2279,
 igr2=1354,1355,1356,1358,1359,1360,2301,2302,
 &end
#
#  140 LYS  HE-          83 LEU  MDX         5.50    (#   2439:20  Unique         7.42,11.47 A)
 &rst
  ixpk= 2439, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2307,2308,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   80 PRO  HB+          83 LEU  MDX         4.40    (#   2440:20  Unique         3.83, 5.97 A)
 &rst
  ixpk= 2440, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1292,1293,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   83 LEU  HB+          83 LEU  MDX         2.60    (#   2441:20  Unique         2.12, 3.26 A)
 &rst
  ixpk= 2441, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1349,1350,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   83 LEU  HG           83 LEU  MDX         2.60    (#   2442:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 2442, nxpk= 20, iat=1352,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   83 LEU  HG           83 LEU  MDY         2.60    (#   2444:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 2444, nxpk= 20, iat=1352,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   83 LEU  HB+          83 LEU  MDY         2.60    (#   2445:20  Unique         2.12, 3.26 A)
 &rst
  ixpk= 2445, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1349,1350,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   82 ARG  HB+          83 LEU  MDY         3.50    (#   2446:20  Unique         2.15, 5.76 A)
 &rst
  ixpk= 2446, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1325,1326,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   83 LEU  HA           83 LEU  MDY         2.60    (#   2447:20  Unique         2.28, 4.04 A)
 &rst
  ixpk= 2447, nxpk= 20, iat=1347,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   83 LEU  HN           83 LEU  MDY         3.50    (#   2448:20  Unique         2.75, 4.38 A)
 &rst
  ixpk= 2448, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   82 ARG  HN           83 LEU  MDY         5.50    (#   2449:20  Unique         3.79, 5.97 A)
 &rst
  ixpk= 2449, nxpk= 20, iat=1321,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#   85 ARG  HN           84 VAL  HA          2.60    (#   2451:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 2451, nxpk= 20, iat=1380,1366, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  112 ASN  HN          111 ILE  HA          2.60    (#   2452:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 2452, nxpk= 20, iat=1829,1812, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  111 ILE  HN          111 ILE  HA          3.50    (#   2453:20  Unique         2.74, 2.77 A)
 &rst
  ixpk= 2453, nxpk= 20, iat=1810,1812, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   85 ARG  HA           84 VAL  HA          5.50    (#   2454:20  Unique         4.38, 4.39 A)
 &rst
  ixpk= 2454, nxpk= 20, iat=1382,1366, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   84 VAL  HB           84 VAL  HA          3.50    (#   2455:20  Unique         2.99, 3.01 A)
 &rst
  ixpk= 2455, nxpk= 20, iat=1368,1366, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2456    84 VAL  HA          3.50    (#   2456:20  Single Ambig)
 &rst
  ixpk= 2456, nxpk= 20, iat=  -1,1366, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1349,1350,1384,1385,
 &end
#
#  111 ILE  HG1-        111 ILE  HA          4.40    (#   2457:20  Unique         2.46, 2.78 A)
 &rst
  ixpk= 2457, nxpk= 20, iat=  -1,1812, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1820,1821,
 &end
#
#   79 LEU  MDX          84 VAL  HA          3.50    (#   2458:20  Unique         3.21, 4.95 A)
 &rst
  ixpk= 2458, nxpk= 20, iat=  -1,1366, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  20-2:2459     0 AMB  20-1:2459   2.60    (#   2459:20  Double Ambig)
 &rst
  ixpk= 2459, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1= 900, 901, 902, 904, 905, 906,1370,1371,1372,1374,
      1375,1376,
 igr2=1812,1366,
 &end
#
#    0 AMB  20-2:2460     0 AMB  20-1:2460   3.50    (#   2460:20  Double Ambig)
 &rst
  ixpk= 2460, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1496,1497,1498,1500,1501,1502,1820,1821,
 igr2=1366,1812,
 &end
#
#  111 ILE  QG2         111 ILE  HA          3.50    (#   2461:20  Unique         2.32, 3.11 A)
 &rst
  ixpk= 2461, nxpk= 20, iat=  -1,1812, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1816,1817,1818,
 &end
#
#   84 VAL  MGX          84 VAL  HA          2.60    (#   2462:20  Unique         2.41, 3.12 A)
 &rst
  ixpk= 2462, nxpk= 20, iat=  -1,1366, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   83 LEU  HN           84 VAL  HB          5.50    (#   2464:20  Unique         4.20, 4.43 A)
 &rst
  ixpk= 2464, nxpk= 20, iat=1345,1368, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   86 TRP  HE1          84 VAL  MGX         3.50    (#   2465:20  Unique         3.98, 5.29 A)
 &rst
  ixpk= 2465, nxpk= 20, iat=1414,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   93 ILE  HN           84 VAL  MGX         5.50    (#   2466:20  Unique         5.04, 6.45 A)
 &rst
  ixpk= 2466, nxpk= 20, iat=1517,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   85 ARG  HN           84 VAL  MGX         2.60    (#   2467:20  Unique         2.19, 4.35 A)
 &rst
  ixpk= 2467, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   86 TRP  HN           84 VAL  MGX         4.40    (#   2468:20  Unique         4.22, 6.30 A)
 &rst
  ixpk= 2468, nxpk= 20, iat=1404,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   83 LEU  HN           84 VAL  MGX         5.50    (#   2469:20  Unique         3.47, 5.29 A)
 &rst
  ixpk= 2469, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2470    84 VAL  MGX         4.40    (#   2470:20  Single Ambig)
 &rst
  ixpk= 2470, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1423,1536,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   86 TRP  HZ2          84 VAL  MGX         3.50    (#   2471:20  Unique         3.08, 4.03 A)
 &rst
  ixpk= 2471, nxpk= 20, iat=1417,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2472    84 VAL  MGX         3.50    (#   2472:20  Single Ambig)
 &rst
  ixpk= 2472, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1364,1419,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2473    84 VAL  MGX         5.50    (#   2473:20  Single Ambig)
 &rst
  ixpk= 2473, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1440,1555,1556,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   93 ILE  HA           84 VAL  MGX         2.60    (#   2474:20  Unique         3.05, 4.29 A)
 &rst
  ixpk= 2474, nxpk= 20, iat=1519,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   85 ARG  HA           84 VAL  MGX         4.40    (#   2475:20  Unique         4.06, 5.96 A)
 &rst
  ixpk= 2475, nxpk= 20, iat=1382,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   81 LYS  HA           84 VAL  MGX         4.40    (#   2477:20  Unique         1.92, 3.95 A)
 &rst
  ixpk= 2477, nxpk= 20, iat=1301,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   91 VAL  HA           84 VAL  MGX         5.50    (#   2478:20  Unique         5.04, 6.66 A)
 &rst
  ixpk= 2478, nxpk= 20, iat=1492,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   84 VAL  HA           84 VAL  MGX         2.60    (#   2479:20  Unique         2.41, 3.12 A)
 &rst
  ixpk= 2479, nxpk= 20, iat=1366,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2480    84 VAL  MGX         3.50    (#   2480:20  Single Ambig)
 &rst
  ixpk= 2480, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1=1494,1384,1385,1309,1310,1292,1293,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   91 VAL  MGY          84 VAL  MGX         3.50    (#   2481:20  Unique         1.88, 4.48 A)
 &rst
  ixpk= 2481, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1496,1497,1498,1500,1501,1502,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   93 ILE  QG2          84 VAL  MGX         2.60    (#   2483:20  Unique         3.22, 5.73 A)
 &rst
  ixpk= 2483, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1523,1524,1525,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   91 VAL  MGX          84 VAL  MGX         2.60    (#   2484:20  Unique         1.88, 4.48 A)
 &rst
  ixpk= 2484, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1496,1497,1498,1500,1501,1502,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2485    84 VAL  MGX         2.60    (#   2485:20  Single Ambig)
 &rst
  ixpk= 2485, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1368,1306,1307,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2486     0 AMB  20-1:2486   2.60    (#   2486:20  Double Ambig)
 &rst
  ixpk= 2486, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1= 832,1368, 224, 225,
 igr2= 900, 901, 902, 904, 905, 906,1370,1371,1372,1374,
      1375,1376,
 &end
#
#    0 AMB  20-2:2487     0 AMB  20-1:2487   2.60    (#   2487:20  Double Ambig)
 &rst
  ixpk= 2487, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.44, r4= 6.19,
 igr1= 829, 830,1303,1304,1303,1304,1009,
 igr2= 900, 901, 902, 904, 905, 906,1370,1371,1372,1374,
      1375,1376,
 &end
#
#   86 TRP  HE1          84 VAL  MGY         4.40    (#   2488:20  Unique         3.98, 5.29 A)
 &rst
  ixpk= 2488, nxpk= 20, iat=1414,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   85 ARG  HN           84 VAL  MGY         3.50    (#   2489:20  Unique         2.19, 4.35 A)
 &rst
  ixpk= 2489, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   81 LYS  HN           84 VAL  MGY         5.50    (#   2490:20  Unique         3.56, 6.08 A)
 &rst
  ixpk= 2490, nxpk= 20, iat=1299,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   93 ILE  HN           84 VAL  MGY         5.50    (#   2491:20  Unique         5.04, 6.45 A)
 &rst
  ixpk= 2491, nxpk= 20, iat=1517,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   79 LEU  HN           84 VAL  MGY         4.70    (#   2492:20  Unique         4.49, 6.23 A)
 &rst
  ixpk= 2492, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 6.34, r4= 7.09,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   83 LEU  HN           84 VAL  MGY         4.40    (#   2493:20  Unique         3.47, 5.29 A)
 &rst
  ixpk= 2493, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   86 TRP  HZ2          84 VAL  MGY         2.60    (#   2494:20  Unique         3.08, 4.03 A)
 &rst
  ixpk= 2494, nxpk= 20, iat=1417,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2496    84 VAL  MGY         5.50    (#   2496:20  Single Ambig)
 &rst
  ixpk= 2496, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1423,1536,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2497     0 AMB  20-1:2497   4.40    (#   2497:20  Double Ambig)
 &rst
  ixpk= 2497, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1=2515,2523,1715,1716,
 igr2=2554,2555,2556,2558,2559,2560, 329, 330, 331, 333,
       334, 335,
 &end
#
#    0 AMB  20-2:2498     0 AMB  20-1:2498   2.60    (#   2498:20  Double Ambig)
 &rst
  ixpk= 2498, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2096,2550,
 igr2= 329, 330, 331, 333, 334, 335,2554,2555,2556,2558,
      2559,2560,
 &end
#
#   84 VAL  MGX          85 ARG  HA          4.40    (#   2499:20  Unique         4.06, 5.96 A)
 &rst
  ixpk= 2499, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   85 ARG  HG-          85 ARG  HA          3.50    (#   2500:20  Unique         2.70, 3.20 A)
 &rst
  ixpk= 2500, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1387,1388,
 &end
#
#    0 AMB  20-2:2501    85 ARG  HA          2.60    (#   2501:20  Single Ambig)
 &rst
  ixpk= 2501, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1384,1385,1387,1388,
 &end
#
#   85 ARG  HB+          85 ARG  HA          2.60    (#   2502:20  Unique         2.59, 2.81 A)
 &rst
  ixpk= 2502, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1384,1385,
 &end
#
#   87 ASP  HB-          85 ARG  HA          4.40    (#   2504:20  Unique         4.54, 5.26 A)
 &rst
  ixpk= 2504, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1432,1433,
 &end
#
#   87 ASP  HB+          85 ARG  HA          4.40    (#   2505:20  Unique         4.54, 5.26 A)
 &rst
  ixpk= 2505, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1432,1433,
 &end
#
#    0 AMB  20-2:2506    85 ARG  HA          4.40    (#   2506:20  Single Ambig)
 &rst
  ixpk= 2506, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1408,1409,1467,1468,
 &end
#
#   85 ARG  HD+          85 ARG  HA          2.60    (#   2507:20  Unique         2.09, 2.65 A)
 &rst
  ixpk= 2507, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1390,1391,
 &end
#
#    0 AMB  20-2:2508    85 ARG  HA          4.40    (#   2508:20  Single Ambig)
 &rst
  ixpk= 2508, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1366,1408,1409,
 &end
#
#   86 TRP  HD1          85 ARG  HA          5.50    (#   2510:20  Unique         3.59, 3.68 A)
 &rst
  ixpk= 2510, nxpk= 20, iat=1412,1382, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   86 TRP  HN           85 ARG  HA          2.60    (#   2511:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 2511, nxpk= 20, iat=1404,1382, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   85 ARG  HN           85 ARG  HA          3.50    (#   2512:20  Unique         2.92, 2.93 A)
 &rst
  ixpk= 2512, nxpk= 20, iat=1380,1382, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   87 ASP  HN           85 ARG  HA          3.50    (#   2513:20  Unique         3.28, 3.34 A)
 &rst
  ixpk= 2513, nxpk= 20, iat=1428,1382, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   85 ARG  HN           85 ARG  HB+         3.50    (#   2514:20  Unique         2.24, 2.94 A)
 &rst
  ixpk= 2514, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1384,1385,
 &end
#
#   85 ARG  HN           85 ARG  HB-         3.50    (#   2515:20  Unique         2.24, 2.94 A)
 &rst
  ixpk= 2515, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1384,1385,
 &end
#
#   87 ASP  HN           85 ARG  HB+         5.50    (#   2516:20  Unique         3.34, 4.20 A)
 &rst
  ixpk= 2516, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1384,1385,
 &end
#
#   87 ASP  HN           85 ARG  HB-         5.50    (#   2517:20  Unique         3.34, 4.20 A)
 &rst
  ixpk= 2517, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1384,1385,
 &end
#
#   85 ARG  HE           85 ARG  HB-         5.50    (#   2518:20  Unique         3.43, 4.30 A)
 &rst
  ixpk= 2518, nxpk= 20, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1384,1385,
 &end
#
#   85 ARG  HE           85 ARG  HB+         5.50    (#   2519:20  Unique         3.43, 4.30 A)
 &rst
  ixpk= 2519, nxpk= 20, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1384,1385,
 &end
#
#   85 ARG  HA           85 ARG  HB+         3.50    (#   2520:20  Unique         2.59, 2.81 A)
 &rst
  ixpk= 2520, nxpk= 20, iat=1382,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1384,1385,
 &end
#
#   85 ARG  HA           85 ARG  HB-         3.50    (#   2521:20  Unique         2.59, 2.81 A)
 &rst
  ixpk= 2521, nxpk= 20, iat=1382,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1384,1385,
 &end
#
#   88 THR  HB           85 ARG  HB+         3.80    (#   2523:20  Unique         3.46, 4.18 A)
 &rst
  ixpk= 2523, nxpk= 20, iat=1444,  -1, r1= 0.00, r2= 1.80, r3= 4.27, r4= 5.02,
 igr2=1384,1385,
 &end
#
#   85 ARG  HD+          85 ARG  HB+         3.50    (#   2524:20  Unique         2.23, 3.31 A)
 &rst
  ixpk= 2524, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1390,1391,
 igr2=1384,1385,
 &end
#
#   76 ARG  HD+          78 LYS  HD+         3.50    (#   2526:20  Unique         2.74, 4.80 A)
 &rst
  ixpk= 2526, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1209,1210,
 igr2=1254,1255,
 &end
#
#   88 THR  MG2          85 ARG  HB+         3.50    (#   2527:20  Unique         1.96, 3.19 A)
 &rst
  ixpk= 2527, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1446,1447,1448,
 igr2=1384,1385,
 &end
#
#   88 THR  MG2          85 ARG  HB-         4.40    (#   2528:20  Unique         1.96, 3.19 A)
 &rst
  ixpk= 2528, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1446,1447,1448,
 igr2=1384,1385,
 &end
#
#   88 THR  MG2          85 ARG  HG+         4.40    (#   2529:20  Unique         3.55, 5.09 A5)
 &rst
  ixpk= 2529, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1446,1447,1448,
 igr2=1387,1388,
 &end
#
#   88 THR  MG2          85 ARG  HG-         3.50    (#   2530:20  Unique         3.55, 5.09 A)
 &rst
  ixpk= 2530, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1446,1447,1448,
 igr2=1387,1388,
 &end
#
#   85 ARG  HB+          85 ARG  HG+         2.60    (#   2531:20  Unique         2.35, 2.59 A)
 &rst
  ixpk= 2531, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1384,1385,
 igr2=1387,1388,
 &end
#
#   85 ARG  HB+          85 ARG  HG-         2.60    (#   2532:20  Unique         2.35, 2.59 A)
 &rst
  ixpk= 2532, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1384,1385,
 igr2=1387,1388,
 &end
#
#   85 ARG  HD+          85 ARG  HG-         2.60    (#   2533:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 2533, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1390,1391,
 igr2=1387,1388,
 &end
#
#   85 ARG  HD+          85 ARG  HG+         2.60    (#   2534:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 2534, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1390,1391,
 igr2=1387,1388,
 &end
#
#   84 VAL  HA           85 ARG  HG-         5.50    (#   2535:20  Unique         4.28, 5.09 A)
 &rst
  ixpk= 2535, nxpk= 20, iat=1366,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1387,1388,
 &end
#
#   84 VAL  HA           85 ARG  HG+         5.50    (#   2536:20  Unique         4.28, 5.09 A)
 &rst
  ixpk= 2536, nxpk= 20, iat=1366,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1387,1388,
 &end
#
#   85 ARG  HA           85 ARG  HG-         2.60    (#   2537:20  Unique         2.70, 3.20 A)
 &rst
  ixpk= 2537, nxpk= 20, iat=1382,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1387,1388,
 &end
#
#   85 ARG  HA           85 ARG  HG+         3.50    (#   2538:20  Unique         2.70, 3.20 A)
 &rst
  ixpk= 2538, nxpk= 20, iat=1382,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1387,1388,
 &end
#
#   85 ARG  HE           85 ARG  HG+         5.50    (#   2539:20  Unique         2.12, 3.36 A)
 &rst
  ixpk= 2539, nxpk= 20, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1387,1388,
 &end
#
#   85 ARG  HE           85 ARG  HG-         4.40    (#   2540:20  Unique         2.12, 3.36 A)
 &rst
  ixpk= 2540, nxpk= 20, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1387,1388,
 &end
#
#   85 ARG  HN           85 ARG  HG+         3.50    (#   2541:20  Unique         2.99, 3.68 A)
 &rst
  ixpk= 2541, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1387,1388,
 &end
#
#   85 ARG  HN           85 ARG  HG-         3.50    (#   2542:20  Unique         2.99, 3.68 A)
 &rst
  ixpk= 2542, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1387,1388,
 &end
#
#   87 ASP  HN           85 ARG  HG+         5.50    (#   2543:20  Unique         5.47, 5.53 A)
 &rst
  ixpk= 2543, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1387,1388,
 &end
#
#   85 ARG  HH2+         85 ARG  HD+         2.60    (#   2544:20  Unique         4.41, 4.68 A)
 &rst
  ixpk= 2544, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1399,1400,
 igr2=1390,1391,
 &end
#
#   85 ARG  HA           85 ARG  HD+         2.60    (#   2545:20  Unique         2.09, 2.65 A)
 &rst
  ixpk= 2545, nxpk= 20, iat=1382,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1390,1391,
 &end
#
#   87 ASP  HN           85 ARG  HD+         4.40    (#   2546:20  Unique         3.18, 4.00 A)
 &rst
  ixpk= 2546, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1390,1391,
 &end
#
#   85 ARG  HN           85 ARG  HD+         4.40    (#   2547:20  Unique         4.40, 4.83 A)
 &rst
  ixpk= 2547, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1390,1391,
 &end
#
#   86 TRP  HN           85 ARG  HD+         3.50    (#   2548:20  Unique         3.41, 4.10 A)
 &rst
  ixpk= 2548, nxpk= 20, iat=1404,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1390,1391,
 &end
#
#   85 ARG  HE           85 ARG  HD+         2.60    (#   2549:20  Unique         2.27, 2.59 A)
 &rst
  ixpk= 2549, nxpk= 20, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1390,1391,
 &end
#
#   85 ARG  HB+          85 ARG  HD+         2.60    (#   2550:20  Unique         2.23, 3.31 A)
 &rst
  ixpk= 2550, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1384,1385,
 igr2=1390,1391,
 &end
#
#   85 ARG  HG+          85 ARG  HD+         2.60    (#   2551:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 2551, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1387,1388,
 igr2=1390,1391,
 &end
#
#   85 ARG  HG-          85 ARG  HD+         2.60    (#   2552:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 2552, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1387,1388,
 igr2=1390,1391,
 &end
#
#   88 THR  MG2          85 ARG  HD+         3.50    (#   2553:20  Unique         3.78, 5.54 A)
 &rst
  ixpk= 2553, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1446,1447,1448,
 igr2=1390,1391,
 &end
#
#   84 VAL  MGX          86 TRP  HA          3.50    (#   2554:20  Unique         4.38, 6.61 A)
 &rst
  ixpk= 2554, nxpk= 20, iat=  -1,1406, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   91 VAL  MGX          86 TRP  HA          3.50    (#   2555:20  Unique         2.30, 4.21 A)
 &rst
  ixpk= 2555, nxpk= 20, iat=  -1,1406, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   91 VAL  MGY          86 TRP  HA          3.50    (#   2556:20  Unique         2.30, 4.21 A)
 &rst
  ixpk= 2556, nxpk= 20, iat=  -1,1406, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   86 TRP  HB-          86 TRP  HA          2.60    (#   2557:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 2557, nxpk= 20, iat=  -1,1406, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1408,1409,
 &end
#
#   86 TRP  HB+          86 TRP  HA          2.60    (#   2558:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 2558, nxpk= 20, iat=  -1,1406, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1408,1409,
 &end
#
#   86 TRP  HD1          86 TRP  HA          4.40    (#   2559:20  Unique         4.34, 4.37 A)
 &rst
  ixpk= 2559, nxpk= 20, iat=1412,1406, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   88 THR  HN           86 TRP  HA          4.40    (#   2560:20  Unique         3.19, 3.22 A)
 &rst
  ixpk= 2560, nxpk= 20, iat=1440,1406, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   86 TRP  HE3          86 TRP  HA          2.60    (#   2561:20  Unique         3.40, 3.46 A)
 &rst
  ixpk= 2561, nxpk= 20, iat=1423,1406, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   86 TRP  HN           86 TRP  HA          3.50    (#   2562:20  Unique         2.91, 2.92 A)
 &rst
  ixpk= 2562, nxpk= 20, iat=1404,1406, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   87 ASP  HN           86 TRP  HA          3.50    (#   2563:20  Unique         3.36, 3.37 A)
 &rst
  ixpk= 2563, nxpk= 20, iat=1428,1406, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 TRP  HE1          86 TRP  HA          5.50    (#   2564:20  Unique         5.86, 5.88 A)
 &rst
  ixpk= 2564, nxpk= 20, iat=1414,1406, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   86 TRP  HN           86 TRP  HB+         3.50    (#   2565:20  Unique         2.89, 3.29 A)
 &rst
  ixpk= 2565, nxpk= 20, iat=1404,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1408,1409,
 &end
#
#   86 TRP  HN           86 TRP  HB-         3.50    (#   2566:20  Unique         2.89, 3.29 A)
 &rst
  ixpk= 2566, nxpk= 20, iat=1404,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1408,1409,
 &end
#
#   86 TRP  HE3          86 TRP  HB-         4.40    (#   2567:20  Unique         2.47, 3.26 A)
 &rst
  ixpk= 2567, nxpk= 20, iat=1423,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1408,1409,
 &end
#
#   86 TRP  HE3          86 TRP  HB+         3.50    (#   2568:20  Unique         2.47, 3.26 A)
 &rst
  ixpk= 2568, nxpk= 20, iat=1423,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1408,1409,
 &end
#
#   86 TRP  HD1          86 TRP  HB+         3.50    (#   2569:20  Unique         2.73, 3.30 A)
 &rst
  ixpk= 2569, nxpk= 20, iat=1412,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1408,1409,
 &end
#
#   86 TRP  HD1          86 TRP  HB-         3.50    (#   2570:20  Unique         2.73, 3.30 A)
 &rst
  ixpk= 2570, nxpk= 20, iat=1412,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1408,1409,
 &end
#
#   85 ARG  HA           86 TRP  HB+         4.40    (#   2571:20  Unique         5.05, 5.36 A)
 &rst
  ixpk= 2571, nxpk= 20, iat=1382,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1408,1409,
 &end
#
#   85 ARG  HA           86 TRP  HB-         4.40    (#   2572:20  Unique         5.05, 5.36 A)
 &rst
  ixpk= 2572, nxpk= 20, iat=1382,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1408,1409,
 &end
#
#   86 TRP  HA           86 TRP  HB+         2.60    (#   2573:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 2573, nxpk= 20, iat=1406,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1408,1409,
 &end
#
#   86 TRP  HA           86 TRP  HB-         2.60    (#   2574:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 2574, nxpk= 20, iat=1406,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1408,1409,
 &end
#
#    0 AMB  20-2:2575     0 AMB  20-1:2575   5.50    (#   2575:20  Double Ambig)
 &rst
  ixpk= 2575, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1494,1384,1385,
 igr2=1408,1409,1408,1409,
 &end
#
#   87 ASP  HN           87 ASP  HB+         3.50    (#   2576:20  Unique         2.12, 2.70 A)
 &rst
  ixpk= 2576, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1432,1433,
 &end
#
#   87 ASP  HN           87 ASP  HB-         3.50    (#   2577:20  Unique         2.12, 2.70 A)
 &rst
  ixpk= 2577, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1432,1433,
 &end
#
#   88 THR  HN           87 ASP  HB+         4.40    (#   2578:20  Unique         3.92, 4.08 A)
 &rst
  ixpk= 2578, nxpk= 20, iat=1440,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1432,1433,
 &end
#
#   28 PHE  HD           28 PHE  HB+         5.50    (#   2579:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 2579, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 446, 454,
 igr2= 442, 443,
 &end
#
#   88 THR  HN           87 ASP  HB-         5.50    (#   2580:20  Unique         3.92, 4.08 A2.6)
 &rst
  ixpk= 2580, nxpk= 20, iat=1440,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1432,1433,
 &end
#
#   87 ASP  HA           87 ASP  HB+         2.60    (#   2581:20  Unique         2.30, 2.83 A)
 &rst
  ixpk= 2581, nxpk= 20, iat=1430,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1432,1433,
 &end
#
#   87 ASP  HA           87 ASP  HB-         2.60    (#   2582:20  Unique         2.30, 2.83 A)
 &rst
  ixpk= 2582, nxpk= 20, iat=1430,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1432,1433,
 &end
#
#    0 AMB  20-2:2583     0 AMB  20-1:2583   5.50    (#   2583:20  Double Ambig)
 &rst
  ixpk= 2583, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.17, r4=10.92,
 igr1=1442,1406, 604, 605,1937,
 igr2=1432,1433,1432,1433, 442, 443, 442, 443,
 &end
#
#   89 LYS  HN           88 THR  HA          2.60    (#   2584:20  Unique         2.89, 2.90 A)
 &rst
  ixpk= 2584, nxpk= 20, iat=1454,1442, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   88 THR  HN           88 THR  HA          3.50    (#   2585:20  Unique         2.92, 2.93 A)
 &rst
  ixpk= 2585, nxpk= 20, iat=1440,1442, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   88 THR  HB           88 THR  HA          2.60    (#   2587:20  Unique         2.48, 2.50 A)
 &rst
  ixpk= 2587, nxpk= 20, iat=1444,1442, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    0 AMB  20-2:2588    88 THR  HA          4.40    (#   2588:20  Single Ambig)
 &rst
  ixpk= 2588, nxpk= 20, iat=  -1,1442, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1458,1459,1458,1459,1387,1388,
 &end
#
#   88 THR  MG2          88 THR  HA          3.50    (#   2589:20  Unique         3.52, 3.90 A)
 &rst
  ixpk= 2589, nxpk= 20, iat=  -1,1442, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1446,1447,1448,
 &end
#
#   88 THR  MG2          88 THR  HB          2.60    (#   2590:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2590, nxpk= 20, iat=  -1,1444, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1446,1447,1448,
 &end
#
#    0 AMB  20-2:2591    88 THR  HB          3.80    (#   2591:20  Single Ambig)
 &rst
  ixpk= 2591, nxpk= 20, iat=  -1,1444, r1= 0.00, r2= 1.80, r3= 5.12, r4= 5.87,
 igr1=1384,1385,1387,1388,1458,1459,
 &end
#
#   89 LYS  HG+          88 THR  HB          5.50    (#   2593:20  Unique         5.50, 6.14 A)
 &rst
  ixpk= 2593, nxpk= 20, iat=  -1,1444, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1461,1462,
 &end
#
#   88 THR  HA           88 THR  HB          2.60    (#   2594:20  Unique         2.48, 2.50 A)
 &rst
  ixpk= 2594, nxpk= 20, iat=1442,1444, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   88 THR  HN           88 THR  HB          3.50    (#   2596:20  Unique         2.88, 3.21 A)
 &rst
  ixpk= 2596, nxpk= 20, iat=1440,1444, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   89 LYS  HN           88 THR  HB          4.10    (#   2597:20  Unique         3.34, 3.35 A)
 &rst
  ixpk= 2597, nxpk= 20, iat=1454,1444, r1= 0.00, r2= 1.80, r3= 4.10, r4= 4.85,  &end
#
#   87 ASP  HN           88 THR  MG2         4.40    (#   2600:20  Unique         3.78, 4.86 A)
 &rst
  ixpk= 2600, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1446,1447,1448,
 &end
#
#    0 AMB  20-2:2601    88 THR  MG2         4.40    (#   2601:20  Single Ambig)
 &rst
  ixpk= 2601, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1490,1380,
 igr2=1446,1447,1448,
 &end
#
#   89 LYS  HN           88 THR  MG2         3.10    (#   2602:20  Unique         2.31, 3.03 A)
 &rst
  ixpk= 2602, nxpk= 20, iat=1454,  -1, r1= 0.00, r2= 1.80, r3= 3.72, r4= 4.47,
 igr2=1446,1447,1448,
 &end
#
#   88 THR  HN           88 THR  MG2         2.60    (#   2603:20  Unique         2.09, 3.24 A)
 &rst
  ixpk= 2603, nxpk= 20, iat=1440,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1446,1447,1448,
 &end
#
#   85 ARG  HE           88 THR  MG2         4.40    (#   2604:20  Unique         4.23, 6.17 A)
 &rst
  ixpk= 2604, nxpk= 20, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1446,1447,1448,
 &end
#
#    0 AMB  20-2:2607    88 THR  MG2         3.93    (#   2607:20  Single Ambig)
 &rst
  ixpk= 2607, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1456,1382,
 igr2=1446,1447,1448,
 &end
#
#    0 AMB  20-2:2608    88 THR  MG2         3.50    (#   2608:20  Single Ambig)
 &rst
  ixpk= 2608, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1442,1406,
 igr2=1446,1447,1448,
 &end
#
#   88 THR  HB           88 THR  MG2         2.60    (#   2609:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2609, nxpk= 20, iat=1444,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1446,1447,1448,
 &end
#
#   91 VAL  HA           88 THR  MG2         5.50    (#   2611:20  Unique         5.27, 5.92 A)
 &rst
  ixpk= 2611, nxpk= 20, iat=1492,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1446,1447,1448,
 &end
#
#  143 VAL  HA          143 VAL  MGX         3.50    (#   2612:20  Unique         2.38, 3.53 A)
 &rst
  ixpk= 2612, nxpk= 20, iat=2354,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   85 ARG  HD+          88 THR  MG2         3.50    (#   2613:20  Unique         3.78, 5.54 A)
 &rst
  ixpk= 2613, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1390,1391,
 igr2=1446,1447,1448,
 &end
#
#   87 ASP  HB-          88 THR  MG2         4.40    (#   2614:20  Unique         5.03, 6.06 A)
 &rst
  ixpk= 2614, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1432,1433,
 igr2=1446,1447,1448,
 &end
#
#   89 LYS  HG-          89 LYS  HA          3.50    (#   2617:20  Unique         3.44, 3.71 A)
 &rst
  ixpk= 2617, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1461,1462,
 &end
#
#   89 LYS  HG+          89 LYS  HA          3.50    (#   2618:20  Unique         3.44, 3.71 A)
 &rst
  ixpk= 2618, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1461,1462,
 &end
#
#   89 LYS  HB+          89 LYS  HA          2.60    (#   2619:20  Unique         2.27, 2.48 A)
 &rst
  ixpk= 2619, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1458,1459,
 &end
#
#    0 AMB  20-2:2620    89 LYS  HA          3.60    (#   2620:20  Single Ambig)
 &rst
  ixpk= 2620, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 4.54, r4= 5.29,
 igr1=1480,1481,1483,1484,
 &end
#
#   90 PRO  HB+          89 LYS  HA          3.80    (#   2621:20  Unique         4.94, 5.35 A)
 &rst
  ixpk= 2621, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 4.27, r4= 5.02,
 igr1=1483,1484,
 &end
#
#    0 AMB  20-2:2622    89 LYS  HA          5.50    (#   2622:20  Single Ambig)
 &rst
  ixpk= 2622, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1467,1468,1408,1409,
 &end
#
#   90 PRO  HD+          89 LYS  HA          4.00    (#   2623:20  Unique         2.49, 2.63 A)
 &rst
  ixpk= 2623, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 4.49, r4= 5.24,
 igr1=1477,1478,
 &end
#
#   90 PRO  HA           89 LYS  HA          2.60    (#   2625:20  Unique         4.39, 4.39 A)
 &rst
  ixpk= 2625, nxpk= 20, iat=1486,1456, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   89 LYS  HN           89 LYS  HA          3.00    (#   2626:20  Unique         2.71, 2.72 A)
 &rst
  ixpk= 2626, nxpk= 20, iat=1454,1456, r1= 0.00, r2= 1.80, r3= 3.00, r4= 3.75,  &end
#
#   91 VAL  HN           89 LYS  HA          5.50    (#   2627:20  Unique         5.27, 5.29 A)
 &rst
  ixpk= 2627, nxpk= 20, iat=1490,1456, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  164 LYS  HN          164 LYS  HB-         4.40    (#   2628:20  Unique         2.23, 3.18 A)
 &rst
  ixpk= 2628, nxpk= 20, iat=2701,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2705,2706,
 &end
#
#  125 ARG  HA          125 ARG  HB-         3.50    (#   2629:20  Unique         2.36, 2.75 A)
 &rst
  ixpk= 2629, nxpk= 20, iat=2021,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2023,2024,
 &end
#
#    0 AMB  20-2:2630     0 AMB  20-1:2630   5.50    (#   2630:20  Double Ambig)
 &rst
  ixpk= 2630, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2634,2635,2634,2635,1483,1484,
 igr2=2705,2706,1458,1459,
 &end
#
#    0 AMB  20-2:2631     0 AMB  20-1:2631   2.60    (#   2631:20  Double Ambig)
 &rst
  ixpk= 2631, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2026,2027,1461,1462,
 igr2=2023,2024,1458,1459,
 &end
#
#   89 LYS  HG-          89 LYS  HB-         2.60    (#   2632:20  Unique         2.32, 2.71 A)
 &rst
  ixpk= 2632, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1461,1462,
 igr2=1458,1459,
 &end
#
#    0 AMB  20-2:2633     0 AMB  20-1:2633   2.60    (#   2633:20  Double Ambig)
 &rst
  ixpk= 2633, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2711,2712,1464,1465,1458,1459,
 igr2=2708,2709,1461,1462,1461,1462,
 &end
#
#    0 AMB  20-2:2634    89 LYS  HG-         2.60    (#   2634:20  Single Ambig)
 &rst
  ixpk= 2634, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1464,1465,1458,1459,
 igr2=1461,1462,
 &end
#
#   89 LYS  HE+          89 LYS  HG-         3.50    (#   2635:20  Unique         2.42, 2.89 A)
 &rst
  ixpk= 2635, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1467,1468,
 igr2=1461,1462,
 &end
#
#    0 AMB  20-2:2636     0 AMB  20-1:2636   3.50    (#   2636:20  Double Ambig)
 &rst
  ixpk= 2636, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2714,2715,1467,1468,
 igr2=2708,2709,1461,1462,
 &end
#
#  164 LYS  HA          164 LYS  HG+         4.40    (#   2637:20  Unique         2.18, 3.62 A)
 &rst
  ixpk= 2637, nxpk= 20, iat=2703,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2708,2709,
 &end
#
#   89 LYS  HA           89 LYS  HG+         3.50    (#   2638:20  Unique         3.44, 3.71 A)
 &rst
  ixpk= 2638, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1461,1462,
 &end
#
#   89 LYS  HA           89 LYS  HG-         3.50    (#   2639:20  Unique         3.44, 3.71 A)
 &rst
  ixpk= 2639, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1461,1462,
 &end
#
#   90 PRO  HA           89 LYS  HG-         4.40    (#   2640:20  Unique         3.87, 4.65 A)
 &rst
  ixpk= 2640, nxpk= 20, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1461,1462,
 &end
#
#   90 PRO  HA           89 LYS  HG+         4.40    (#   2641:20  Unique         3.87, 4.65 A)
 &rst
  ixpk= 2641, nxpk= 20, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1461,1462,
 &end
#
#  164 LYS  HN          164 LYS  HG+         4.40    (#   2642:20  Unique         1.95, 3.16 A)
 &rst
  ixpk= 2642, nxpk= 20, iat=2701,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2708,2709,
 &end
#
#   89 LYS  HN           89 LYS  HG+         3.50    (#   2643:20  Unique         3.17, 3.62 A)
 &rst
  ixpk= 2643, nxpk= 20, iat=1454,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1461,1462,
 &end
#
#   89 LYS  HN           89 LYS  HG-         3.50    (#   2644:20  Unique         3.17, 3.62 A)
 &rst
  ixpk= 2644, nxpk= 20, iat=1454,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1461,1462,
 &end
#
#    0 AMB  20-2:2645    89 LYS  HG-         5.50    (#   2645:20  Single Ambig)
 &rst
  ixpk= 2645, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1490,1506,
 igr2=1461,1462,
 &end
#
#   89 LYS  HA           89 LYS  HD+         3.50    (#   2646:20  Unique         3.94, 4.56 A)
 &rst
  ixpk= 2646, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1464,1465,
 &end
#
#   89 LYS  HN           89 LYS  HD+         5.50    (#   2648:20  Unique         2.34, 4.72 A)
 &rst
  ixpk= 2648, nxpk= 20, iat=1454,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1464,1465,
 &end
#
#    0 AMB  20-2:2649     0 AMB  20-1:2649   2.60    (#   2649:20  Double Ambig)
 &rst
  ixpk= 2649, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1467,1468, 984, 985,2714,2715,
 igr2=1464,1465, 981, 982,2711,2712,
 &end
#
#    0 AMB  20-2:2650     0 AMB  20-1:2650   2.60    (#   2650:20  Double Ambig)
 &rst
  ixpk= 2650, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2705,2706,1458,1459,
 igr2=2711,2712,1464,1465,
 &end
#
#    0 AMB  20-2:2652     0 AMB  20-1:2652   2.60    (#   2652:20  Double Ambig)
 &rst
  ixpk= 2652, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 978, 979,1461,1462,
 igr2= 981, 982,1464,1465,
 &end
#
#    0 AMB  20-2:2653     0 AMB  20-1:2653   2.60    (#   2653:20  Double Ambig)
 &rst
  ixpk= 2653, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2708,2709,1461,1462,
 igr2=2711,2712,1464,1465,
 &end
#
#   73 ASN  HD2-        149 LYS  HE+         5.50    (#   2654:20  Unique         4.84, 9.48 A)
 &rst
  ixpk= 2654, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1151,1152,
 igr2=2483,2484,
 &end
#
#    0 AMB  20-2:2655     0 AMB  20-1:2655   5.50    (#   2655:20  Double Ambig)
 &rst
  ixpk= 2655, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2352, 993,
 igr2=2307,2308, 984, 985,
 &end
#
#   91 VAL  MGY          90 PRO  HA          3.50    (#   2656:20  Unique         3.88, 5.77 A)
 &rst
  ixpk= 2656, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   89 LYS  HG-          90 PRO  HA          4.40    (#   2657:20  Unique         3.87, 4.65 A)
 &rst
  ixpk= 2657, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1461,1462,
 &end
#
#    0 AMB  20-2:2658    90 PRO  HA          3.40    (#   2658:20  Single Ambig)
 &rst
  ixpk= 2658, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 4.28, r4= 5.03,
 igr1=1494,1458,1459,  25,
 &end
#
#   90 PRO  HB-          90 PRO  HA          3.50    (#   2659:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2659, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1483,1484,
 &end
#
#   90 PRO  HB+          90 PRO  HA          3.50    (#   2660:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2660, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1483,1484,
 &end
#
#    0 AMB  20-2:2661    90 PRO  HA          5.50    (#   2661:20  Single Ambig)
 &rst
  ixpk= 2661, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1467,1468,1408,1409,
 &end
#
#    0 AMB  20-2:2662    90 PRO  HA          5.50    (#   2662:20  Single Ambig)
 &rst
  ixpk= 2662, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1477,1478,1408,1409,
 &end
#
#   91 VAL  HA           90 PRO  HA          4.40    (#   2663:20  Unique         4.50, 4.50 A)
 &rst
  ixpk= 2663, nxpk= 20, iat=1492,1486, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   89 LYS  HA           90 PRO  HA          2.60    (#   2664:20  Unique         4.39, 4.39 A)
 &rst
  ixpk= 2664, nxpk= 20, iat=1456,1486, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   91 VAL  HN           90 PRO  HA          2.60    (#   2666:20  Unique         2.28, 2.29 A)
 &rst
  ixpk= 2666, nxpk= 20, iat=1490,1486, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  113 MET  HN          114 GLN  HG+         4.40    (#   2668:20  Unique         3.74, 4.66 A)
 &rst
  ixpk= 2668, nxpk= 20, iat=1843,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1867,1868,
 &end
#
#    0 AMB  20-2:2669     0 AMB  20-1:2669   4.40    (#   2669:20  Double Ambig)
 &rst
  ixpk= 2669, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1490,1506,
 igr2=1483,1484,1483,1484,
 &end
#
#    0 AMB  20-2:2670    90 PRO  HB-         4.40    (#   2670:20  Single Ambig)
 &rst
  ixpk= 2670, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1490,1506,
 igr2=1483,1484,
 &end
#
#  114 GLN  HN          114 GLN  HG+         3.50    (#   2671:20  Unique         2.19, 2.76 A)
 &rst
  ixpk= 2671, nxpk= 20, iat=1860,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1867,1868,
 &end
#
#  159 GLN  HN            0 AMB  20-1:2672   2.60    (#   2672:20  Single Ambig)
 &rst
  ixpk= 2672, nxpk= 20, iat=2627,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr2=2634,2635,2634,2635,
 &end
#
#  159 GLN  HE2+        159 GLN  HG+         2.60    (#   2673:20  Unique         2.16, 3.27 A)
 &rst
  ixpk= 2673, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2639,2640,
 igr2=2634,2635,
 &end
#
#  114 GLN  HE2-        114 GLN  HG+         3.50    (#   2674:20  Unique         2.22, 3.41 A)
 &rst
  ixpk= 2674, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1872,1873,
 igr2=1867,1868,
 &end
#
#  159 GLN  HE2-        159 GLN  HG+         4.40    (#   2675:20  Unique         2.16, 3.27 A)
 &rst
  ixpk= 2675, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2639,2640,
 igr2=2634,2635,
 &end
#
#  159 GLN  HE2-        159 GLN  HG+         3.50    (#   2676:20  Unique         2.16, 3.27 A)
 &rst
  ixpk= 2676, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2639,2640,
 igr2=2634,2635,
 &end
#
#   90 PRO  HA           90 PRO  HB-         2.60    (#   2677:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2677, nxpk= 20, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1483,1484,
 &end
#
#   89 LYS  HA           90 PRO  HB-         4.40    (#   2678:20  Unique         4.94, 5.35 A)
 &rst
  ixpk= 2678, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1483,1484,
 &end
#
#   89 LYS  HA           90 PRO  HB+         3.80    (#   2679:20  Unique         4.94, 5.35 A)
 &rst
  ixpk= 2679, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 4.27, r4= 5.02,
 igr2=1483,1484,
 &end
#
#    0 AMB  20-2:2680     0 AMB  20-1:2680   2.60    (#   2680:20  Double Ambig)
 &rst
  ixpk= 2680, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=2582,2646,2629,
 igr2=2634,2635,2634,2635,2634,2635,
 &end
#
#    0 AMB  20-2:2681     0 AMB  20-1:2681   3.50    (#   2681:20  Double Ambig)
 &rst
  ixpk= 2681, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1477,1478,2566,
 igr2=1483,1484,2634,2635,
 &end
#
#   90 PRO  HD+          90 PRO  HB-         3.50    (#   2682:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2682, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1477,1478,
 igr2=1483,1484,
 &end
#
#    0 AMB  20-2:2683     0 AMB  20-1:2683   2.60    (#   2683:20  Double Ambig)
 &rst
  ixpk= 2683, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1480,1481,2612,2613,
 igr2=1483,1484,2634,2635,
 &end
#
#   90 PRO  HG-          90 PRO  HB-         2.60    (#   2684:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 2684, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1480,1481,
 igr2=1483,1484,
 &end
#
#    0 AMB  20-2:2685    90 PRO  HB-         3.50    (#   2685:20  Single Ambig)
 &rst
  ixpk= 2685, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=  34,  35,  36,  27,  28,  29,
 igr2=1483,1484,
 &end
#
#   91 VAL  MGY          90 PRO  HB-         5.50    (#   2686:20  Unique         5.80, 7.40 A)
 &rst
  ixpk= 2686, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1496,1497,1498,1500,1501,1502,
 igr2=1483,1484,
 &end
#
#    0 AMB  20-2:2687     0 AMB  20-1:2687   2.60    (#   2687:20  Double Ambig)
 &rst
  ixpk= 2687, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2570,2571,2572,2574,2575,2576,2617,2618,2619,2621,
      2622,2623,
 igr2=2634,2635,2634,2635,2634,2635,
 &end
#
#    2 ILE  QD1          90 PRO  HG+         4.40    (#   2688:20  Unique         3.18, 4.74 A)
 &rst
  ixpk= 2688, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  34,  35,  36,
 igr2=1480,1481,
 &end
#
#    2 ILE  QD1          90 PRO  HG-         3.50    (#   2689:20  Unique         3.18, 4.74 A)
 &rst
  ixpk= 2689, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  34,  35,  36,
 igr2=1480,1481,
 &end
#
#   90 PRO  HB+          90 PRO  HG-         3.50    (#   2690:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 2690, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1483,1484,
 igr2=1480,1481,
 &end
#
#   90 PRO  HB+          90 PRO  HG+         2.60    (#   2691:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 2691, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1483,1484,
 igr2=1480,1481,
 &end
#
#   90 PRO  HD+          90 PRO  HG+         2.60    (#   2692:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2692, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1477,1478,
 igr2=1480,1481,
 &end
#
#   90 PRO  HD+          90 PRO  HG-         2.60    (#   2693:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2693, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1477,1478,
 igr2=1480,1481,
 &end
#
#    0 AMB  20-2:2694     0 AMB  20-1:2694   4.40    (#   2694:20  Double Ambig)
 &rst
  ixpk= 2694, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1490,1506,
 igr2=1480,1481,1480,1481,
 &end
#
#   90 PRO  HA           90 PRO  HG+         4.40    (#   2695:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 2695, nxpk= 20, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1480,1481,
 &end
#
#   90 PRO  HA           90 PRO  HG-         4.40    (#   2696:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 2696, nxpk= 20, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1480,1481,
 &end
#
#   91 VAL  MGX          91 VAL  HA          2.60    (#   2699:20  Unique         2.37, 3.50 A)
 &rst
  ixpk= 2699, nxpk= 20, iat=  -1,1492, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#    2 ILE  QD1          91 VAL  HA          3.80    (#   2700:20  Unique         3.04, 3.98 A)
 &rst
  ixpk= 2700, nxpk= 20, iat=  -1,1492, r1= 0.00, r2= 1.80, r3= 4.56, r4= 5.31,
 igr1=  34,  35,  36,
 &end
#
#   91 VAL  MGY          91 VAL  HA          2.60    (#   2701:20  Unique         2.37, 3.50 A)
 &rst
  ixpk= 2701, nxpk= 20, iat=  -1,1492, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   91 VAL  HB           91 VAL  HA          3.50    (#   2702:20  Unique         2.40, 2.42 A)
 &rst
  ixpk= 2702, nxpk= 20, iat=1494,1492, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   92 CYS  HB-          91 VAL  HA          4.40    (#   2703:20  Unique         4.30, 5.00 A)
 &rst
  ixpk= 2703, nxpk= 20, iat=  -1,1492, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1510,1511,
 &end
#
#    0 AMB  20-2:2704    91 VAL  HA          2.60    (#   2704:20  Single Ambig)
 &rst
  ixpk= 2704, nxpk= 20, iat=  -1,1492, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1506,1490,
 &end
#
#   91 VAL  MGX          91 VAL  HB          2.60    (#   2705:20  Unique         2.31, 2.63 A)
 &rst
  ixpk= 2705, nxpk= 20, iat=  -1,1494, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   91 VAL  MGY          91 VAL  HB          2.60    (#   2706:20  Unique         2.31, 2.63 A)
 &rst
  ixpk= 2706, nxpk= 20, iat=  -1,1494, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   91 VAL  HA           91 VAL  HB          3.50    (#   2707:20  Unique         2.40, 2.42 A)
 &rst
  ixpk= 2707, nxpk= 20, iat=1492,1494, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   90 PRO  HA           91 VAL  HB          5.50    (#   2708:20  Unique         4.89, 4.92 A)
 &rst
  ixpk= 2708, nxpk= 20, iat=1486,1494, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   93 ILE  QG2          91 VAL  HB          5.50    (#   2710:20  Unique         6.79, 7.68 A)
 &rst
  ixpk= 2710, nxpk= 20, iat=  -1,1494, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1523,1524,1525,
 &end
#
#    0 AMB  20-2:2711    91 VAL  HB          3.50    (#   2711:20  Single Ambig)
 &rst
  ixpk= 2711, nxpk= 20, iat=  -1,1494, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1490,1506,
 &end
#
#    0 AMB  20-2:2712    91 VAL  MGX         4.40    (#   2712:20  Single Ambig)
 &rst
  ixpk= 2712, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1517,1428,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2713    91 VAL  MGX         2.60    (#   2713:20  Single Ambig)
 &rst
  ixpk= 2713, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1490,1506,1380,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   86 TRP  HN           91 VAL  MGX         4.40    (#   2714:20  Unique         3.75, 5.54 A)
 &rst
  ixpk= 2714, nxpk= 20, iat=1404,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   86 TRP  HE3          91 VAL  MGX         3.50    (#   2715:20  Unique         2.69, 4.30 A)
 &rst
  ixpk= 2715, nxpk= 20, iat=1423,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   86 TRP  HZ3          91 VAL  MGX         3.50    (#   2716:20  Unique         3.19, 4.82 A)
 &rst
  ixpk= 2716, nxpk= 20, iat=1421,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   86 TRP  HA           91 VAL  MGX         3.50    (#   2718:20  Unique         2.30, 4.21 A)
 &rst
  ixpk= 2718, nxpk= 20, iat=1406,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2719    91 VAL  MGX         4.40    (#   2719:20  Single Ambig)
 &rst
  ixpk= 2719, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1382,1456,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   91 VAL  HA           91 VAL  MGX         2.60    (#   2720:20  Unique         2.37, 3.50 A)
 &rst
  ixpk= 2720, nxpk= 20, iat=1492,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2721    91 VAL  MGX         3.50    (#   2721:20  Single Ambig)
 &rst
  ixpk= 2721, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1366,1408,1409,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2722    91 VAL  MGX         5.50    (#   2722:20  Single Ambig)
 &rst
  ixpk= 2722, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1408,1409,1467,1468,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   91 VAL  HB           91 VAL  MGX         2.60    (#   2723:20  Unique         2.31, 2.63 A)
 &rst
  ixpk= 2723, nxpk= 20, iat=1494,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   84 VAL  HB           91 VAL  MGX         4.40    (#   2724:20  Unique         4.06, 5.07 A)
 &rst
  ixpk= 2724, nxpk= 20, iat=1368,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2725    91 VAL  MGX         5.50    (#   2725:20  Single Ambig)
 &rst
  ixpk= 2725, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=  31,  32,1270,1271,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   84 VAL  MGY          91 VAL  MGX         3.50    (#   2727:20  Unique         1.88, 4.48 A)
 &rst
  ixpk= 2727, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1370,1371,1372,1374,1375,1376,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   93 ILE  QG2          91 VAL  MGX         2.60    (#   2728:20  Unique         4.05, 6.13 A)
 &rst
  ixpk= 2728, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1523,1524,1525,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   84 VAL  MGX          91 VAL  MGX         2.60    (#   2729:20  Unique         1.88, 4.48 A)
 &rst
  ixpk= 2729, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1370,1371,1372,1374,1375,1376,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   84 VAL  MGX          91 VAL  MGY         3.50    (#   2733:20  Unique         1.88, 4.48 A)
 &rst
  ixpk= 2733, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1370,1371,1372,1374,1375,1376,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#  101 LEU  MDY         154 VAL  MGX         2.60    (#   2735:20  Unique         1.99, 5.19 A)
 &rst
  ixpk= 2735, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:2736     0 AMB  20-1:2736   2.60    (#   2736:20  Double Ambig)
 &rst
  ixpk= 2736, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2237,2238,2239,2241,2242,2243,1523,1524,1525,
 igr2=2180,2181,2182,2184,2185,2186,1496,1497,1498,1500,
      1501,1502,
 &end
#
#    0 AMB  20-2:2738   154 VAL  MGX         2.60    (#   2738:20  Single Ambig)
 &rst
  ixpk= 2738, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1087,1088,1089,1068,1069,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:2739     0 AMB  20-1:2739   3.50    (#   2739:20  Double Ambig)
 &rst
  ixpk= 2739, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1=2396,2397,1494,2612,2613,2323,2324,
 igr2=2180,2181,2182,2184,2185,2186,1496,1497,1498,1500,
      1501,1502,2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:2740     0 AMB  20-1:2740   2.60    (#   2740:20  Double Ambig)
 &rst
  ixpk= 2740, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2552,2393,2394,
 igr2=2554,2555,2556,2558,2559,2560,2180,2181,2182,2184,
      2185,2186,
 &end
#
#  133 VAL  HB          133 VAL  MGX         2.60    (#   2741:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2741, nxpk= 20, iat=2178,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:2742    91 VAL  MGY         4.40    (#   2742:20  Single Ambig)
 &rst
  ixpk= 2742, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=1408,1409,1467,1468,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2743     0 AMB  20-1:2743   3.50    (#   2743:20  Double Ambig)
 &rst
  ixpk= 2743, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2511,2512, 114, 115,
 igr2=2554,2555,2556,2558,2559,2560,1496,1497,1498,1500,
      1501,1502,
 &end
#
#    0 AMB  20-2:2744     0 AMB  20-1:2744   3.50    (#   2744:20  Double Ambig)
 &rst
  ixpk= 2744, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2176,1366,
 igr2=2180,2181,2182,2184,2185,2186,1496,1497,1498,1500,
      1501,1502,
 &end
#
#    0 AMB  20-2:2745     0 AMB  20-1:2745   2.60    (#   2745:20  Double Ambig)
 &rst
  ixpk= 2745, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2550,1492,
 igr2=2554,2555,2556,2558,2559,2560,1496,1497,1498,1500,
      1501,1502,
 &end
#
#   86 TRP  HA           91 VAL  MGY         3.50    (#   2746:20  Unique         2.30, 4.21 A)
 &rst
  ixpk= 2746, nxpk= 20, iat=1406,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#  130 TRP  HA          133 VAL  MGX         3.50    (#   2747:20  Unique         1.99, 3.76 A)
 &rst
  ixpk= 2747, nxpk= 20, iat=2117,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#  151 PHE  HA          154 VAL  MGX         3.50    (#   2748:20  Unique         2.16, 4.83 A)
 &rst
  ixpk= 2748, nxpk= 20, iat=2509,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#   90 PRO  HA           91 VAL  MGY         3.50    (#   2749:20  Unique         3.88, 5.77 A)
 &rst
  ixpk= 2749, nxpk= 20, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2751   154 VAL  MGX         4.40    (#   2751:20  Single Ambig)
 &rst
  ixpk= 2751, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2515,2523,1715,1716,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#  154 VAL  HN          154 VAL  MGX         2.60    (#   2752:20  Unique         1.76, 3.61 A)
 &rst
  ixpk= 2752, nxpk= 20, iat=2548,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#   86 TRP  HE3          91 VAL  MGY         3.50    (#   2753:20  Unique         2.69, 4.30 A)
 &rst
  ixpk= 2753, nxpk= 20, iat=1423,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2754    91 VAL  MGY         2.60    (#   2754:20  Single Ambig)
 &rst
  ixpk= 2754, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1490,1506,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:2755     0 AMB  20-1:2755   4.40    (#   2755:20  Double Ambig)
 &rst
  ixpk= 2755, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2329,2537,
 igr2=2180,2181,2182,2184,2185,2186,2554,2555,2556,2558,
      2559,2560,
 &end
#
#    0 AMB  20-2:2756    91 VAL  MGY         4.40    (#   2756:20  Single Ambig)
 &rst
  ixpk= 2756, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1517,1428,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    2 ILE  QD1          92 CYS  HB+         3.50    (#   2757:20  Unique         2.24, 3.99 A)
 &rst
  ixpk= 2757, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  34,  35,  36,
 igr2=1510,1511,
 &end
#
#    2 ILE  QD1          92 CYS  HB-         4.40    (#   2758:20  Unique         2.24, 3.99 A)
 &rst
  ixpk= 2758, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  34,  35,  36,
 igr2=1510,1511,
 &end
#
#   91 VAL  HA           92 CYS  HB+         5.50    (#   2759:20  Unique         4.30, 5.00 A)
 &rst
  ixpk= 2759, nxpk= 20, iat=1492,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1510,1511,
 &end
#
#   91 VAL  HA           92 CYS  HB-         5.50    (#   2760:20  Unique         4.30, 5.00 A)
 &rst
  ixpk= 2760, nxpk= 20, iat=1492,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1510,1511,
 &end
#
#    0 AMB  20-2:2763     0 AMB  20-1:2763   3.50    (#   2763:20  Double Ambig)
 &rst
  ixpk= 2763, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 104,1506,
 igr2=1510,1511,1510,1511,
 &end
#
#    0 AMB  20-2:2764    92 CYS  HB-         3.50    (#   2764:20  Single Ambig)
 &rst
  ixpk= 2764, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 104,1506,
 igr2=1510,1511,
 &end
#
#   93 ILE  HN           92 CYS  HB+         5.50    (#   2765:20  Unique         2.93, 3.57 A)
 &rst
  ixpk= 2765, nxpk= 20, iat=1517,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1510,1511,
 &end
#
#   52 ARG  HN           52 ARG  HA          3.50    (#   2766:20  Unique         2.81, 2.83 A)
 &rst
  ixpk= 2766, nxpk= 20, iat= 786, 788, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   84 VAL  MGY          93 ILE  HA          2.60    (#   2767:20  Unique         3.05, 4.29 A)
 &rst
  ixpk= 2767, nxpk= 20, iat=  -1,1519, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2768    93 ILE  HA          3.50    (#   2768:20  Single Ambig)
 &rst
  ixpk= 2768, nxpk= 20, iat=  -1,1519, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1527,1528,1530,1531,1532,
 &end
#
#   93 ILE  QG2          93 ILE  HA          2.60    (#   2769:20  Unique         2.56, 3.03 A)
 &rst
  ixpk= 2769, nxpk= 20, iat=  -1,1519, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1523,1524,1525,
 &end
#
#   84 VAL  MGX          93 ILE  HA          3.50    (#   2770:20  Unique         3.05, 4.29 A)
 &rst
  ixpk= 2770, nxpk= 20, iat=  -1,1519, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  20-2:2771     0 AMB  20-1:2771   5.50    (#   2771:20  Double Ambig)
 &rst
  ixpk= 2771, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1519, 788,
 igr2=1527,1528, 834, 835, 836, 838, 839, 840,
 &end
#
#    0 AMB  20-2:2772     0 AMB  20-1:2772   2.60    (#   2772:20  Double Ambig)
 &rst
  ixpk= 2772, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 185, 186, 187,1527,1528,
 igr2= 192, 193, 194,1530,1531,1532,
 &end
#
#    0 AMB  20-2:2773     0 AMB  20-1:2773   5.50    (#   2773:20  Double Ambig)
 &rst
  ixpk= 2773, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1640,1555,1556,
 igr2= 192, 193, 194,1530,1531,1532,
 &end
#
#   93 ILE  HN           93 ILE  QG2         3.50    (#   2774:20  Unique         2.39, 3.40 A)
 &rst
  ixpk= 2774, nxpk= 20, iat=1517,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1523,1524,1525,
 &end
#
#    0 AMB  20-2:2775    93 ILE  QG2         4.40    (#   2775:20  Single Ambig)
 &rst
  ixpk= 2775, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1506,1490, 104,1380,
 igr2=1523,1524,1525,
 &end
#
#   79 LEU  HN           93 ILE  QG2         5.50    (#   2776:20  Unique         7.11, 8.03 A)
 &rst
  ixpk= 2776, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1523,1524,1525,
 &end
#
#    0 AMB  20-2:2777    93 ILE  QG2         4.40    (#   2777:20  Single Ambig)
 &rst
  ixpk= 2777, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1423,1536,
 igr2=1523,1524,1525,
 &end
#
#   86 TRP  HZ2          93 ILE  QG2         5.50    (#   2778:20  Unique         4.39, 5.38 A)
 &rst
  ixpk= 2778, nxpk= 20, iat=1417,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1523,1524,1525,
 &end
#
#   86 TRP  HZ3          93 ILE  QG2         4.40    (#   2779:20  Unique         1.99, 2.43 A)
 &rst
  ixpk= 2779, nxpk= 20, iat=1421,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1523,1524,1525,
 &end
#
#  126 TRP  HA          127 VAL  MGX         4.40    (#   2780:20  Unique         3.31, 4.79 A)
 &rst
  ixpk= 2780, nxpk= 20, iat=2045,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#   93 ILE  HA           93 ILE  QG2         2.60    (#   2781:20  Unique         2.56, 3.03 A)
 &rst
  ixpk= 2781, nxpk= 20, iat=1519,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1523,1524,1525,
 &end
#
#    6 GLY  HA+          93 ILE  QG2         3.50    (#   2782:20  Unique         3.86, 5.58 A)
 &rst
  ixpk= 2782, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  78,  79,
 igr2=1523,1524,1525,
 &end
#
#    6 GLY  HA-          93 ILE  QG2         3.50    (#   2783:20  Unique         3.86, 5.58 A)
 &rst
  ixpk= 2783, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  78,  79,
 igr2=1523,1524,1525,
 &end
#
#    0 AMB  20-2:2784    93 ILE  QG2         4.40    (#   2784:20  Single Ambig)
 &rst
  ixpk= 2784, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1366,1408,1409,
 igr2=1523,1524,1525,
 &end
#
#   93 ILE  HB           93 ILE  QG2         2.60    (#   2785:20  Unique         2.33, 2.63 A)
 &rst
  ixpk= 2785, nxpk= 20, iat=1521,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1523,1524,1525,
 &end
#
#   93 ILE  HG1-         93 ILE  QG2         2.60    (#   2786:20  Unique         2.79, 3.63 A)
 &rst
  ixpk= 2786, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1527,1528,
 igr2=1523,1524,1525,
 &end
#
#   84 VAL  MGX          93 ILE  QG2         2.60    (#   2787:20  Unique         3.22, 5.73 A)
 &rst
  ixpk= 2787, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1370,1371,1372,1374,1375,1376,
 igr2=1523,1524,1525,
 &end
#
#   91 VAL  MGX          93 ILE  QG2         2.60    (#   2788:20  Unique         4.05, 6.13 A)
 &rst
  ixpk= 2788, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1496,1497,1498,1500,1501,1502,
 igr2=1523,1524,1525,
 &end
#
#    0 AMB  20-2:2789     0 AMB  20-1:2789   5.50    (#   2789:20  Double Ambig)
 &rst
  ixpk= 2789, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.64, r4=12.39,
 igr1=2098,2099,2119,2120,1999,2000, 237, 238,1286,1287,
      
 igr2=2073,2074,2075,2077,2078,2079,1523,1524,1525,
 &end
#
#    0 AMB  20-2:2790   127 VAL  MGX         3.50    (#   2790:20  Single Ambig)
 &rst
  ixpk= 2790, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2143,2144,2029,2030,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  20-2:2791   127 VAL  MGX         3.50    (#   2791:20  Single Ambig)
 &rst
  ixpk= 2791, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 364,2147,2156,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#   94 GLY  HN           94 GLY  HA+         5.50    (#   2792:20  Unique         2.61, 2.79 A)
 &rst
  ixpk= 2792, nxpk= 20, iat=1536,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1538,1539,
 &end
#
#   94 GLY  HN           94 GLY  HA-         4.40    (#   2793:20  Unique         2.61, 2.79 A)
 &rst
  ixpk= 2793, nxpk= 20, iat=1536,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1538,1539,
 &end
#
#    0 AMB  20-2:2794     0 AMB  20-1:2794   5.50    (#   2794:20  Double Ambig)
 &rst
  ixpk= 2794, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1251,1252,1547,1548,
 igr2=1538,1539,1538,1539,
 &end
#
#   79 LEU  HG           94 GLY  HA+         5.50    (#   2795:20  Unique         3.84, 4.74 A)
 &rst
  ixpk= 2795, nxpk= 20, iat=1273,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1538,1539,
 &end
#
#   79 LEU  HG           94 GLY  HA-         5.50    (#   2796:20  Unique         3.84, 4.74 A)
 &rst
  ixpk= 2796, nxpk= 20, iat=1273,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1538,1539,
 &end
#
#    0 AMB  20-2:2797     0 AMB  20-1:2797   3.50    (#   2797:20  Double Ambig)
 &rst
  ixpk= 2797, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2570,2571,2572,2574,2575,2576,2617,2618,2619,2621,
      2622,2623,
 igr2= 301, 302, 301, 302,
 &end
#
#   79 LEU  MDX          94 GLY  HA+         5.50    (#   2798:20  Unique         3.24, 5.88 A)
 &rst
  ixpk= 2798, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1538,1539,
 &end
#
#   95 GLN  HB-          95 GLN  HA          4.40    (#   2799:20  Unique         2.23, 2.46 A)
 &rst
  ixpk= 2799, nxpk= 20, iat=  -1,1545, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1547,1548,
 &end
#
#    0 AMB  20-2:2800    95 GLN  HA          3.50    (#   2800:20  Single Ambig)
 &rst
  ixpk= 2800, nxpk= 20, iat=  -1,1545, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1547,1548, 108, 109,
 &end
#
#    0 AMB  20-2:2801    95 GLN  HA          3.50    (#   2801:20  Single Ambig)
 &rst
  ixpk= 2801, nxpk= 20, iat=  -1,1545, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1550,1551,1209,1210,
 &end
#
#   95 GLN  HG+          95 GLN  HA          5.50    (#   2802:20  Unique         3.25, 3.78 A)
 &rst
  ixpk= 2802, nxpk= 20, iat=  -1,1545, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1550,1551,
 &end
#
#    8 ARG  HN           95 GLN  HA          3.50    (#   2803:20  Unique         2.41, 2.54 A)
 &rst
  ixpk= 2803, nxpk= 20, iat= 104,1545, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   96 LYS  HN           95 GLN  HA          2.60    (#   2804:20  Unique         2.23, 2.31 A)
 &rst
  ixpk= 2804, nxpk= 20, iat=1560,1545, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    0 AMB  20-2:2805    95 GLN  HB-         3.50    (#   2805:20  Single Ambig)
 &rst
  ixpk= 2805, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1550,1551,1209,1210,
 igr2=1547,1548,
 &end
#
#   95 GLN  HA           95 GLN  HB+         4.40    (#   2806:20  Unique         2.23, 2.46 A)
 &rst
  ixpk= 2806, nxpk= 20, iat=1545,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1547,1548,
 &end
#
#   95 GLN  HA           95 GLN  HB-         5.50    (#   2807:20  Unique         2.23, 2.46 A)
 &rst
  ixpk= 2807, nxpk= 20, iat=1545,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1547,1548,
 &end
#
#    0 AMB  20-2:2808     0 AMB  20-1:2808   3.50    (#   2808:20  Double Ambig)
 &rst
  ixpk= 2808, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.00, r4= 7.75,
 igr1=1419,1364, 773, 782, 644, 645, 446, 454,
 igr2=1303,1304,1303,1304, 817, 818,1934,1935,
 &end
#
#   95 GLN  HN           95 GLN  HB-         5.50    (#   2809:20  Unique         2.70, 3.36 A)
 &rst
  ixpk= 2809, nxpk= 20, iat=1543,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1547,1548,
 &end
#
#    0 AMB  20-2:2810     0 AMB  20-1:2810   3.50    (#   2810:20  Double Ambig)
 &rst
  ixpk= 2810, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1594,1595,1555,1556,
 igr2=1550,1551,1550,1551,
 &end
#
#   95 GLN  HA           95 GLN  HG+         4.40    (#   2811:20  Unique         3.25, 3.78 A)
 &rst
  ixpk= 2811, nxpk= 20, iat=1545,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1550,1551,
 &end
#
#   95 GLN  HB-          95 GLN  HG+         2.60    (#   2812:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2812, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1547,1548,
 igr2=1550,1551,
 &end
#
#   96 LYS  HG+          96 LYS  HA          5.50    (#   2814:20  Unique         2.35, 3.19 A)
 &rst
  ixpk= 2814, nxpk= 20, iat=  -1,1562, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1567,1568,
 &end
#
#   96 LYS  HD+          96 LYS  HA          5.50    (#   2815:20  Unique         3.70, 4.56 A)
 &rst
  ixpk= 2815, nxpk= 20, iat=  -1,1562, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1570,1571,
 &end
#
#    0 AMB  20-2:2816    96 LYS  HA          5.50    (#   2816:20  Single Ambig)
 &rst
  ixpk= 2816, nxpk= 20, iat=  -1,1562, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1203,1204,1564,1565,
 &end
#
#   76 ARG  HA           96 LYS  HA          4.40    (#   2817:20  Unique         1.98, 4.12 A)
 &rst
  ixpk= 2817, nxpk= 20, iat=1201,1562, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   96 LYS  HN           96 LYS  HA          5.50    (#   2819:20  Unique         2.95, 2.95 A)
 &rst
  ixpk= 2819, nxpk= 20, iat=1560,1562, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   97 GLN  HN           96 LYS  HA          3.50    (#   2820:20  Unique         2.16, 2.22 A)
 &rst
  ixpk= 2820, nxpk= 20, iat=1582,1562, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2821     0 AMB  20-1:2821   5.50    (#   2821:20  Double Ambig)
 &rst
  ixpk= 2821, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1156,  40,1142,
 igr2=1564,1565,1564,1565,1564,1565,
 &end
#
#   96 LYS  HA           96 LYS  HB+         5.50    (#   2822:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 2822, nxpk= 20, iat=1562,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1564,1565,
 &end
#
#    9 PRO  HB+          96 LYS  HB-         5.50    (#   2823:20  Unique         3.15, 5.13 A)
 &rst
  ixpk= 2823, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 135, 136,
 igr2=1564,1565,
 &end
#
#    0 AMB  20-2:2824     0 AMB  20-1:2824   5.50    (#   2824:20  Double Ambig)
 &rst
  ixpk= 2824, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1570,1571,1206,1207,
 igr2=1564,1565,1564,1565,
 &end
#
#    0 AMB  20-2:2825    96 LYS  HB-         4.40    (#   2825:20  Single Ambig)
 &rst
  ixpk= 2825, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1570,1571,1206,1207,
 igr2=1564,1565,
 &end
#
#    0 AMB  20-2:2827    96 LYS  HG-         3.50    (#   2827:20  Single Ambig)
 &rst
  ixpk= 2827, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1206,1207,1570,1571,
 igr2=1567,1568,
 &end
#
#   76 ARG  HD-          96 LYS  HG-         5.50    (#   2828:20  Unique         2.00, 5.20 A)
 &rst
  ixpk= 2828, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1209,1210,
 igr2=1567,1568,
 &end
#
#    0 AMB  20-2:2829    97 GLN  HA          4.40    (#   2829:20  Single Ambig)
 &rst
  ixpk= 2829, nxpk= 20, iat=  -1,1584, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1603,1604,2358,2359,2360,2362,2363,2364,
 &end
#
#   97 GLN  HB-          97 GLN  HA          3.50    (#   2830:20  Unique         2.50, 2.82 A)
 &rst
  ixpk= 2830, nxpk= 20, iat=  -1,1584, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1586,1587,
 &end
#
#   97 GLN  HG+          97 GLN  HA          4.40    (#   2831:20  Unique         2.04, 2.68 A)
 &rst
  ixpk= 2831, nxpk= 20, iat=  -1,1584, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1589,1590,
 &end
#
#    0 AMB  20-2:2832    97 GLN  HA          4.40    (#   2832:20  Single Ambig)
 &rst
  ixpk= 2832, nxpk= 20, iat=  -1,1584, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 158, 144,
 &end
#
#    0 AMB  20-2:2833    97 GLN  HA          4.40    (#   2833:20  Single Ambig)
 &rst
  ixpk= 2833, nxpk= 20, iat=  -1,1584, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1594,1595,1640,
 &end
#
#   98 LYS  HN           97 GLN  HA          2.60    (#   2834:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 2834, nxpk= 20, iat=1599,1584, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   10 ASN  HN           97 GLN  HA          4.40    (#   2835:20  Unique         3.11, 3.44 A)
 &rst
  ixpk= 2835, nxpk= 20, iat= 142,1584, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   97 GLN  HN           97 GLN  HA          4.40    (#   2836:20  Unique         2.94, 2.94 A)
 &rst
  ixpk= 2836, nxpk= 20, iat=1582,1584, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   98 LYS  HB-          98 LYS  HA          4.40    (#   2838:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 2838, nxpk= 20, iat=  -1,1601, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1603,1604,
 &end
#
#   98 LYS  HG+          98 LYS  HA          5.50    (#   2839:20  Unique         2.27, 3.16 A)
 &rst
  ixpk= 2839, nxpk= 20, iat=  -1,1601, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1606,1607,
 &end
#
#   98 LYS  HB+          98 LYS  HA          3.50    (#   2840:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 2840, nxpk= 20, iat=  -1,1601, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1603,1604,
 &end
#
#   99 TRP  HN           98 LYS  HA          3.50    (#   2841:20  Unique         2.14, 2.14 A)
 &rst
  ixpk= 2841, nxpk= 20, iat=1621,1601, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   98 LYS  HN           98 LYS  HB+         5.50    (#   2842:20  Unique         2.33, 2.87 A)
 &rst
  ixpk= 2842, nxpk= 20, iat=1599,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1603,1604,
 &end
#
#   99 TRP  HN           98 LYS  HB+         5.50    (#   2843:20  Unique         3.25, 4.14 A)
 &rst
  ixpk= 2843, nxpk= 20, iat=1621,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1603,1604,
 &end
#
#   74 TRP  HH2          98 LYS  HB+         5.50    (#   2844:20  Unique         2.37, 4.09 A)
 &rst
  ixpk= 2844, nxpk= 20, iat=1171,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1603,1604,
 &end
#
#   98 LYS  HA           98 LYS  HB+         4.40    (#   2845:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 2845, nxpk= 20, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1603,1604,
 &end
#
#   98 LYS  HE-          98 LYS  HB+         5.50    (#   2846:20  Unique         2.08, 3.82 A)
 &rst
  ixpk= 2846, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1612,1613,
 igr2=1603,1604,
 &end
#
#    0 AMB  20-2:2847     0 AMB  20-1:2847   4.40    (#   2847:20  Double Ambig)
 &rst
  ixpk= 2847, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.25, r4= 8.00,
 igr1= 700, 701, 702, 626, 627,
 igr2=1603,1604,1603,1604,
 &end
#
#   11 VAL  MGY          98 LYS  HB+         3.50    (#   2848:20  Unique         1.97, 4.54 A)
 &rst
  ixpk= 2848, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2=1603,1604,
 &end
#
#    0 AMB  20-2:2849     0 AMB  20-1:2849   5.50    (#   2849:20  Double Ambig)
 &rst
  ixpk= 2849, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.80, r4=10.55,
 igr1=1609,1610, 162, 163, 164, 166, 167, 168,
 igr2=1603,1604,1603,1604,
 &end
#
#   98 LYS  HG+          98 LYS  HB+         3.50    (#   2850:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2850, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1606,1607,
 igr2=1603,1604,
 &end
#
#   98 LYS  HG-          98 LYS  HB-         3.50    (#   2851:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2851, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1606,1607,
 igr2=1603,1604,
 &end
#
#    0 AMB  20-2:2852    98 LYS  HB-         5.50    (#   2852:20  Single Ambig)
 &rst
  ixpk= 2852, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1609,1610, 162, 163, 164, 166, 167, 168,
 igr2=1603,1604,
 &end
#
#   98 LYS  HD+          98 LYS  HB-         5.50    (#   2853:20  Unique         1.94, 3.20 A)
 &rst
  ixpk= 2853, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1609,1610,
 igr2=1603,1604,
 &end
#
#   46 ALA  MB           98 LYS  HB-         4.40    (#   2854:20  Unique         2.40, 4.72 A)
 &rst
  ixpk= 2854, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 700, 701, 702,
 igr2=1603,1604,
 &end
#
#   98 LYS  HE+          98 LYS  HB-         5.50    (#   2855:20  Unique         2.08, 3.82 A)
 &rst
  ixpk= 2855, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1612,1613,
 igr2=1603,1604,
 &end
#
#   98 LYS  HA           98 LYS  HB-         4.40    (#   2856:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 2856, nxpk= 20, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1603,1604,
 &end
#
#   74 TRP  HH2          98 LYS  HB-         5.50    (#   2858:20  Unique         2.37, 4.09 A)
 &rst
  ixpk= 2858, nxpk= 20, iat=1171,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1603,1604,
 &end
#
#   12 GLY  HN           98 LYS  HB-         5.50    (#   2859:20  Unique         2.79, 4.14 A)
 &rst
  ixpk= 2859, nxpk= 20, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1603,1604,
 &end
#
#   98 LYS  HN           98 LYS  HB-         5.50    (#   2860:20  Unique         2.33, 2.87 A)
 &rst
  ixpk= 2860, nxpk= 20, iat=1599,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1603,1604,
 &end
#
#   98 LYS  HN           98 LYS  HG+         5.50    (#   2861:20  Unique         2.37, 4.10 A)
 &rst
  ixpk= 2861, nxpk= 20, iat=1599,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1606,1607,
 &end
#
#  100 PHE  HD           98 LYS  HG+         4.45    (#   2863:20  Unique         2.20, 5.70 A)
 &rst
  ixpk= 2863, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.61, r4= 6.36,
 igr1=1653,1661,
 igr2=1606,1607,
 &end
#
#   74 TRP  HH2          98 LYS  HG-         4.40    (#   2864:20  Unique         2.77, 4.52 A)
 &rst
  ixpk= 2864, nxpk= 20, iat=1171,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1606,1607,
 &end
#
#    0 AMB  20-2:2865    98 LYS  HG-         4.40    (#   2865:20  Single Ambig)
 &rst
  ixpk= 2865, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1621, 172,
 igr2=1606,1607,
 &end
#
#   98 LYS  HA           98 LYS  HG+         4.40    (#   2869:20  Unique         2.27, 3.16 A)
 &rst
  ixpk= 2869, nxpk= 20, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1606,1607,
 &end
#
#   98 LYS  HA           98 LYS  HG-         5.50    (#   2870:20  Unique         2.27, 3.16 A)
 &rst
  ixpk= 2870, nxpk= 20, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1606,1607,
 &end
#
#   98 LYS  HE+          98 LYS  HG+         3.50    (#   2871:20  Unique         2.09, 3.37 A)
 &rst
  ixpk= 2871, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1612,1613,
 igr2=1606,1607,
 &end
#
#   98 LYS  HE-          98 LYS  HG+         3.50    (#   2872:20  Unique         2.09, 3.37 A)
 &rst
  ixpk= 2872, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1612,1613,
 igr2=1606,1607,
 &end
#
#   98 LYS  HE-          98 LYS  HG-         4.40    (#   2873:20  Unique         2.09, 3.37 A)
 &rst
  ixpk= 2873, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1612,1613,
 igr2=1606,1607,
 &end
#
#   98 LYS  HE+          98 LYS  HG-         3.50    (#   2874:20  Unique         2.09, 3.37 A)
 &rst
  ixpk= 2874, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1612,1613,
 igr2=1606,1607,
 &end
#
#    0 AMB  20-2:2875    98 LYS  HG-         3.50    (#   2875:20  Single Ambig)
 &rst
  ixpk= 2875, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 700, 701, 702, 626, 627,
 igr2=1606,1607,
 &end
#
#    0 AMB  20-2:2876     0 AMB  20-1:2876   3.50    (#   2876:20  Double Ambig)
 &rst
  ixpk= 2876, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 700, 701, 702, 626, 627,
 igr2=1606,1607,1606,1607,
 &end
#
#   98 LYS  HB+          98 LYS  HG+         3.50    (#   2877:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2877, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1603,1604,
 igr2=1606,1607,
 &end
#
#   98 LYS  HB+          98 LYS  HG-         3.50    (#   2878:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2878, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1603,1604,
 igr2=1606,1607,
 &end
#
#   98 LYS  HD+          98 LYS  HG+         2.60    (#   2879:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2879, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1609,1610,
 igr2=1606,1607,
 &end
#
#   98 LYS  HD+          98 LYS  HG-         2.60    (#   2880:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2880, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1609,1610,
 igr2=1606,1607,
 &end
#
#    0 AMB  20-2:2881     0 AMB  20-1:2881   2.60    (#   2881:20  Double Ambig)
 &rst
  ixpk= 2881, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.63, r4= 5.38,
 igr1= 162, 163, 164, 166, 167, 168,1609,1610,
 igr2=1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:2882    98 LYS  HG-         2.60    (#   2882:20  Single Ambig)
 &rst
  ixpk= 2882, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 162, 163, 164, 166, 167, 168,1609,1610,
 igr2=1606,1607,
 &end
#
#   98 LYS  HB-          98 LYS  HG+         3.50    (#   2883:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2883, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1603,1604,
 igr2=1606,1607,
 &end
#
#   98 LYS  HB-          98 LYS  HG-         3.50    (#   2884:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2884, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1603,1604,
 igr2=1606,1607,
 &end
#
#   98 LYS  HB-          98 LYS  HD+         4.40    (#   2885:20  Unique         1.94, 3.20 A)
 &rst
  ixpk= 2885, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1603,1604,
 igr2=1609,1610,
 &end
#
#   98 LYS  HB-          98 LYS  HD-         4.40    (#   2886:20  Unique         1.94, 3.20 A)
 &rst
  ixpk= 2886, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1603,1604,
 igr2=1609,1610,
 &end
#
#   98 LYS  HG-          98 LYS  HD+         2.60    (#   2887:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2887, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1606,1607,
 igr2=1609,1610,
 &end
#
#   98 LYS  HG+          98 LYS  HD-         2.60    (#   2888:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2888, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1606,1607,
 igr2=1609,1610,
 &end
#
#   98 LYS  HB+          98 LYS  HD+         3.50    (#   2889:20  Unique         1.94, 3.20 A)
 &rst
  ixpk= 2889, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1603,1604,
 igr2=1609,1610,
 &end
#
#   98 LYS  HB+          98 LYS  HD-         3.50    (#   2890:20  Unique         1.94, 3.20 A)
 &rst
  ixpk= 2890, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1603,1604,
 igr2=1609,1610,
 &end
#
#   46 ALA  MB           98 LYS  HD+         2.60    (#   2891:20  Unique         1.93, 2.79 A)
 &rst
  ixpk= 2891, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 700, 701, 702,
 igr2=1609,1610,
 &end
#
#   46 ALA  MB           98 LYS  HD-         3.50    (#   2892:20  Unique         1.93, 2.79 A)
 &rst
  ixpk= 2892, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 700, 701, 702,
 igr2=1609,1610,
 &end
#
#    0 AMB  20-2:2893     0 AMB  20-1:2893   3.50    (#   2893:20  Double Ambig)
 &rst
  ixpk= 2893, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1612,1613,1254,1255,
 igr2=1609,1610,1206,1207,
 &end
#
#   98 LYS  HE+          98 LYS  HD+         4.40    (#   2894:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2894, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1612,1613,
 igr2=1609,1610,
 &end
#
#   98 LYS  HE+          98 LYS  HD-         4.40    (#   2895:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2895, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1612,1613,
 igr2=1609,1610,
 &end
#
#   98 LYS  HE-          98 LYS  HD-         3.50    (#   2896:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2896, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1612,1613,
 igr2=1609,1610,
 &end
#
#    0 AMB  20-2:2897    76 ARG  HG-         4.40    (#   2897:20  Single Ambig)
 &rst
  ixpk= 2897, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1209,1210,1550,1551,1586,1587,
 igr2=1206,1207,
 &end
#
#   76 ARG  HD+          76 ARG  HG-         5.50    (#   2898:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 2898, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1209,1210,
 igr2=1206,1207,
 &end
#
#   98 LYS  HA           98 LYS  HD+         5.50    (#   2899:20  Unique         2.58, 4.05 A)
 &rst
  ixpk= 2899, nxpk= 20, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1609,1610,
 &end
#
#   98 LYS  HA           98 LYS  HD-         5.50    (#   2900:20  Unique         2.58, 4.05 A)
 &rst
  ixpk= 2900, nxpk= 20, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1609,1610,
 &end
#
#   74 TRP  HH2          98 LYS  HD+         5.50    (#   2903:20  Unique         2.00, 3.20 A)
 &rst
  ixpk= 2903, nxpk= 20, iat=1171,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1609,1610,
 &end
#
#  100 PHE  HD           98 LYS  HD-         5.50    (#   2904:20  Unique         3.29, 6.02 A)
 &rst
  ixpk= 2904, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1653,1661,
 igr2=1609,1610,
 &end
#
#    0 AMB  20-2:2905    76 ARG  HG-         4.40    (#   2905:20  Single Ambig)
 &rst
  ixpk= 2905, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1199,1223,
 igr2=1206,1207,
 &end
#
#   98 LYS  HB-          98 LYS  HE+         4.40    (#   2906:20  Unique         2.08, 3.82 A)
 &rst
  ixpk= 2906, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1603,1604,
 igr2=1612,1613,
 &end
#
#   98 LYS  HB-          98 LYS  HE-         5.50    (#   2907:20  Unique         2.08, 3.82 A)
 &rst
  ixpk= 2907, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1603,1604,
 igr2=1612,1613,
 &end
#
#   98 LYS  HG-          98 LYS  HE+         2.60    (#   2908:20  Unique         2.09, 3.37 A)
 &rst
  ixpk= 2908, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1606,1607,
 igr2=1612,1613,
 &end
#
#   98 LYS  HG+          98 LYS  HE-         2.60    (#   2909:20  Unique         2.09, 3.37 A)
 &rst
  ixpk= 2909, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1606,1607,
 igr2=1612,1613,
 &end
#
#   98 LYS  HD-          98 LYS  HE+         3.50    (#   2910:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2910, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1609,1610,
 igr2=1612,1613,
 &end
#
#   98 LYS  HD-          98 LYS  HE-         2.60    (#   2911:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2911, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1609,1610,
 igr2=1612,1613,
 &end
#
#   98 LYS  HD+          98 LYS  HE-         2.60    (#   2912:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2912, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1609,1610,
 igr2=1612,1613,
 &end
#
#   98 LYS  HD+          98 LYS  HE+         3.50    (#   2913:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2913, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1609,1610,
 igr2=1612,1613,
 &end
#
#   98 LYS  HB+          98 LYS  HE-         4.40    (#   2914:20  Unique         2.08, 3.82 A)
 &rst
  ixpk= 2914, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1603,1604,
 igr2=1612,1613,
 &end
#
#   98 LYS  HB+          98 LYS  HE+         5.50    (#   2915:20  Unique         2.08, 3.82 A)
 &rst
  ixpk= 2915, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1603,1604,
 igr2=1612,1613,
 &end
#
#    0 AMB  20-2:2916     0 AMB  20-1:2916   4.40    (#   2916:20  Double Ambig)
 &rst
  ixpk= 2916, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.25, r4= 8.00,
 igr1= 700, 701, 702, 626, 627,
 igr2=1612,1613,1612,1613,
 &end
#
#    0 AMB  20-2:2917    98 LYS  HE-         3.50    (#   2917:20  Single Ambig)
 &rst
  ixpk= 2917, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 700, 701, 702, 626, 627,
 igr2=1612,1613,
 &end
#
#    0 AMB  20-2:2919    98 LYS  HE-         5.50    (#   2919:20  Single Ambig)
 &rst
  ixpk= 2919, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1160,1161,1625,1626,
 igr2=1612,1613,
 &end
#
#    0 AMB  20-2:2920     0 AMB  20-1:2920   5.50    (#   2920:20  Double Ambig)
 &rst
  ixpk= 2920, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 698,1120,
 igr2=1612,1613,1612,1613,
 &end
#
#    0 AMB  20-2:2921    98 LYS  HE-         5.50    (#   2921:20  Single Ambig)
 &rst
  ixpk= 2921, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 698,1120,
 igr2=1612,1613,
 &end
#
#   73 ASN  HA           98 LYS  HE+         5.50    (#   2922:20  Unique         6.22, 7.43 A)
 &rst
  ixpk= 2922, nxpk= 20, iat=1144,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1612,1613,
 &end
#
#  100 PHE  HE           98 LYS  HE+         5.50    (#   2923:20  Unique         1.96, 5.82 A)
 &rst
  ixpk= 2923, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1655,1659,
 igr2=1612,1613,
 &end
#
#   74 TRP  HH2          98 LYS  HE+         5.50    (#   2924:20  Unique         2.75, 3.85 A)
 &rst
  ixpk= 2924, nxpk= 20, iat=1171,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1612,1613,
 &end
#
#   74 TRP  HH2          98 LYS  HE-         5.50    (#   2925:20  Unique         2.75, 3.85 A)
 &rst
  ixpk= 2925, nxpk= 20, iat=1171,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1612,1613,
 &end
#
#   74 TRP  HD1          98 LYS  HE-         5.50    (#   2926:20  Unique         4.52, 5.68 A)
 &rst
  ixpk= 2926, nxpk= 20, iat=1164,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1612,1613,
 &end
#
#   74 TRP  HZ2          98 LYS  HE-         5.50    (#   2927:20  Unique         2.39, 3.74 A)
 &rst
  ixpk= 2927, nxpk= 20, iat=1169,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1612,1613,
 &end
#
#   74 TRP  HE1          98 LYS  HE-         5.50    (#   2928:20  Unique         3.23, 4.63 A)
 &rst
  ixpk= 2928, nxpk= 20, iat=1166,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1612,1613,
 &end
#
#   42 PRO  HD+           1 MET  HB+         5.50    (#   2929:20  Unique         3.38, 5.75 A)
 &rst
  ixpk= 2929, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 650, 651,
 igr2=   8,   9,
 &end
#
#   37 GLN  HA           37 GLN  HG-         5.50    (#   2930:20  Unique         2.17, 2.93 A)
 &rst
  ixpk= 2930, nxpk= 20, iat= 587,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 592, 593,
 &end
#
#   97 GLN  HA           97 GLN  HG-         5.50    (#   2931:20  Unique         2.04, 2.68 A)
 &rst
  ixpk= 2931, nxpk= 20, iat=1584,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1589,1590,
 &end
#
#   13 ILE  HN           37 GLN  HG-         5.50    (#   2932:20  Unique         3.17, 4.72 A)
 &rst
  ixpk= 2932, nxpk= 20, iat= 179,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 592, 593,
 &end
#
#    0 AMB  20-2:2933    97 GLN  HG-         4.40    (#   2933:20  Single Ambig)
 &rst
  ixpk= 2933, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1582,1631,
 igr2=1589,1590,
 &end
#
#    0 AMB  20-2:2934    97 GLN  HA          3.50    (#   2934:20  Single Ambig)
 &rst
  ixpk= 2934, nxpk= 20, iat=  -1,1584, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1589,1590,1586,1587,
 &end
#
#  100 PHE  HN           99 TRP  HA          3.50    (#   2935:20  Unique         2.14, 2.19 A)
 &rst
  ixpk= 2935, nxpk= 20, iat=1645,1623, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   99 TRP  HN           99 TRP  HA          3.50    (#   2936:20  Unique         2.93, 2.94 A)
 &rst
  ixpk= 2936, nxpk= 20, iat=1621,1623, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  100 PHE  HD           99 TRP  HA          4.40    (#   2937:20  Unique         3.52, 5.52 A)
 &rst
  ixpk= 2937, nxpk= 20, iat=  -1,1623, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1653,1661,
 &end
#
#   11 VAL  HA           99 TRP  HA          5.50    (#   2939:20  Unique         4.47, 4.89 A)
 &rst
  ixpk= 2939, nxpk= 20, iat= 158,1623, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:2940    99 TRP  HA          5.50    (#   2940:20  Single Ambig)
 &rst
  ixpk= 2940, nxpk= 20, iat=  -1,1623, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 174, 175, 174, 175,
 &end
#
#   71 THR  MG2          99 TRP  HB+         4.40    (#   2941:20  Unique         1.97, 3.56 A)
 &rst
  ixpk= 2941, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1110,1111,1112,
 igr2=1625,1626,
 &end
#
#   71 THR  MG2          99 TRP  HB-         3.50    (#   2942:20  Unique         1.97, 3.56 A)
 &rst
  ixpk= 2942, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1110,1111,1112,
 igr2=1625,1626,
 &end
#
#   99 TRP  HA           99 TRP  HB-         5.50    (#   2943:20  Unique         2.37, 2.72 A)
 &rst
  ixpk= 2943, nxpk= 20, iat=1623,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1625,1626,
 &end
#
#   99 TRP  HD1          99 TRP  HB-         4.40    (#   2944:20  Unique         2.55, 3.13 A)
 &rst
  ixpk= 2944, nxpk= 20, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1625,1626,
 &end
#
#   99 TRP  HD1          99 TRP  HB+         3.50    (#   2945:20  Unique         2.55, 3.13 A)
 &rst
  ixpk= 2945, nxpk= 20, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1625,1626,
 &end
#
#   14 VAL  MGX          99 TRP  HB+         5.50    (#   2946:20  Unique         3.29, 6.10 A)
 &rst
  ixpk= 2946, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=1625,1626,
 &end
#
#  147 VAL  MGX          99 TRP  HB+         5.50    (#   2947:20  Unique         1.99, 4.09 A)
 &rst
  ixpk= 2947, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=1625,1626,
 &end
#
#  100 PHE  HN           99 TRP  HB-         5.50    (#   2949:20  Unique         2.87, 3.57 A)
 &rst
  ixpk= 2949, nxpk= 20, iat=1645,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1625,1626,
 &end
#
#  100 PHE  HN          100 PHE  HB+         5.50    (#   2950:20  Unique         2.56, 3.13 A)
 &rst
  ixpk= 2950, nxpk= 20, iat=1645,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1649,1650,
 &end
#
#  100 PHE  HD          100 PHE  HB+         4.40    (#   2951:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 2951, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1653,1661,
 igr2=1649,1650,
 &end
#
#   50 MET  HB-         100 PHE  HB+         3.50    (#   2952:20  Unique         4.25, 5.29 A)
 &rst
  ixpk= 2952, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 752, 753,
 igr2=1649,1650,
 &end
#
#  101 LEU  MDX         101 LEU  HA          2.60    (#   2953:20  Unique         1.96, 3.75 A)
 &rst
  ixpk= 2953, nxpk= 20, iat=  -1,1667, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#  101 LEU  HB+         101 LEU  HA          3.50    (#   2954:20  Unique         2.30, 2.68 A)
 &rst
  ixpk= 2954, nxpk= 20, iat=  -1,1667, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1669,1670,
 &end
#
#    0 AMB  20-2:2955   101 LEU  HA          4.40    (#   2955:20  Single Ambig)
 &rst
  ixpk= 2955, nxpk= 20, iat=  -1,1667, r1= 0.00, r2= 1.80, r3= 7.25, r4= 8.00,
 igr1= 227, 228, 229,1073,1074,1075,1077,1078,1079, 185,
       186, 187, 224, 225,2570,2571,2572,2574,2575,2576,
      
 &end
#
#  101 LEU  HN          101 LEU  HA          4.40    (#   2957:20  Unique         2.93, 2.94 A)
 &rst
  ixpk= 2957, nxpk= 20, iat=1665,1667, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  102 LEU  HN          101 LEU  HA          3.50    (#   2958:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 2958, nxpk= 20, iat=1684,1667, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   14 VAL  HB          101 LEU  HA          5.50    (#   2959:20  Unique         1.97, 2.48 A)
 &rst
  ixpk= 2959, nxpk= 20, iat= 202,1667, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  MDY         101 LEU  HB+         3.50    (#   2961:20  Unique         1.98, 3.36 A)
 &rst
  ixpk= 2961, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=1669,1670,
 &end
#
#  101 LEU  MDX         101 LEU  HB+         4.40    (#   2962:20  Unique         1.98, 3.36 A)
 &rst
  ixpk= 2962, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=1669,1670,
 &end
#
#   69 ALA  MB          101 LEU  HB+         5.50    (#   2964:20  Unique         1.98, 4.28 A)
 &rst
  ixpk= 2964, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1087,1088,1089,
 igr2=1669,1670,
 &end
#
#  151 PHE  HD          101 LEU  HB+         4.40    (#   2965:20  Unique         2.55, 3.73 A)
 &rst
  ixpk= 2965, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2515,2523,
 igr2=1669,1670,
 &end
#
#  101 LEU  HA          101 LEU  HB+         5.50    (#   2966:20  Unique         2.30, 2.68 A)
 &rst
  ixpk= 2966, nxpk= 20, iat=1667,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1669,1670,
 &end
#
#  111 ILE  QD1         104 LEU  MDY         3.50    (#   2967:20  Unique         2.64, 6.14 A)
 &rst
  ixpk= 2967, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1823,1824,1825,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  111 ILE  QG2         104 LEU  MDY         5.50    (#   2968:20  Unique         5.76, 8.22 A)
 &rst
  ixpk= 2968, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1816,1817,1818,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  111 ILE  HG1+        104 LEU  MDY         5.50    (#   2969:20  Unique         2.71, 5.23 A)
 &rst
  ixpk= 2969, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1820,1821,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  101 LEU  MDY         101 LEU  HG          3.50    (#   2970:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 2970, nxpk= 20, iat=  -1,1672, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:2971     0 AMB  20-1:2971   2.60    (#   2971:20  Double Ambig)
 &rst
  ixpk= 2971, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.82, r4= 6.57,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,1674,1675,1676,1678,1679,1680,
 igr2=1729,1730,1731,1733,1734,1735,1672,
 &end
#
#    0 AMB  20-2:2972     0 AMB  20-1:2972   2.60    (#   2972:20  Double Ambig)
 &rst
  ixpk= 2972, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.97, r4= 5.72,
 igr1=1068,1069,1724,1725, 350, 351, 352,
 igr2=1672,1729,1730,1731,1733,1734,1735,
 &end
#
#   60 LEU  HG          104 LEU  MDY         4.40    (#   2973:20  Unique         1.97, 4.04 A)
 &rst
  ixpk= 2973, nxpk= 20, iat= 924,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:2974     0 AMB  20-1:2974   3.50    (#   2974:20  Double Ambig)
 &rst
  ixpk= 2974, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.85, r4= 7.60,
 igr1= 218,2612,2613,1854,1855,1856, 310, 311,
 igr2=1729,1730,1731,1733,1734,1735,1672,
 &end
#
#    0 AMB  20-2:2975   104 LEU  MDY         3.50    (#   2975:20  Single Ambig)
 &rst
  ixpk= 2975, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1724,1725,1799,1800,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:2976   104 LEU  MDY         3.50    (#   2976:20  Single Ambig)
 &rst
  ixpk= 2976, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1777,1778, 248, 249,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  108 ASP  HA          104 LEU  MDY         3.50    (#   2977:20  Unique         2.12, 4.44 A)
 &rst
  ixpk= 2977, nxpk= 20, iat=1775,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  104 LEU  HA          104 LEU  MDY         4.40    (#   2978:20  Unique         1.99, 3.66 A)
 &rst
  ixpk= 2978, nxpk= 20, iat=1722,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:2979     0 AMB  20-1:2979   5.50    (#   2979:20  Double Ambig)
 &rst
  ixpk= 2979, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.54, r4= 9.29,
 igr1=2509, 216,
 igr2=1672,1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:2981     0 AMB  20-1:2981   4.40    (#   2981:20  Double Ambig)
 &rst
  ixpk= 2981, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.31, r4= 8.06,
 igr1=2058,2104,2109,
 igr2=1729,1730,1731,1733,1734,1735,1672,
 &end
#
#  126 TRP  HZ2         104 LEU  MDY         2.60    (#   2983:20  Unique         3.16, 5.35 A)
 &rst
  ixpk= 2983, nxpk= 20, iat=2056,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:2984   104 LEU  MDY         4.40    (#   2984:20  Single Ambig)
 &rst
  ixpk= 2984, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1773,1766,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  104 LEU  HN          104 LEU  MDY         4.40    (#   2985:20  Unique         3.59, 4.96 A)
 &rst
  ixpk= 2985, nxpk= 20, iat=1720,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  105 VAL  HN          104 LEU  MDY         5.50    (#   2986:20  Unique         2.07, 4.71 A)
 &rst
  ixpk= 2986, nxpk= 20, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  20-2:2988     0 AMB  20-1:2988   5.50    (#   2988:20  Double Ambig)
 &rst
  ixpk= 2988, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2564, 910,2056,
 igr2=1674,1675,1676,1678,1679,1680, 926, 927, 928, 930,
       931, 932,
 &end
#
#  151 PHE  HA          101 LEU  MDX         3.50    (#   2989:20  Unique         1.95, 4.53 A)
 &rst
  ixpk= 2989, nxpk= 20, iat=2509,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#   16 CYS  HB+         101 LEU  MDX         4.40    (#   2990:20  Unique         1.98, 4.47 A)
 &rst
  ixpk= 2990, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 237, 238,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#   16 CYS  HB-         101 LEU  MDX         4.40    (#   2991:20  Unique         1.98, 4.47 A)
 &rst
  ixpk= 2991, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 237, 238,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:2992   101 LEU  MDX         3.50    (#   2992:20  Single Ambig)
 &rst
  ixpk= 2992, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1707,1708,2457,2458,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  101 LEU  HB-         101 LEU  MDY         3.50    (#   2993:20  Unique         1.98, 3.36 A)
 &rst
  ixpk= 2993, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1669,1670,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  154 VAL  MGY         101 LEU  MDY         2.60    (#   2995:20  Unique         1.99, 5.19 A)
 &rst
  ixpk= 2995, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2554,2555,2556,2558,2559,2560,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:2996   101 LEU  MDY         2.60    (#   2996:20  Single Ambig)
 &rst
  ixpk= 2996, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.44, r4= 6.19,
 igr1=1669,1670,2554,2555,2556,2558,2559,2560,1073,1074,
      1075,1077,1078,1079,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:2997   101 LEU  MDY         2.60    (#   2997:20  Single Ambig)
 &rst
  ixpk= 2997, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1068,1069,1087,1088,1089,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  103 GLN  HB-         101 LEU  MDY         4.40    (#   2998:20  Unique         4.08, 6.19 A)
 &rst
  ixpk= 2998, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1707,1708,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:2999   101 LEU  MDY         4.40    (#   2999:20  Single Ambig)
 &rst
  ixpk= 2999, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2612,2613, 224, 225,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:3000   101 LEU  MDY         3.50    (#   3000:20  Single Ambig)
 &rst
  ixpk= 3000, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2552, 202,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  151 PHE  HB-         101 LEU  MDY         4.40    (#   3001:20  Unique         1.93, 4.54 A)
 &rst
  ixpk= 3001, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2511,2512,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  151 PHE  HB+         101 LEU  MDY         3.50    (#   3002:20  Unique         1.93, 4.54 A)
 &rst
  ixpk= 3002, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2511,2512,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  151 PHE  HA          101 LEU  MDY         5.50    (#   3003:20  Unique         1.95, 4.53 A)
 &rst
  ixpk= 3003, nxpk= 20, iat=2509,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  101 LEU  HA          101 LEU  MDY         5.50    (#   3004:20  Unique         1.96, 3.75 A)
 &rst
  ixpk= 3004, nxpk= 20, iat=1667,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  151 PHE  HD          101 LEU  MDY         3.50    (#   3005:20  Unique         2.46, 5.47 A)
 &rst
  ixpk= 3005, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2515,2523,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  155 VAL  HN          101 LEU  MDY         5.50    (#   3006:20  Unique         3.95, 5.70 A)
 &rst
  ixpk= 3006, nxpk= 20, iat=2564,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#   69 ALA  HN          101 LEU  MDY         5.50    (#   3007:20  Unique         2.36, 4.90 A)
 &rst
  ixpk= 3007, nxpk= 20, iat=1083,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  101 LEU  HN          101 LEU  MDY         5.50    (#   3008:20  Unique         4.05, 5.22 A)
 &rst
  ixpk= 3008, nxpk= 20, iat=1665,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:3009   101 LEU  MDY         5.50    (#   3009:20  Single Ambig)
 &rst
  ixpk= 3009, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1093,2580,2094,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  102 LEU  HN          101 LEU  MDY         5.50    (#   3010:20  Unique         1.94, 4.25 A)
 &rst
  ixpk= 3010, nxpk= 20, iat=1684,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  20-2:3012   102 LEU  HA          2.60    (#   3012:20  Single Ambig)
 &rst
  ixpk= 3012, nxpk= 20, iat=  -1,1686, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1693,1694,1695,1697,1698,1699,1073,1074,1075,1077,
      1078,1079,
 &end
#
#  102 LEU  MDY         102 LEU  HA          3.50    (#   3013:20  Unique         1.98, 4.38 A)
 &rst
  ixpk= 3013, nxpk= 20, iat=  -1,1686, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:3014   102 LEU  HA          4.40    (#   3014:20  Single Ambig)
 &rst
  ixpk= 3014, nxpk= 20, iat=  -1,1686, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1051,1052,1053, 220, 221, 222,
 &end
#
#  102 LEU  HB-         102 LEU  HA          5.50    (#   3015:20  Unique         2.22, 2.52 A)
 &rst
  ixpk= 3015, nxpk= 20, iat=  -1,1686, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1688,1689,
 &end
#
#    0 AMB  20-2:3016   102 LEU  HA          3.50    (#   3016:20  Single Ambig)
 &rst
  ixpk= 3016, nxpk= 20, iat=  -1,1686, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1691,1028,1029,
 &end
#
#  102 LEU  HB+         102 LEU  HA          3.50    (#   3017:20  Unique         2.22, 2.52 A)
 &rst
  ixpk= 3017, nxpk= 20, iat=  -1,1686, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1688,1689,
 &end
#
#    0 AMB  20-2:3018   102 LEU  HA          5.50    (#   3018:20  Single Ambig)
 &rst
  ixpk= 3018, nxpk= 20, iat=  -1,1686, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1707,1708,1049,
 &end
#
#   67 ILE  HA          102 LEU  HA          4.40    (#   3019:20  Unique         1.99, 2.40 A)
 &rst
  ixpk= 3019, nxpk= 20, iat=1047,1686, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  103 GLN  HN          102 LEU  HA          3.50    (#   3020:20  Unique         2.14, 2.24 A)
 &rst
  ixpk= 3020, nxpk= 20, iat=1703,1686, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   68 LEU  HN          102 LEU  HA          4.40    (#   3021:20  Unique         2.20, 2.48 A)
 &rst
  ixpk= 3021, nxpk= 20, iat=1064,1686, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  102 LEU  HN          102 LEU  HA          5.50    (#   3022:20  Unique         2.94, 2.94 A)
 &rst
  ixpk= 3022, nxpk= 20, iat=1684,1686, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  102 LEU  HN          102 LEU  HB+         4.40    (#   3023:20  Unique         2.40, 3.51 A)
 &rst
  ixpk= 3023, nxpk= 20, iat=1684,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1688,1689,
 &end
#
#  102 LEU  HN          102 LEU  HB-         5.50    (#   3024:20  Unique         2.40, 3.51 A)
 &rst
  ixpk= 3024, nxpk= 20, iat=1684,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1688,1689,
 &end
#
#    0 AMB  20-2:3025     0 AMB  20-1:3025   5.50    (#   3025:20  Double Ambig)
 &rst
  ixpk= 3025, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1703,1045,
 igr2=1688,1689,1688,1689,
 &end
#
#    0 AMB  20-2:3026   102 LEU  HB-         5.50    (#   3026:20  Single Ambig)
 &rst
  ixpk= 3026, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1703,1045,
 igr2=1688,1689,
 &end
#
#  102 LEU  HA          102 LEU  HB+         5.50    (#   3027:20  Unique         2.22, 2.52 A)
 &rst
  ixpk= 3027, nxpk= 20, iat=1686,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1688,1689,
 &end
#
#  102 LEU  HA          102 LEU  HB-         4.40    (#   3028:20  Unique         2.22, 2.52 A)
 &rst
  ixpk= 3028, nxpk= 20, iat=1686,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1688,1689,
 &end
#
#  102 LEU  HG          102 LEU  HB+         4.40    (#   3029:20  Unique         2.25, 2.76 A)
 &rst
  ixpk= 3029, nxpk= 20, iat=1691,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1688,1689,
 &end
#
#  102 LEU  HG          102 LEU  HB-         4.40    (#   3030:20  Unique         2.25, 2.76 A)
 &rst
  ixpk= 3030, nxpk= 20, iat=1691,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1688,1689,
 &end
#
#    0 AMB  20-2:3031     0 AMB  20-1:3031   2.60    (#   3031:20  Double Ambig)
 &rst
  ixpk= 3031, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1693,1694,1695,1697,1698,1699, 227, 228, 229,
 igr2=1688,1689,1688,1689,
 &end
#
#    0 AMB  20-2:3032     0 AMB  20-1:3032   2.60    (#   3032:20  Double Ambig)
 &rst
  ixpk= 3032, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=1011,1012,1013,1015,1016,1017,1693,1694,1695,1697,
      1698,1699,
 igr2=1688,1689,1688,1689,
 &end
#
#    0 AMB  20-2:3033   102 LEU  HB-         2.60    (#   3033:20  Single Ambig)
 &rst
  ixpk= 3033, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1011,1012,1013,1015,1016,1017,1693,1694,1695,1697,
      1698,1699,
 igr2=1688,1689,
 &end
#
#    0 AMB  20-2:3034   102 LEU  HB-         2.60    (#   3034:20  Single Ambig)
 &rst
  ixpk= 3034, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1693,1694,1695,1697,1698,1699, 227, 228, 229,
 igr2=1688,1689,
 &end
#
#  102 LEU  HN          102 LEU  HG          5.50    (#   3035:20  Unique         2.08, 2.37 A)
 &rst
  ixpk= 3035, nxpk= 20, iat=1684,1691, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:3036   102 LEU  HG          5.50    (#   3036:20  Single Ambig)
 &rst
  ixpk= 3036, nxpk= 20, iat=  -1,1691, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1021,1665,
 &end
#
#  102 LEU  HA          102 LEU  HG          5.50    (#   3038:20  Unique         2.46, 3.62 A)
 &rst
  ixpk= 3038, nxpk= 20, iat=1686,1691, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:3040   102 LEU  HG          2.60    (#   3040:20  Single Ambig)
 &rst
  ixpk= 3040, nxpk= 20, iat=  -1,1691, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1688,1689,1055,1056,
 &end
#
#    0 AMB  20-2:3041   102 LEU  HG          2.60    (#   3041:20  Single Ambig)
 &rst
  ixpk= 3041, nxpk= 20, iat=  -1,1691, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 227, 228, 229,1693,1694,1695,1697,1698,1699, 185,
       186, 187,
 &end
#
#    0 AMB  20-2:3042   102 LEU  HG          5.50    (#   3042:20  Single Ambig)
 &rst
  ixpk= 3042, nxpk= 20, iat=  -1,1691, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1009, 713, 714,
 &end
#
#   51 TYR  HE          102 LEU  MDX         5.50    (#   3043:20  Unique         3.52, 6.60 A)
 &rst
  ixpk= 3043, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 775, 780,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   77 TYR  HE            0 AMB  20-1:3044   5.50    (#   3044:20  Single Ambig)
 &rst
  ixpk= 3044, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1233,1238,
 igr2=2301,2302,1275,1276,1277,1279,1280,1281,
 &end
#
#  102 LEU  HN          102 LEU  MDY         4.40    (#   3045:20  Unique         2.35, 4.04 A)
 &rst
  ixpk= 3045, nxpk= 20, iat=1684,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   68 LEU  HN          102 LEU  MDY         5.50    (#   3046:20  Unique         2.60, 5.62 A)
 &rst
  ixpk= 3046, nxpk= 20, iat=1064,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:3047   102 LEU  MDY         3.50    (#   3047:20  Single Ambig)
 &rst
  ixpk= 3047, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1045,1703,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#  100 PHE  HD          102 LEU  MDY         4.40    (#   3048:20  Unique         2.36, 5.92 A)
 &rst
  ixpk= 3048, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1653,1661,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   51 TYR  HE          102 LEU  MDY         5.50    (#   3049:20  Unique         3.52, 6.60 A)
 &rst
  ixpk= 3049, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 775, 780,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#  102 LEU  HA          102 LEU  MDY         4.40    (#   3050:20  Unique         1.98, 4.38 A)
 &rst
  ixpk= 3050, nxpk= 20, iat=1686,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#  101 LEU  HA          102 LEU  MDY         5.50    (#   3051:20  Unique         2.77, 5.13 A)
 &rst
  ixpk= 3051, nxpk= 20, iat=1667,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   15 ILE  HA          102 LEU  MDY         5.50    (#   3052:20  Unique         4.28, 5.59 A)
 &rst
  ixpk= 3052, nxpk= 20, iat= 216,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   51 TYR  HA          102 LEU  MDY         4.40    (#   3054:20  Unique         5.01, 6.92 A)
 &rst
  ixpk= 3054, nxpk= 20, iat= 767,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:3056   102 LEU  MDY         2.60    (#   3056:20  Single Ambig)
 &rst
  ixpk= 3056, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.91, r4= 6.66,
 igr1= 192, 193, 194, 189, 190,1674,1675,1676,1678,1679,
      1680, 926, 927, 928, 930, 931, 932, 926, 927, 928,
       930, 931, 932,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#  102 LEU  HB-         102 LEU  MDY         3.50    (#   3057:20  Unique         2.00, 3.26 A)
 &rst
  ixpk= 3057, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1688,1689,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:3058   102 LEU  MDY         4.40    (#   3058:20  Single Ambig)
 &rst
  ixpk= 3058, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.09, r4= 9.84,
 igr1=1672,1729,1730,1731,1733,1734,1735,2554,2555,2556,
      2558,2559,2560,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#  102 LEU  HG          102 LEU  MDY         2.60    (#   3059:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 3059, nxpk= 20, iat=1691,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:3060   102 LEU  MDY         2.60    (#   3060:20  Single Ambig)
 &rst
  ixpk= 3060, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1688,1689, 755, 756,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:3061   102 LEU  MDY         5.50    (#   3061:20  Single Ambig)
 &rst
  ixpk= 3061, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1= 218, 814, 815,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   65 VAL  HB          102 LEU  MDY         4.40    (#   3062:20  Unique         1.96, 5.82 A)
 &rst
  ixpk= 3062, nxpk= 20, iat=1009,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#  100 PHE  HB+         102 LEU  MDY         4.40    (#   3063:20  Unique         1.97, 4.34 A)
 &rst
  ixpk= 3063, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1649,1650,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#   65 VAL  HA          102 LEU  MDY         5.50    (#   3064:20  Unique         4.11, 6.74 A)
 &rst
  ixpk= 3064, nxpk= 20, iat=1007,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:3066   103 GLN  HA          3.50    (#   3066:20  Single Ambig)
 &rst
  ixpk= 3066, nxpk= 20, iat=  -1,1705, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2617,2618,2619,2621,2622,2623,2617,2618,2619,2621,
      2622,2623,1693,1694,1695,1697,1698,1699,2554,2555,
      2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:3067   103 GLN  HA          5.50    (#   3067:20  Single Ambig)
 &rst
  ixpk= 3067, nxpk= 20, iat=  -1,1705, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 218, 310, 311,
 &end
#
#  103 GLN  HN          103 GLN  HA          5.50    (#   3068:20  Unique         2.85, 2.90 A)
 &rst
  ixpk= 3068, nxpk= 20, iat=1703,1705, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   16 CYS  HN          103 GLN  HA          3.50    (#   3069:20  Unique         2.14, 2.31 A)
 &rst
  ixpk= 3069, nxpk= 20, iat= 233,1705, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   65 VAL  HN           63 LYS  HB+         5.50    (#   3070:20  Unique         5.08, 5.32 A)
 &rst
  ixpk= 3070, nxpk= 20, iat=1005,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 975, 976,
 &end
#
#   63 LYS  HE+          63 LYS  HB+         5.50    (#   3071:20  Unique         2.97, 4.06 A)
 &rst
  ixpk= 3071, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 984, 985,
 igr2= 975, 976,
 &end
#
#  103 GLN  HE2-        103 GLN  HG+         4.40    (#   3073:20  Unique         2.12, 3.35 A)
 &rst
  ixpk= 3073, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1715,1716,
 igr2=1710,1711,
 &end
#
#  104 LEU  HN          103 GLN  HG+         4.40    (#   3075:20  Unique         2.16, 3.18 A)
 &rst
  ixpk= 3075, nxpk= 20, iat=1720,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1710,1711,
 &end
#
#  103 GLN  HN          103 GLN  HG+         5.50    (#   3076:20  Unique         3.64, 4.22 A)
 &rst
  ixpk= 3076, nxpk= 20, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1710,1711,
 &end
#
#  105 VAL  HN          103 GLN  HG+         5.50    (#   3077:20  Unique         4.04, 4.94 A)
 &rst
  ixpk= 3077, nxpk= 20, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1710,1711,
 &end
#
#    0 AMB  20-2:3079     0 AMB  20-1:3079   5.50    (#   3079:20  Double Ambig)
 &rst
  ixpk= 3079, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.07, r4= 8.82,
 igr1=1538,1539,1268, 665, 666,
 igr2=1246, 672,
 &end
#
#    0 AMB  20-2:3080     0 AMB  20-1:3080   3.50    (#   3080:20  Double Ambig)
 &rst
  ixpk= 3080, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1720,1244,
 igr2=1722,1246,
 &end
#
#    0 AMB  20-2:3081     0 AMB  20-1:3081   4.40    (#   3081:20  Double Ambig)
 &rst
  ixpk= 3081, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1724,1725, 725, 726,
 igr2=1722, 672,
 &end
#
#  104 LEU  MDX         104 LEU  HA          3.50    (#   3082:20  Unique         1.99, 3.66 A)
 &rst
  ixpk= 3082, nxpk= 20, iat=  -1,1722, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1729,1730,1731,1733,1734,1735,
 &end
#
#  104 LEU  MDX         104 LEU  HB+         3.50    (#   3083:20  Unique         2.18, 3.29 A)
 &rst
  ixpk= 3083, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1724,1725,
 &end
#
#  104 LEU  MDX         104 LEU  HB-         3.50    (#   3084:20  Unique         2.18, 3.29 A)
 &rst
  ixpk= 3084, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1724,1725,
 &end
#
#  104 LEU  MDY         104 LEU  HB+         3.50    (#   3085:20  Unique         2.18, 3.29 A)
 &rst
  ixpk= 3085, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1724,1725,
 &end
#
#  104 LEU  MDY         104 LEU  HB-         3.50    (#   3086:20  Unique         2.18, 3.29 A)
 &rst
  ixpk= 3086, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1724,1725,
 &end
#
#    0 AMB  20-2:3087     0 AMB  20-1:3087   5.50    (#   3087:20  Double Ambig)
 &rst
  ixpk= 3087, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.76, r4=11.51,
 igr1= 310, 311, 286, 287,2615,2612,2613,
 igr2=1724,1725,1724,1725,1724,1725,1724,1725,
 &end
#
#   15 ILE  HB          104 LEU  HB-         4.40    (#   3088:20  Unique         4.09, 5.24 A)
 &rst
  ixpk= 3088, nxpk= 20, iat= 218,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1724,1725,
 &end
#
#  104 LEU  HA          104 LEU  HB+         5.50    (#   3089:20  Unique         2.51, 2.80 A)
 &rst
  ixpk= 3089, nxpk= 20, iat=1722,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1724,1725,
 &end
#
#    0 AMB  20-2:3090     0 AMB  20-1:3090   5.50    (#   3090:20  Double Ambig)
 &rst
  ixpk= 3090, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2058,1715,1716,
 igr2=1724,1725,1724,1725,
 &end
#
#  104 LEU  HN          104 LEU  HB+         4.40    (#   3091:20  Unique         2.11, 2.55 A)
 &rst
  ixpk= 3091, nxpk= 20, iat=1720,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1724,1725,
 &end
#
#  104 LEU  HN          104 LEU  HB-         5.50    (#   3092:20  Unique         2.11, 2.55 A)
 &rst
  ixpk= 3092, nxpk= 20, iat=1720,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1724,1725,
 &end
#
#  155 VAL  HA          155 VAL  MGY         2.60    (#   3095:20  Unique         2.18, 3.22 A)
 &rst
  ixpk= 3095, nxpk= 20, iat=2566,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:3096   155 VAL  MGY         4.40    (#   3096:20  Single Ambig)
 &rst
  ixpk= 3096, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2098,2099, 237, 238,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#  152 ALA  HA          155 VAL  MGY         4.40    (#   3097:20  Unique         1.95, 3.85 A)
 &rst
  ixpk= 3097, nxpk= 20, iat=2529,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#  129 TYR  HD          155 VAL  MGY         2.60    (#   3098:20  Unique         2.28, 5.07 A)
 &rst
  ixpk= 3098, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2102,2111,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:3099     0 AMB  20-1:3099   3.50    (#   3099:20  Double Ambig)
 &rst
  ixpk= 3099, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1720,1199,
 igr2=1729,1730,1731,1733,1734,1735,1189,1190,1191,1193,
      1194,1195,1073,1074,1075,1077,1078,1079,
 &end
#
#  105 VAL  MGX         105 VAL  HA          2.60    (#   3101:20  Unique         2.26, 3.31 A)
 &rst
  ixpk= 3101, nxpk= 20, iat=  -1,1741, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  20-2:3102     0 AMB  20-1:3102   2.60    (#   3102:20  Double Ambig)
 &rst
  ixpk= 3102, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1745,1746,1747,1749,1750,1751,1370,1371,1372,1374,
      1375,1376,
 igr2=1741,1295,
 &end
#
#  105 VAL  HB          105 VAL  HA          3.50    (#   3103:20  Unique         2.27, 2.71 A)
 &rst
  ixpk= 3103, nxpk= 20, iat=1743,1741, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3104     0 AMB  20-1:3104   5.50    (#   3104:20  Double Ambig)
 &rst
  ixpk= 3104, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1722,1246,
 igr2=1741,1295,
 &end
#
#  106 SER  HN          105 VAL  HA          3.50    (#   3105:20  Unique         3.45, 3.53 A)
 &rst
  ixpk= 3105, nxpk= 20, iat=1755,1741, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  105 VAL  HN          105 VAL  HA          3.50    (#   3106:20  Unique         2.86, 2.91 A)
 &rst
  ixpk= 3106, nxpk= 20, iat=1739,1741, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  105 VAL  MGX         105 VAL  HB          2.60    (#   3107:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 3107, nxpk= 20, iat=  -1,1743, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#  105 VAL  MGY         105 VAL  HB          2.60    (#   3108:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 3108, nxpk= 20, iat=  -1,1743, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#  143 VAL  MGY         143 VAL  HB          2.60    (#   3109:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 3109, nxpk= 20, iat=  -1,2356, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#    0 AMB  20-2:3110     0 AMB  20-1:3110   2.60    (#   3110:20  Double Ambig)
 &rst
  ixpk= 3110, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2477,2478,2304,2305,2396,2397,
 igr2=2474,2475,2251,2474,2475,
 &end
#
#    0 AMB  20-2:3111     0 AMB  20-1:3111   2.60    (#   3111:20  Double Ambig)
 &rst
  ixpk= 3111, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2480,2481,2477,2478,2396,2397,
 igr2=2474,2475,2474,2475,2474,2475,
 &end
#
#  137 VAL  HA          137 VAL  HB          2.60    (#   3112:20  Unique         2.37, 2.71 A)
 &rst
  ixpk= 3112, nxpk= 20, iat=2249,2251, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    0 AMB  20-2:3113     0 AMB  20-1:3113   3.50    (#   3113:20  Double Ambig)
 &rst
  ixpk= 3113, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1741,2472,
 igr2=1743,2474,2475,
 &end
#
#    0 AMB  20-2:3114     0 AMB  20-1:3114   3.50    (#   3114:20  Double Ambig)
 &rst
  ixpk= 3114, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1755, 616,
 igr2=1743, 135, 136,
 &end
#
#    0 AMB  20-2:3115     0 AMB  20-1:3115   3.50    (#   3115:20  Double Ambig)
 &rst
  ixpk= 3115, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2130,1171,
 igr2=2474,2475, 135, 136,
 &end
#
#  150 GLU  HN          149 LYS  HB+         3.50    (#   3116:20  Unique         2.43, 3.41 A)
 &rst
  ixpk= 3116, nxpk= 20, iat=2492,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2474,2475,
 &end
#
#    0 AMB  20-2:3117     0 AMB  20-1:3117   2.60    (#   3117:20  Double Ambig)
 &rst
  ixpk= 3117, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2470,2263,
 igr2=2474,2475,2251,
 &end
#
#    0 AMB  20-2:3131     0 AMB  20-1:3131   5.50    (#   3131:20  Double Ambig)
 &rst
  ixpk= 3131, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1759,1760,1759,1760,
 &end
#
#  104 LEU  MDX         106 SER  HB-         5.50    (#   3132:20  Unique         3.78, 5.79 A)
 &rst
  ixpk= 3132, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1759,1760,
 &end
#
#  110 GLU  HG-         106 SER  HB+         5.50    (#   3133:20  Unique         2.00, 2.99 A)
 &rst
  ixpk= 3133, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1802,1803,
 igr2=1759,1760,
 &end
#
#  110 GLU  HG+         106 SER  HB+         5.50    (#   3134:20  Unique         2.00, 2.99 A)
 &rst
  ixpk= 3134, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1802,1803,
 igr2=1759,1760,
 &end
#
#  110 GLU  HG-         106 SER  HB-         4.40    (#   3135:20  Unique         2.00, 2.99 A)
 &rst
  ixpk= 3135, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1802,1803,
 igr2=1759,1760,
 &end
#
#  110 GLU  HG+         106 SER  HB-         4.40    (#   3136:20  Unique         2.00, 2.99 A)
 &rst
  ixpk= 3136, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1802,1803,
 igr2=1759,1760,
 &end
#
#   64 ASP  HB+         106 SER  HB-         5.50    (#   3137:20  Unique         1.97, 3.67 A)
 &rst
  ixpk= 3137, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 997, 998,
 igr2=1759,1760,
 &end
#
#   64 ASP  HB+         106 SER  HB+         5.50    (#   3138:20  Unique         1.97, 3.67 A)
 &rst
  ixpk= 3138, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 997, 998,
 igr2=1759,1760,
 &end
#
#  106 SER  HN          106 SER  HB+         3.50    (#   3141:20  Unique         2.08, 2.72 A)
 &rst
  ixpk= 3141, nxpk= 20, iat=1755,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1759,1760,
 &end
#
#  106 SER  HN          106 SER  HB-         3.50    (#   3142:20  Unique         2.08, 2.72 A)
 &rst
  ixpk= 3142, nxpk= 20, iat=1755,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1759,1760,
 &end
#
#  107 GLY  HN          106 SER  HB+         3.50    (#   3143:20  Unique         1.94, 2.54 A)
 &rst
  ixpk= 3143, nxpk= 20, iat=1766,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1759,1760,
 &end
#
#  107 GLY  HN          106 SER  HB-         3.50    (#   3144:20  Unique         1.94, 2.54 A)
 &rst
  ixpk= 3144, nxpk= 20, iat=1766,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1759,1760,
 &end
#
#    0 AMB  20-2:3145   107 GLY  HA-         2.60    (#   3145:20  Single Ambig)
 &rst
  ixpk= 3145, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1773,1766,
 igr2=1768,1769,
 &end
#
#  104 LEU  HN          107 GLY  HA-         5.50    (#   3146:20  Unique         6.17, 7.35 A)
 &rst
  ixpk= 3146, nxpk= 20, iat=1720,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1768,1769,
 &end
#
#  108 ASP  HN          108 ASP  HA          2.60    (#   3149:20  Unique         2.76, 2.83 A)
 &rst
  ixpk= 3149, nxpk= 20, iat=1773,1775, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  109 ALA  HN          108 ASP  HA          3.50    (#   3150:20  Unique         3.36, 3.44 A)
 &rst
  ixpk= 3150, nxpk= 20, iat=1785,1775, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  110 GLU  HN          108 ASP  HA          5.50    (#   3151:20  Unique         3.36, 3.58 A)
 &rst
  ixpk= 3151, nxpk= 20, iat=1795,1775, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  108 ASP  HB+         108 ASP  HA          2.60    (#   3154:20  Unique         2.30, 2.47 A)
 &rst
  ixpk= 3154, nxpk= 20, iat=  -1,1775, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1777,1778,
 &end
#
#    0 AMB  20-2:3155   108 ASP  HA          4.40    (#   3155:20  Single Ambig)
 &rst
  ixpk= 3155, nxpk= 20, iat=  -1,1775, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1814,1789,1790,1791,
 &end
#
#  111 ILE  HG1-        108 ASP  HA          5.50    (#   3156:20  Unique         1.95, 2.75 A)
 &rst
  ixpk= 3156, nxpk= 20, iat=  -1,1775, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1820,1821,
 &end
#
#  104 LEU  MDY         108 ASP  HA          2.60    (#   3157:20  Unique         2.12, 4.44 A)
 &rst
  ixpk= 3157, nxpk= 20, iat=  -1,1775, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1729,1730,1731,1733,1734,1735,
 &end
#
#  111 ILE  QG2           0 AMB  20-1:3158   4.40    (#   3158:20  Single Ambig)
 &rst
  ixpk= 3158, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1816,1817,1818,
 igr2=1845,1775,
 &end
#
#  111 ILE  QD1         108 ASP  HA          3.50    (#   3159:20  Unique         1.94, 3.10 A)
 &rst
  ixpk= 3159, nxpk= 20, iat=  -1,1775, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1823,1824,1825,
 &end
#
#    0 AMB  20-2:3160   113 MET  HA          2.60    (#   3160:20  Single Ambig)
 &rst
  ixpk= 3160, nxpk= 20, iat=  -1,1845, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1847,1848,1854,1855,1856,
 &end
#
#    0 AMB  20-2:3161     0 AMB  20-1:3161   4.40    (#   3161:20  Double Ambig)
 &rst
  ixpk= 3161, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=1789,1790,1791, 248, 249, 924,
 igr2=1777,1778,1777,1778,1777,1778,
 &end
#
#  108 ASP  HA          108 ASP  HB+         2.60    (#   3162:20  Unique         2.30, 2.47 A)
 &rst
  ixpk= 3162, nxpk= 20, iat=1775,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1777,1778,
 &end
#
#  126 TRP  HH2         108 ASP  HB+         4.40    (#   3163:20  Unique         1.99, 3.80 A)
 &rst
  ixpk= 3163, nxpk= 20, iat=2058,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1777,1778,
 &end
#
#    0 AMB  20-2:3164     0 AMB  20-1:3164   3.50    (#   3164:20  Double Ambig)
 &rst
  ixpk= 3164, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2051, 282,
 igr2=1777,1778,1777,1778,
 &end
#
#  108 ASP  HN          108 ASP  HB+         3.50    (#   3165:20  Unique         2.24, 2.95 A)
 &rst
  ixpk= 3165, nxpk= 20, iat=1773,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1777,1778,
 &end
#
#  109 ALA  MB          109 ALA  HA          2.60    (#   3166:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3166, nxpk= 20, iat=  -1,1787, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1789,1790,1791,
 &end
#
#  108 ASP  HB+         109 ALA  HA          5.50    (#   3167:20  Unique         4.24, 5.27 A)
 &rst
  ixpk= 3167, nxpk= 20, iat=  -1,1787, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1777,1778,
 &end
#
#  111 ILE  HN          109 ALA  HA          5.50    (#   3168:20  Unique         3.74, 3.93 A)
 &rst
  ixpk= 3168, nxpk= 20, iat=1810,1787, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  110 GLU  HN          109 ALA  HA          3.50    (#   3169:20  Unique         3.33, 3.44 A)
 &rst
  ixpk= 3169, nxpk= 20, iat=1795,1787, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  109 ALA  HN          109 ALA  HA          3.50    (#   3170:20  Unique         2.76, 2.80 A)
 &rst
  ixpk= 3170, nxpk= 20, iat=1785,1787, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  108 ASP  HN          109 ALA  HA          5.50    (#   3171:20  Unique         4.94, 5.12 A)
 &rst
  ixpk= 3171, nxpk= 20, iat=1773,1787, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:3172   109 ALA  MB          4.40    (#   3172:20  Single Ambig)
 &rst
  ixpk= 3172, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1773,1766,
 igr2=1789,1790,1791,
 &end
#
#  109 ALA  HN          109 ALA  MB          2.60    (#   3173:20  Unique         2.07, 2.88 A)
 &rst
  ixpk= 3173, nxpk= 20, iat=1785,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1789,1790,1791,
 &end
#
#  110 GLU  HN          109 ALA  MB          3.50    (#   3174:20  Unique         2.82, 3.75 A)
 &rst
  ixpk= 3174, nxpk= 20, iat=1795,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1789,1790,1791,
 &end
#
#  111 ILE  HN          109 ALA  MB          5.50    (#   3175:20  Unique         4.95, 5.41 A)
 &rst
  ixpk= 3175, nxpk= 20, iat=1810,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1789,1790,1791,
 &end
#
#  109 ALA  HA          109 ALA  MB          2.60    (#   3176:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3176, nxpk= 20, iat=1787,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1789,1790,1791,
 &end
#
#    0 AMB  20-2:3177   109 ALA  MB          3.50    (#   3177:20  Single Ambig)
 &rst
  ixpk= 3177, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1768,1769,1797,
 igr2=1789,1790,1791,
 &end
#
#  110 GLU  HB-         109 ALA  MB          4.40    (#   3179:20  Unique         4.51, 6.23 A)
 &rst
  ixpk= 3179, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1799,1800,
 igr2=1789,1790,1791,
 &end
#
#  104 LEU  MDY         109 ALA  MB          5.50    (#   3180:20  Unique         6.25, 8.91 A)
 &rst
  ixpk= 3180, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1789,1790,1791,
 &end
#
#    0 AMB  20-2:3181   109 ALA  MB          5.50    (#   3181:20  Single Ambig)
 &rst
  ixpk= 3181, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1789,1790,1791,
 &end
#
#    0 AMB  20-2:3183   110 GLU  HA          4.40    (#   3183:20  Single Ambig)
 &rst
  ixpk= 3183, nxpk= 20, iat=  -1,1797, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#  110 GLU  HB-         110 GLU  HA          2.60    (#   3184:20  Unique         2.40, 2.79 A)
 &rst
  ixpk= 3184, nxpk= 20, iat=  -1,1797, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1799,1800,
 &end
#
#  110 GLU  HB+         110 GLU  HA          2.60    (#   3185:20  Unique         2.40, 2.79 A)
 &rst
  ixpk= 3185, nxpk= 20, iat=  -1,1797, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1799,1800,
 &end
#
#  110 GLU  HG+         110 GLU  HA          3.50    (#   3186:20  Unique         2.58, 3.27 A)
 &rst
  ixpk= 3186, nxpk= 20, iat=  -1,1797, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1802,1803,
 &end
#
#    0 AMB  20-2:3187     0 AMB  20-1:3187   2.60    (#   3187:20  Double Ambig)
 &rst
  ixpk= 3187, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1802,1803,2651,2652,
 igr2=1797,2610,
 &end
#
#  111 ILE  HN          110 GLU  HA          2.65    (#   3188:20  Unique         3.32, 3.43 A)
 &rst
  ixpk= 3188, nxpk= 20, iat=1810,1797, r1= 0.00, r2= 1.80, r3= 2.65, r4= 3.40,  &end
#
#  110 GLU  HN          110 GLU  HA          3.50    (#   3190:20  Unique         2.82, 2.88 A)
 &rst
  ixpk= 3190, nxpk= 20, iat=1795,1797, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3192     0 AMB  20-1:3192   5.50    (#   3192:20  Double Ambig)
 &rst
  ixpk= 3192, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1785,2580,
 igr2=1797,2610,
 &end
#
#  110 GLU  HN          110 GLU  HB-         2.60    (#   3194:20  Unique         2.10, 2.93 A)
 &rst
  ixpk= 3194, nxpk= 20, iat=1795,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1799,1800,
 &end
#
#  110 GLU  HN          110 GLU  HB+         2.60    (#   3195:20  Unique         2.10, 2.93 A)
 &rst
  ixpk= 3195, nxpk= 20, iat=1795,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1799,1800,
 &end
#
#  110 GLU  HA          110 GLU  HB-         3.50    (#   3196:20  Unique         2.40, 2.79 A)
 &rst
  ixpk= 3196, nxpk= 20, iat=1797,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1799,1800,
 &end
#
#  106 SER  HB+         110 GLU  HB+         2.60    (#   3197:20  Unique         2.57, 4.20 A)
 &rst
  ixpk= 3197, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1759,1760,
 igr2=1799,1800,
 &end
#
#  159 GLN  HA          159 GLN  HB+         2.60    (#   3198:20  Unique         2.29, 2.46 A)
 &rst
  ixpk= 3198, nxpk= 20, iat=2629,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2631,2632,
 &end
#
#    0 AMB  20-2:3199   110 GLU  HB-         5.50    (#   3199:20  Single Ambig)
 &rst
  ixpk= 3199, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1775, 846,
 igr2=1799,1800,
 &end
#
#  110 GLU  HG+         110 GLU  HB-         3.50    (#   3200:20  Unique         2.25, 2.58 A)
 &rst
  ixpk= 3200, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1802,1803,
 igr2=1799,1800,
 &end
#
#  110 GLU  HG-         110 GLU  HB-         3.50    (#   3201:20  Unique         2.25, 2.58 A)
 &rst
  ixpk= 3201, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1802,1803,
 igr2=1799,1800,
 &end
#
#  110 GLU  HG+         110 GLU  HB+         2.60    (#   3202:20  Unique         2.25, 2.58 A)
 &rst
  ixpk= 3202, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1802,1803,
 igr2=1799,1800,
 &end
#
#    0 AMB  20-2:3203     0 AMB  20-1:3203   3.50    (#   3203:20  Double Ambig)
 &rst
  ixpk= 3203, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1799,1800,1799,1800,
 &end
#
#    0 AMB  20-2:3204     0 AMB  20-1:3204   4.40    (#   3204:20  Double Ambig)
 &rst
  ixpk= 3204, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1=2570,2571,2572,2574,2575,2576,2617,2618,2619,2621,
      2622,2623,
 igr2=2631,2632,2631,2632,
 &end
#
#  104 LEU  MDX         110 GLU  HB-         5.50    (#   3205:20  Unique         3.31, 5.80 A)
 &rst
  ixpk= 3205, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1799,1800,
 &end
#
#    0 AMB  20-2:3206     0 AMB  20-1:3206   3.50    (#   3206:20  Double Ambig)
 &rst
  ixpk= 3206, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1802,1803,1802,1803,
 &end
#
#  104 LEU  MDX         110 GLU  HG+         5.50    (#   3207:20  Unique         3.48, 6.63 A)
 &rst
  ixpk= 3207, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1802,1803,
 &end
#
#  109 ALA  MB          110 GLU  HG+         5.50    (#   3208:20  Unique         3.43, 5.54 A)
 &rst
  ixpk= 3208, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1789,1790,1791,
 igr2=1802,1803,
 &end
#
#  110 GLU  HB-         110 GLU  HG+         2.60    (#   3209:20  Unique         2.25, 2.58 A)
 &rst
  ixpk= 3209, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1799,1800,
 igr2=1802,1803,
 &end
#
#  110 GLU  HB+         110 GLU  HG+         2.60    (#   3210:20  Unique         2.25, 2.58 A)
 &rst
  ixpk= 3210, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1799,1800,
 igr2=1802,1803,
 &end
#
#  106 SER  HB-         110 GLU  HG+         3.50    (#   3212:20  Unique         2.00, 2.99 A)
 &rst
  ixpk= 3212, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1759,1760,
 igr2=1802,1803,
 &end
#
#  110 GLU  HA          110 GLU  HG+         2.60    (#   3213:20  Unique         2.58, 3.27 A)
 &rst
  ixpk= 3213, nxpk= 20, iat=1797,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1802,1803,
 &end
#
#  110 GLU  HN          110 GLU  HG+         3.50    (#   3214:20  Unique         1.97, 3.36 A)
 &rst
  ixpk= 3214, nxpk= 20, iat=1795,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1802,1803,
 &end
#
#  107 GLY  HN          110 GLU  HG+         4.40    (#   3215:20  Unique         2.58, 3.81 A)
 &rst
  ixpk= 3215, nxpk= 20, iat=1766,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1802,1803,
 &end
#
#  105 VAL  HN          110 GLU  HG+         5.50    (#   3216:20  Unique         5.34, 7.12 A)
 &rst
  ixpk= 3216, nxpk= 20, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1802,1803,
 &end
#
#   84 VAL  HN           84 VAL  HA          3.50    (#   3217:20  Unique         2.90, 2.92 A)
 &rst
  ixpk= 3217, nxpk= 20, iat=1364,1366, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 ILE  QD1         111 ILE  HA          5.50    (#   3219:20  Unique         4.34, 4.63 A)
 &rst
  ixpk= 3219, nxpk= 20, iat=  -1,1812, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1823,1824,1825,
 &end
#
#    0 AMB  20-2:3220     0 AMB  20-1:3220   3.50    (#   3220:20  Double Ambig)
 &rst
  ixpk= 3220, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1814,1349,1350,1387,1388,
 igr2=1812,1366,
 &end
#
#  111 ILE  QD1         111 ILE  HB          3.50    (#   3221:20  Unique         2.30, 3.12 A)
 &rst
  ixpk= 3221, nxpk= 20, iat=  -1,1814, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1823,1824,1825,
 &end
#
#  111 ILE  QG2         111 ILE  HB          3.50    (#   3222:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3222, nxpk= 20, iat=  -1,1814, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1816,1817,1818,
 &end
#
#  111 ILE  HG1-        111 ILE  HB          4.40    (#   3223:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 3223, nxpk= 20, iat=  -1,1814, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1820,1821,
 &end
#
#  111 ILE  HA          111 ILE  HB          4.40    (#   3224:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 3224, nxpk= 20, iat=1812,1814, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  111 ILE  HN          111 ILE  HB          3.50    (#   3225:20  Unique         2.49, 2.60 A)
 &rst
  ixpk= 3225, nxpk= 20, iat=1810,1814, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 ILE  HN          111 ILE  HG1-        4.40    (#   3226:20  Unique         1.90, 2.63 A)
 &rst
  ixpk= 3226, nxpk= 20, iat=1810,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1820,1821,
 &end
#
#    0 AMB  20-2:3227   111 ILE  HG1-        5.50    (#   3227:20  Single Ambig)
 &rst
  ixpk= 3227, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1820,1821,
 &end
#
#  111 ILE  QG2         111 ILE  HG1-        4.40    (#   3228:20  Unique         2.29, 3.49 A)
 &rst
  ixpk= 3228, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1816,1817,1818,
 igr2=1820,1821,
 &end
#
#  111 ILE  QD1         111 ILE  HG1-        4.40    (#   3229:20  Unique         2.21, 2.62 A)
 &rst
  ixpk= 3229, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1823,1824,1825,
 igr2=1820,1821,
 &end
#
#  111 ILE  QD1         111 ILE  HG1+        4.40    (#   3230:20  Unique         2.21, 2.62 A)
 &rst
  ixpk= 3230, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1823,1824,1825,
 igr2=1820,1821,
 &end
#
#  111 ILE  QG2         111 ILE  HG1+        5.50    (#   3231:20  Unique         2.29, 3.49 A)
 &rst
  ixpk= 3231, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1816,1817,1818,
 igr2=1820,1821,
 &end
#
#  111 ILE  HA          111 ILE  HG1+        5.50    (#   3232:20  Unique         2.46, 2.78 A)
 &rst
  ixpk= 3232, nxpk= 20, iat=1812,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1820,1821,
 &end
#
#  111 ILE  QG2         111 ILE  QD1         2.60    (#   3233:20  Unique         1.99, 3.65 A)
 &rst
  ixpk= 3233, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1=1816,1817,1818,
 igr2=1823,1824,1825,
 &end
#
#  111 ILE  HG1+        111 ILE  QD1         3.50    (#   3234:20  Unique         2.21, 2.62 A)
 &rst
  ixpk= 3234, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1820,1821,
 igr2=1823,1824,1825,
 &end
#
#    0 AMB  20-2:3235   111 ILE  QD1         4.40    (#   3235:20  Single Ambig)
 &rst
  ixpk= 3235, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1823,1824,1825,
 &end
#
#    0 AMB  20-2:3236   111 ILE  QD1         4.40    (#   3236:20  Single Ambig)
 &rst
  ixpk= 3236, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,
 igr2=1823,1824,1825,
 &end
#
#  104 LEU  MDY         111 ILE  QD1         3.50    (#   3237:20  Unique         2.64, 6.14 A)
 &rst
  ixpk= 3237, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1823,1824,1825,
 &end
#
#   23 MET  ME          111 ILE  QD1         3.50    (#   3238:20  Unique         1.99, 4.66 A)
 &rst
  ixpk= 3238, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 350, 351, 352,
 igr2=1823,1824,1825,
 &end
#
#  111 ILE  HB          111 ILE  QD1         3.50    (#   3239:20  Unique         2.30, 3.12 A)
 &rst
  ixpk= 3239, nxpk= 20, iat=1814,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1823,1824,1825,
 &end
#
#  108 ASP  HB+         111 ILE  QD1         4.40    (#   3240:20  Unique         1.93, 3.50 A)
 &rst
  ixpk= 3240, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1777,1778,
 igr2=1823,1824,1825,
 &end
#
#  111 ILE  HA          111 ILE  QD1         5.50    (#   3241:20  Unique         4.34, 4.63 A)
 &rst
  ixpk= 3241, nxpk= 20, iat=1812,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1823,1824,1825,
 &end
#
#  108 ASP  HA          111 ILE  QD1         3.50    (#   3242:20  Unique         1.94, 3.10 A)
 &rst
  ixpk= 3242, nxpk= 20, iat=1775,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1823,1824,1825,
 &end
#
#  111 ILE  HN          111 ILE  QD1         5.50    (#   3243:20  Unique         3.57, 4.30 A)
 &rst
  ixpk= 3243, nxpk= 20, iat=1810,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1823,1824,1825,
 &end
#
#  126 TRP  HD1         111 ILE  QD1         4.40    (#   3244:20  Unique         5.71, 6.68 A)
 &rst
  ixpk= 3244, nxpk= 20, iat=2051,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1823,1824,1825,
 &end
#
#  112 ASN  HN          111 ILE  QG2         3.50    (#   3246:20  Unique         2.65, 3.91 A)
 &rst
  ixpk= 3246, nxpk= 20, iat=1829,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1816,1817,1818,
 &end
#
#  111 ILE  HN          111 ILE  QG2         4.40    (#   3247:20  Unique         4.38, 4.53 A)
 &rst
  ixpk= 3247, nxpk= 20, iat=1810,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1816,1817,1818,
 &end
#
#    0 AMB  20-2:3248   111 ILE  QG2         5.50    (#   3248:20  Single Ambig)
 &rst
  ixpk= 3248, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=1966,1970,2058,
 igr2=1816,1817,1818,
 &end
#
#   58 VAL  HA          111 ILE  QG2         4.40    (#   3251:20  Unique         2.39, 3.77 A)
 &rst
  ixpk= 3251, nxpk= 20, iat= 896,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1816,1817,1818,
 &end
#
#  111 ILE  HA          111 ILE  QG2         3.50    (#   3252:20  Unique         2.32, 3.11 A)
 &rst
  ixpk= 3252, nxpk= 20, iat=1812,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1816,1817,1818,
 &end
#
#  113 MET  HG+         111 ILE  QG2         3.50    (#   3253:20  Unique         1.98, 3.15 A)
 &rst
  ixpk= 3253, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1850,1851,
 igr2=1816,1817,1818,
 &end
#
#   58 VAL  HB          111 ILE  QG2         5.50    (#   3254:20  Unique         2.37, 5.25 A)
 &rst
  ixpk= 3254, nxpk= 20, iat= 898,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1816,1817,1818,
 &end
#
#    0 AMB  20-2:3255   111 ILE  QG2         3.50    (#   3255:20  Single Ambig)
 &rst
  ixpk= 3255, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1854,1855,1856,1847,1848,
 igr2=1816,1817,1818,
 &end
#
#  111 ILE  HB          111 ILE  QG2         2.60    (#   3256:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3256, nxpk= 20, iat=1814,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1816,1817,1818,
 &end
#
#    0 AMB  20-2:3257   111 ILE  QG2         3.50    (#   3257:20  Single Ambig)
 &rst
  ixpk= 3257, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1820,1821, 350, 351, 352,
 igr2=1816,1817,1818,
 &end
#
#   58 VAL  MGY         111 ILE  QG2         2.60    (#   3258:20  Unique         1.99, 5.01 A)
 &rst
  ixpk= 3258, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 900, 901, 902, 904, 905, 906,
 igr2=1816,1817,1818,
 &end
#
#    0 AMB  20-2:3259   111 ILE  QG2         3.50    (#   3259:20  Single Ambig)
 &rst
  ixpk= 3259, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1816,1817,1818,
 &end
#
#  111 ILE  HG1+        111 ILE  QG2         3.50    (#   3260:20  Unique         2.29, 3.49 A)
 &rst
  ixpk= 3260, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1820,1821,
 igr2=1816,1817,1818,
 &end
#
#  111 ILE  QD1         111 ILE  QG2         2.60    (#   3261:20  Unique         1.99, 3.65 A)
 &rst
  ixpk= 3261, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1=1823,1824,1825,
 igr2=1816,1817,1818,
 &end
#
#    0 AMB  20-2:3266     0 AMB  20-1:3266   2.60    (#   3266:20  Double Ambig)
 &rst
  ixpk= 3266, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2659,1829,
 igr2=2663,2664,1833,1834,
 &end
#
#  161 ASN  HD2+        161 ASN  HB-         2.60    (#   3267:20  Unique         2.11, 3.39 A)
 &rst
  ixpk= 3267, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2668,2669,
 igr2=2663,2664,
 &end
#
#  161 ASN  HD2-        161 ASN  HB-         3.50    (#   3268:20  Unique         2.11, 3.39 A)
 &rst
  ixpk= 3268, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2668,2669,
 igr2=2663,2664,
 &end
#
#    0 AMB  20-2:3269   161 ASN  HB-         4.40    (#   3269:20  Single Ambig)
 &rst
  ixpk= 3269, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2610,2629,
 igr2=2663,2664,
 &end
#
#    0 AMB  20-2:3270     0 AMB  20-1:3270   4.40    (#   3270:20  Double Ambig)
 &rst
  ixpk= 3270, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2651,2652,1867,1868,1864,1865,
 igr2=2663,2664,1833,1834,1833,1834,
 &end
#
#  111 ILE  QG2         112 ASN  HB+         5.50    (#   3271:20  Unique         4.74, 6.19 A)
 &rst
  ixpk= 3271, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1816,1817,1818,
 igr2=1833,1834,
 &end
#
#  162 THR  HN          161 ASN  HB+         5.50    (#   3272:20  Unique         2.84, 3.87 A)
 &rst
  ixpk= 3272, nxpk= 20, iat=2673,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2663,2664,
 &end
#
#  162 THR  HN          161 ASN  HB-         5.50    (#   3273:20  Unique         2.84, 3.87 A)
 &rst
  ixpk= 3273, nxpk= 20, iat=2673,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2663,2664,
 &end
#
#  161 ASN  HD2-        161 ASN  HB+         4.40    (#   3274:20  Unique         2.11, 3.39 A)
 &rst
  ixpk= 3274, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2668,2669,
 igr2=2663,2664,
 &end
#
#    0 AMB  20-2:3276     0 AMB  20-1:3276   5.50    (#   3276:20  Double Ambig)
 &rst
  ixpk= 3276, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=1883,1884,1885, 900, 901, 902, 904, 905, 906,
 igr2=1833,1834,1833,1834,
 &end
#
#  113 MET  HG+         113 MET  HA          2.63    (#   3278:20  Unique         2.46, 3.06 A)
 &rst
  ixpk= 3278, nxpk= 20, iat=  -1,1845, r1= 0.00, r2= 1.80, r3= 2.95, r4= 3.70,
 igr1=1850,1851,
 &end
#
#  113 MET  HG-         113 MET  HB+         2.60    (#   3279:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 3279, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1850,1851,
 igr2=1847,1848,
 &end
#
#  113 MET  HG+         113 MET  HB+         2.60    (#   3280:20  Unique         2.21, 2.68 A)
 &rst
  ixpk= 3280, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1850,1851,
 igr2=1847,1848,
 &end
#
#  113 MET  HA          113 MET  HB+         3.50    (#   3281:20  Unique         2.33, 2.73 A)
 &rst
  ixpk= 3281, nxpk= 20, iat=1845,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1847,1848,
 &end
#
#  114 GLN  HN          113 MET  HB+         5.50    (#   3282:20  Unique         3.65, 4.26 A)
 &rst
  ixpk= 3282, nxpk= 20, iat=1860,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1847,1848,
 &end
#
#  113 MET  HN          113 MET  HB+         3.50    (#   3283:20  Unique         2.33, 3.33 A)
 &rst
  ixpk= 3283, nxpk= 20, iat=1843,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1847,1848,
 &end
#
#  113 MET  HN          113 MET  HG+         5.50    (#   3285:20  Unique         2.36, 3.17 A)
 &rst
  ixpk= 3285, nxpk= 20, iat=1843,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1850,1851,
 &end
#
#  113 MET  HN          113 MET  HG-         4.40    (#   3286:20  Unique         2.36, 3.17 A)
 &rst
  ixpk= 3286, nxpk= 20, iat=1843,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1850,1851,
 &end
#
#  113 MET  HA          113 MET  HG+         3.50    (#   3289:20  Unique         2.46, 3.06 A)
 &rst
  ixpk= 3289, nxpk= 20, iat=1845,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1850,1851,
 &end
#
#  113 MET  HA          113 MET  HG-         3.50    (#   3290:20  Unique         2.46, 3.06 A)
 &rst
  ixpk= 3290, nxpk= 20, iat=1845,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1850,1851,
 &end
#
#    0 AMB  20-2:3293   113 MET  HG-         2.60    (#   3293:20  Single Ambig)
 &rst
  ixpk= 3293, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=1854,1855,1856,1847,1848,
 igr2=1850,1851,
 &end
#
#    0 AMB  20-2:3294     0 AMB  20-1:3294   2.60    (#   3294:20  Double Ambig)
 &rst
  ixpk= 3294, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.28, r4= 5.03,
 igr1=1854,1855,1856,1847,1848,
 igr2=1850,1851,1850,1851,
 &end
#
#   58 VAL  MGY         113 MET  HG-         5.50    (#   3295:20  Unique         2.95, 6.32 A)
 &rst
  ixpk= 3295, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 900, 901, 902, 904, 905, 906,
 igr2=1850,1851,
 &end
#
#   58 VAL  MGY         113 MET  HG+         4.40    (#   3296:20  Unique         2.95, 6.32 A)
 &rst
  ixpk= 3296, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 900, 901, 902, 904, 905, 906,
 igr2=1850,1851,
 &end
#
#  111 ILE  QG2         113 MET  HG+         5.50    (#   3297:20  Unique         1.98, 3.15 A)
 &rst
  ixpk= 3297, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1816,1817,1818,
 igr2=1850,1851,
 &end
#
#  111 ILE  QG2         113 MET  HG-         3.50    (#   3298:20  Unique         1.98, 3.15 A)
 &rst
  ixpk= 3298, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1816,1817,1818,
 igr2=1850,1851,
 &end
#
#  113 MET  HN          114 GLN  HA          5.50    (#   3299:20  Unique         4.36, 4.93 A)
 &rst
  ixpk= 3299, nxpk= 20, iat=1843,1862, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  114 GLN  HN          114 GLN  HA          3.50    (#   3300:20  Unique         2.91, 2.93 A)
 &rst
  ixpk= 3300, nxpk= 20, iat=1860,1862, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  115 THR  HN          114 GLN  HA          3.50    (#   3301:20  Unique         3.08, 3.11 A)
 &rst
  ixpk= 3301, nxpk= 20, iat=1877,1862, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3303   114 GLN  HA          5.50    (#   3303:20  Single Ambig)
 &rst
  ixpk= 3303, nxpk= 20, iat=  -1,1862, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1881, 912, 913,1917,
 &end
#
#    0 AMB  20-2:3305   114 GLN  HA          2.60    (#   3305:20  Single Ambig)
 &rst
  ixpk= 3305, nxpk= 20, iat=  -1,1862, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1864,1865,1867,1868,
 &end
#
#    0 AMB  20-2:3306   114 GLN  HA          3.50    (#   3306:20  Single Ambig)
 &rst
  ixpk= 3306, nxpk= 20, iat=  -1,1862, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1934,1935,1864,1865,
 &end
#
#  119 PRO  HG+         114 GLN  HA          4.40    (#   3307:20  Unique         2.95, 4.49 A)
 &rst
  ixpk= 3307, nxpk= 20, iat=  -1,1862, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1931,1932,
 &end
#
#  119 PRO  HG-         114 GLN  HA          5.50    (#   3308:20  Unique         2.95, 4.49 A)
 &rst
  ixpk= 3308, nxpk= 20, iat=  -1,1862, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1931,1932,
 &end
#
#    0 AMB  20-2:3309     0 AMB  20-1:3309   2.60    (#   3309:20  Double Ambig)
 &rst
  ixpk= 3309, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1862, 672,
 igr2=1864,1865, 725, 726,
 &end
#
#  114 GLN  HA          114 GLN  HB-         2.60    (#   3310:20  Unique         2.39, 2.45 A)
 &rst
  ixpk= 3310, nxpk= 20, iat=1862,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1864,1865,
 &end
#
#  114 GLN  HN          114 GLN  HB-         3.50    (#   3312:20  Unique         2.66, 3.38 A)
 &rst
  ixpk= 3312, nxpk= 20, iat=1860,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1864,1865,
 &end
#
#  114 GLN  HN          114 GLN  HB+         3.50    (#   3313:20  Unique         2.66, 3.38 A)
 &rst
  ixpk= 3313, nxpk= 20, iat=1860,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1864,1865,
 &end
#
#  113 MET  HN          114 GLN  HB-         5.50    (#   3314:20  Unique         3.73, 5.11 A)
 &rst
  ixpk= 3314, nxpk= 20, iat=1843,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1864,1865,
 &end
#
#   48 GLN  HN           48 GLN  HB+         4.40    (#   3316:20  Unique         2.40, 3.05 A)
 &rst
  ixpk= 3316, nxpk= 20, iat= 721,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 725, 726,
 &end
#
#    0 AMB  20-2:3317     0 AMB  20-1:3317   3.50    (#   3317:20  Double Ambig)
 &rst
  ixpk= 3317, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 723, 689, 690,
 igr2= 725, 726, 725, 726,
 &end
#
#    0 AMB  20-2:3318     0 AMB  20-1:3318   2.60    (#   3318:20  Double Ambig)
 &rst
  ixpk= 3318, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1486,1862,
 igr2=1483,1484,1867,1868,
 &end
#
#    0 AMB  20-2:3319     0 AMB  20-1:3319   4.40    (#   3319:20  Double Ambig)
 &rst
  ixpk= 3319, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 301, 302,1879,
 igr2=2634,2635,1867,1868,
 &end
#
#    0 AMB  20-2:3320     0 AMB  20-1:3320   2.60    (#   3320:20  Double Ambig)
 &rst
  ixpk= 3320, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1864,1865,2631,2632,
 igr2=1867,1868,2634,2635,2634,2635,
 &end
#
#  115 THR  MG2         115 THR  HA          2.60    (#   3321:20  Unique         1.99, 2.81 A)
 &rst
  ixpk= 3321, nxpk= 20, iat=  -1,1879, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1883,1884,1885,
 &end
#
#  115 THR  HB          115 THR  HA          2.60    (#   3322:20  Unique         2.67, 2.83 A)
 &rst
  ixpk= 3322, nxpk= 20, iat=1881,1879, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  115 THR  HN          115 THR  HA          3.50    (#   3324:20  Unique         2.74, 2.76 A)
 &rst
  ixpk= 3324, nxpk= 20, iat=1877,1879, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  116 SER  HN          115 THR  HA          3.50    (#   3325:20  Unique         3.48, 3.55 A)
 &rst
  ixpk= 3325, nxpk= 20, iat=1891,1879, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  115 THR  HN          115 THR  HB          3.50    (#   3326:20  Unique         3.17, 3.35 A)
 &rst
  ixpk= 3326, nxpk= 20, iat=1877,1881, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  116 SER  HN          115 THR  HB          2.60    (#   3327:20  Unique         2.10, 2.49 A)
 &rst
  ixpk= 3327, nxpk= 20, iat=1891,1881, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  118 THR  HA          118 THR  HB          2.60    (#   3328:20  Unique         2.56, 2.65 A)
 &rst
  ixpk= 3328, nxpk= 20, iat=1915,1917, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  116 SER  HB-           0 AMB  20-1:3329   4.40    (#   3329:20  Single Ambig)
 &rst
  ixpk= 3329, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1895,1896,
 igr2=1881,1917,
 &end
#
#  119 PRO  HD+         118 THR  HB          4.40    (#   3330:20  Unique         3.44, 4.11 A)
 &rst
  ixpk= 3330, nxpk= 20, iat=  -1,1917, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1928,1929,
 &end
#
#  119 PRO  HD-         118 THR  HB          4.40    (#   3331:20  Unique         3.44, 4.11 A)
 &rst
  ixpk= 3331, nxpk= 20, iat=  -1,1917, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1928,1929,
 &end
#
#    0 AMB  20-2:3332     0 AMB  20-1:3332   5.50    (#   3332:20  Double Ambig)
 &rst
  ixpk= 3332, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1867,1868,1864,1865,1864,1865,
 igr2=1881,1917,
 &end
#
#  115 THR  MG2         115 THR  HB          2.60    (#   3333:20  Unique         2.25, 2.64 A)
 &rst
  ixpk= 3333, nxpk= 20, iat=  -1,1881, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1883,1884,1885,
 &end
#
#  118 THR  MG2         118 THR  HB          2.60    (#   3334:20  Unique         2.33, 2.64 A)
 &rst
  ixpk= 3334, nxpk= 20, iat=  -1,1917, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=1919,1920,1921,
 &end
#
#    0 AMB  20-2:3336   116 SER  HB-         5.50    (#   3336:20  Single Ambig)
 &rst
  ixpk= 3336, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1934,1935, 442, 443, 871, 872,
 igr2=1895,1896,
 &end
#
#    0 AMB  20-2:3337     0 AMB  20-1:3337   5.50    (#   3337:20  Double Ambig)
 &rst
  ixpk= 3337, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 442, 443, 871, 872,
 igr2=1895,1896,1895,1896,
 &end
#
#    0 AMB  20-2:3338   116 SER  HB-         5.50    (#   3338:20  Single Ambig)
 &rst
  ixpk= 3338, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1937,1915,
 igr2=1895,1896,
 &end
#
#  119 PRO  HA          116 SER  HB+         5.50    (#   3339:20  Unique         3.62, 4.34 A)
 &rst
  ixpk= 3339, nxpk= 20, iat=1937,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1895,1896,
 &end
#
#  116 SER  HA          116 SER  HB+         2.60    (#   3340:20  Unique         2.37, 2.79 A)
 &rst
  ixpk= 3340, nxpk= 20, iat=1893,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1895,1896,
 &end
#
#  116 SER  HA          116 SER  HB-         2.60    (#   3343:20  Unique         2.37, 2.79 A)
 &rst
  ixpk= 3343, nxpk= 20, iat=1893,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1895,1896,
 &end
#
#  116 SER  HN          116 SER  HB+         2.60    (#   3344:20  Unique         2.11, 2.79 A)
 &rst
  ixpk= 3344, nxpk= 20, iat=1891,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1895,1896,
 &end
#
#  115 THR  HN          116 SER  HB-         5.50    (#   3345:20  Unique         4.89, 5.63 A)
 &rst
  ixpk= 3345, nxpk= 20, iat=1877,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1895,1896,
 &end
#
#  116 SER  HN          116 SER  HB-         2.60    (#   3346:20  Unique         2.11, 2.79 A)
 &rst
  ixpk= 3346, nxpk= 20, iat=1891,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1895,1896,
 &end
#
#  117 SER  HN          116 SER  HB-         3.50    (#   3347:20  Unique         2.43, 3.39 A)
 &rst
  ixpk= 3347, nxpk= 20, iat=1902,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1895,1896,
 &end
#
#  117 SER  HN          116 SER  HB+         2.60    (#   3348:20  Unique         2.43, 3.39 A)
 &rst
  ixpk= 3348, nxpk= 20, iat=1902,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1895,1896,
 &end
#
#  117 SER  HN          117 SER  HB+         2.60    (#   3350:20  Unique         2.14, 3.06 A)
 &rst
  ixpk= 3350, nxpk= 20, iat=1902,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1906,1907,
 &end
#
#  117 SER  HN          117 SER  HB-         2.60    (#   3351:20  Unique         2.14, 3.06 A)
 &rst
  ixpk= 3351, nxpk= 20, iat=1902,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1906,1907,
 &end
#
#  118 THR  HN          117 SER  HB+         3.50    (#   3352:20  Unique         2.17, 2.91 A)
 &rst
  ixpk= 3352, nxpk= 20, iat=1913,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1906,1907,
 &end
#
#  118 THR  HN          117 SER  HB-         3.50    (#   3353:20  Unique         2.17, 2.91 A)
 &rst
  ixpk= 3353, nxpk= 20, iat=1913,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1906,1907,
 &end
#
#    0 AMB  20-2:3356     0 AMB  20-1:3356   4.40    (#   3356:20  Double Ambig)
 &rst
  ixpk= 3356, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2608,2548,
 igr2=2601,2602,2601,2602,
 &end
#
#  118 THR  MG2         117 SER  HB+         4.40    (#   3361:20  Unique         2.94, 4.85 A)
 &rst
  ixpk= 3361, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1919,1920,1921,
 igr2=1906,1907,
 &end
#
#  118 THR  MG2         117 SER  HB-         4.40    (#   3362:20  Unique         2.94, 4.85 A)
 &rst
  ixpk= 3362, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1919,1920,1921,
 igr2=1906,1907,
 &end
#
#  118 THR  HN          118 THR  HB          3.50    (#   3363:20  Unique         3.53, 3.61 A)
 &rst
  ixpk= 3363, nxpk= 20, iat=1913,1917, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   28 PHE  HE            0 AMB  20-1:3364   4.40    (#   3364:20  Single Ambig)
 &rst
  ixpk= 3364, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 448, 452,
 igr2=1917,1881,
 &end
#
#   55 PHE  HD          115 THR  HB          5.50    (#   3365:20  Unique         4.64, 7.94 A)
 &rst
  ixpk= 3365, nxpk= 20, iat=  -1,1881, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 852, 860,
 &end
#
#  118 THR  HN          118 THR  MG2         3.50    (#   3366:20  Unique         3.23, 4.12 A)
 &rst
  ixpk= 3366, nxpk= 20, iat=1913,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1919,1920,1921,
 &end
#
#  120 GLU  HN          118 THR  MG2         5.90    (#   3367:20  Unique         6.85, 8.04 A)
 &rst
  ixpk= 3367, nxpk= 20, iat=1941,  -1, r1= 0.00, r2= 1.80, r3= 7.09, r4= 7.84,
 igr2=1919,1920,1921,
 &end
#
#  117 SER  HN          118 THR  MG2         5.50    (#   3368:20  Unique         5.58, 6.70 A)
 &rst
  ixpk= 3368, nxpk= 20, iat=1902,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1919,1920,1921,
 &end
#
#   28 PHE  HE          118 THR  MG2         5.50    (#   3369:20  Unique         6.22, 8.02 A)
 &rst
  ixpk= 3369, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 448, 452,
 igr2=1919,1920,1921,
 &end
#
#  118 THR  HA          118 THR  MG2         3.50    (#   3370:20  Unique         2.25, 2.88 A)
 &rst
  ixpk= 3370, nxpk= 20, iat=1915,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1919,1920,1921,
 &end
#
#  118 THR  HB          118 THR  MG2         2.60    (#   3371:20  Unique         2.33, 2.64 A)
 &rst
  ixpk= 3371, nxpk= 20, iat=1917,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1919,1920,1921,
 &end
#
#  119 PRO  HD+         118 THR  MG2         3.50    (#   3373:20  Unique         3.16, 4.64 A)
 &rst
  ixpk= 3373, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1928,1929,
 igr2=1919,1920,1921,
 &end
#
#  119 PRO  HD-         118 THR  MG2         3.50    (#   3374:20  Unique         3.16, 4.64 A)
 &rst
  ixpk= 3374, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1928,1929,
 igr2=1919,1920,1921,
 &end
#
#    0 AMB  20-2:3375   118 THR  MG2         5.50    (#   3375:20  Single Ambig)
 &rst
  ixpk= 3375, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1867,1868, 442, 443,
 igr2=1919,1920,1921,
 &end
#
#    0 AMB  20-2:3378    90 PRO  HA          5.50    (#   3378:20  Single Ambig)
 &rst
  ixpk= 3378, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1477,1478,1408,1409,
 &end
#
#  159 GLN  HE2-        159 GLN  HG+         3.50    (#   3380:20  Unique         2.16, 3.27 A)
 &rst
  ixpk= 3380, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2639,2640,
 igr2=2634,2635,
 &end
#
#   89 LYS  HA           90 PRO  HG+         5.50    (#   3383:20  Unique         4.71, 4.76 A)
 &rst
  ixpk= 3383, nxpk= 20, iat=1456,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1480,1481,
 &end
#
#  120 GLU  HB-         120 GLU  HA          3.50    (#   3384:20  Unique         2.32, 2.81 A)
 &rst
  ixpk= 3384, nxpk= 20, iat=  -1,1943, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1945,1946,
 &end
#
#  120 GLU  HG+         120 GLU  HA          3.50    (#   3385:20  Unique         2.27, 3.17 A)
 &rst
  ixpk= 3385, nxpk= 20, iat=  -1,1943, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1948,1949,
 &end
#
#  120 GLU  HG-         120 GLU  HA          3.50    (#   3386:20  Unique         2.27, 3.17 A)
 &rst
  ixpk= 3386, nxpk= 20, iat=  -1,1943, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1948,1949,
 &end
#
#  120 GLU  HB+         120 GLU  HA          2.60    (#   3387:20  Unique         2.32, 2.81 A)
 &rst
  ixpk= 3387, nxpk= 20, iat=  -1,1943, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1945,1946,
 &end
#
#    0 AMB  20-2:3388   120 GLU  HA          5.50    (#   3388:20  Single Ambig)
 &rst
  ixpk= 3388, nxpk= 20, iat=  -1,1943, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1931,1932,1847,1848,
 &end
#
#  120 GLU  HN          120 GLU  HA          3.50    (#   3389:20  Unique         2.86, 2.92 A)
 &rst
  ixpk= 3389, nxpk= 20, iat=1941,1943, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  121 PHE  HN          120 GLU  HA          5.50    (#   3390:20  Unique         2.83, 3.33 A)
 &rst
  ixpk= 3390, nxpk= 20, iat=1956,1943, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  121 PHE  HN          120 GLU  HB+         5.50    (#   3391:20  Unique         3.14, 3.67 A)
 &rst
  ixpk= 3391, nxpk= 20, iat=1956,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1945,1946,
 &end
#
#  121 PHE  HN          120 GLU  HB-         5.50    (#   3392:20  Unique         3.14, 3.67 A)
 &rst
  ixpk= 3392, nxpk= 20, iat=1956,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1945,1946,
 &end
#
#    0 AMB  20-2:3393     0 AMB  20-1:3393   3.50    (#   3393:20  Double Ambig)
 &rst
  ixpk= 3393, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1941, 438,
 igr2=1945,1946,1945,1946,
 &end
#
#    0 AMB  20-2:3394   120 GLU  HB-         4.40    (#   3394:20  Single Ambig)
 &rst
  ixpk= 3394, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1941, 438,
 igr2=1945,1946,
 &end
#
#  120 GLU  HA          120 GLU  HB-         3.50    (#   3398:20  Unique         2.32, 2.81 A)
 &rst
  ixpk= 3398, nxpk= 20, iat=1943,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1945,1946,
 &end
#
#  120 GLU  HA          120 GLU  HB+         3.50    (#   3399:20  Unique         2.32, 2.81 A)
 &rst
  ixpk= 3399, nxpk= 20, iat=1943,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1945,1946,
 &end
#
#  120 GLU  HG-         120 GLU  HB-         3.50    (#   3401:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 3401, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1948,1949,
 igr2=1945,1946,
 &end
#
#  120 GLU  HG+         120 GLU  HB+         2.60    (#   3402:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 3402, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1948,1949,
 igr2=1945,1946,
 &end
#
#  120 GLU  HG-         120 GLU  HB+         2.60    (#   3403:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 3403, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1948,1949,
 igr2=1945,1946,
 &end
#
#  120 GLU  HG+         120 GLU  HB-         3.50    (#   3404:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 3404, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1948,1949,
 igr2=1945,1946,
 &end
#
#    0 AMB  20-2:3405     0 AMB  20-1:3405   5.50    (#   3405:20  Double Ambig)
 &rst
  ixpk= 3405, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1941, 438,
 igr2=1948,1949,1948,1949,
 &end
#
#    0 AMB  20-2:3406   120 GLU  HG-         4.40    (#   3406:20  Single Ambig)
 &rst
  ixpk= 3406, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1941, 438,
 igr2=1948,1949,
 &end
#
#  164 LYS  HA          164 LYS  HB+         3.50    (#   3407:20  Unique         2.31, 2.57 A)
 &rst
  ixpk= 3407, nxpk= 20, iat=2703,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2705,2706,
 &end
#
#  120 GLU  HA          120 GLU  HG-         3.50    (#   3408:20  Unique         2.27, 3.17 A)
 &rst
  ixpk= 3408, nxpk= 20, iat=1943,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1948,1949,
 &end
#
#  120 GLU  HB+         120 GLU  HG+         2.60    (#   3409:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 3409, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1945,1946,
 igr2=1948,1949,
 &end
#
#  120 GLU  HB+         120 GLU  HG-         2.60    (#   3410:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 3410, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1945,1946,
 igr2=1948,1949,
 &end
#
#  120 GLU  HB-         120 GLU  HG+         3.50    (#   3411:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 3411, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1945,1946,
 igr2=1948,1949,
 &end
#
#  120 GLU  HB-         120 GLU  HG-         3.50    (#   3412:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 3412, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1945,1946,
 igr2=1948,1949,
 &end
#
#  140 LYS  HG+         140 LYS  HB+         4.40    (#   3414:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 3414, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2301,2302,
 igr2=2298,2299,
 &end
#
#  121 PHE  HB-         121 PHE  HA          5.50    (#   3415:20  Unique         2.40, 2.76 A)
 &rst
  ixpk= 3415, nxpk= 20, iat=  -1,1958, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1960,1961,
 &end
#
#  121 PHE  HB+         121 PHE  HA          5.50    (#   3416:20  Unique         2.40, 2.76 A)
 &rst
  ixpk= 3416, nxpk= 20, iat=  -1,1958, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1960,1961,
 &end
#
#   27 ARG  HA          121 PHE  HA          5.50    (#   3417:20  Unique         3.03, 4.39 A)
 &rst
  ixpk= 3417, nxpk= 20, iat= 416,1958, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  122 ASP  HA          121 PHE  HA          5.50    (#   3418:20  Unique         4.49, 4.83 A)
 &rst
  ixpk= 3418, nxpk= 20, iat=1978,1958, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:3420   121 PHE  HA          5.50    (#   3420:20  Single Ambig)
 &rst
  ixpk= 3420, nxpk= 20, iat=  -1,1958, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1941, 438,
 &end
#
#   25 ALA  MB          121 PHE  HB+         5.50    (#   3422:20  Unique         2.74, 5.08 A)
 &rst
  ixpk= 3422, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 384, 385, 386,
 igr2=1960,1961,
 &end
#
#  122 ASP  HB-         122 ASP  HA          3.50    (#   3423:20  Unique         2.35, 2.75 A)
 &rst
  ixpk= 3423, nxpk= 20, iat=  -1,1978, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1980,1981,
 &end
#
#  122 ASP  HB+         122 ASP  HA          3.50    (#   3424:20  Unique         2.35, 2.75 A)
 &rst
  ixpk= 3424, nxpk= 20, iat=  -1,1978, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1980,1981,
 &end
#
#  122 ASP  HN          122 ASP  HA          3.50    (#   3425:20  Unique         2.27, 2.58 A)
 &rst
  ixpk= 3425, nxpk= 20, iat=1976,1978, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3426     0 AMB  20-1:3426   4.40    (#   3426:20  Double Ambig)
 &rst
  ixpk= 3426, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 416, 512,
 igr2=1980,1981,1980,1981,
 &end
#
#  122 ASP  HA          122 ASP  HB+         3.50    (#   3427:20  Unique         2.35, 2.75 A)
 &rst
  ixpk= 3427, nxpk= 20, iat=1978,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1980,1981,
 &end
#
#  122 ASP  HA          122 ASP  HB-         3.50    (#   3428:20  Unique         2.35, 2.75 A)
 &rst
  ixpk= 3428, nxpk= 20, iat=1978,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1980,1981,
 &end
#
#   28 PHE  HD          122 ASP  HB-         4.40    (#   3430:20  Unique         8.48,11.12 A)
 &rst
  ixpk= 3430, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 446, 454,
 igr2=1980,1981,
 &end
#
#  122 ASP  HN          122 ASP  HB-         5.50    (#   3432:20  Unique         2.24, 3.07 A)
 &rst
  ixpk= 3432, nxpk= 20, iat=1976,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1980,1981,
 &end
#
#  123 GLY  HN          123 GLY  HA-         4.40    (#   3434:20  Unique         2.30, 2.72 A)
 &rst
  ixpk= 3434, nxpk= 20, iat=1988,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1990,1991,
 &end
#
#  123 GLY  HN          123 GLY  HA+         4.40    (#   3435:20  Unique         2.30, 2.72 A)
 &rst
  ixpk= 3435, nxpk= 20, iat=1988,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1990,1991,
 &end
#
#  124 TRP  HN          123 GLY  HA+         2.60    (#   3436:20  Unique         2.14, 2.59 A)
 &rst
  ixpk= 3436, nxpk= 20, iat=1995,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1990,1991,
 &end
#
#  124 TRP  HN          123 GLY  HA-         3.50    (#   3437:20  Unique         2.14, 2.59 A)
 &rst
  ixpk= 3437, nxpk= 20, iat=1995,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1990,1991,
 &end
#
#    0 AMB  20-2:3440   123 GLY  HA-         5.50    (#   3440:20  Single Ambig)
 &rst
  ixpk= 3440, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.54, r4= 9.29,
 igr1=1854,1855,1856,2023,2024,1931,1932,
 igr2=1990,1991,
 &end
#
#   25 ALA  MB          124 TRP  HA          4.40    (#   3441:20  Unique         2.02, 4.09 A)
 &rst
  ixpk= 3441, nxpk= 20, iat=  -1,1997, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1= 384, 385, 386,
 &end
#
#    0 AMB  20-2:3442   124 TRP  HA          5.50    (#   3442:20  Single Ambig)
 &rst
  ixpk= 3442, nxpk= 20, iat=  -1,1997, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1854,1855,1856,2023,2024,
 &end
#
#  124 TRP  HB-         124 TRP  HA          5.50    (#   3443:20  Unique         2.37, 2.54 A)
 &rst
  ixpk= 3443, nxpk= 20, iat=  -1,1997, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1999,2000,
 &end
#
#   25 ALA  HA          124 TRP  HA          5.50    (#   3444:20  Unique         2.57, 3.64 A)
 &rst
  ixpk= 3444, nxpk= 20, iat= 382,1997, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:3446   124 TRP  HA          4.40    (#   3446:20  Single Ambig)
 &rst
  ixpk= 3446, nxpk= 20, iat=  -1,1997, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1= 525,1966,1970,
 &end
#
#  124 TRP  HN          124 TRP  HA          5.50    (#   3447:20  Unique         2.92, 2.93 A)
 &rst
  ixpk= 3447, nxpk= 20, iat=1995,1997, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  125 ARG  HN          124 TRP  HA          4.40    (#   3448:20  Unique         2.15, 2.20 A)
 &rst
  ixpk= 3448, nxpk= 20, iat=2019,1997, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  126 TRP  HD1         125 ARG  HA          5.50    (#   3451:20  Unique         3.50, 3.91 A)
 &rst
  ixpk= 3451, nxpk= 20, iat=2051,2021, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  126 TRP  HN          125 ARG  HA          3.50    (#   3452:20  Unique         2.14, 2.21 A)
 &rst
  ixpk= 3452, nxpk= 20, iat=2043,2021, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  125 ARG  HN          125 ARG  HA          5.50    (#   3453:20  Unique         2.89, 2.93 A)
 &rst
  ixpk= 3453, nxpk= 20, iat=2019,2021, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   52 ARG  HE           49 ALA  HA          5.50    (#   3454:20  Unique         2.35, 3.54 A)
 &rst
  ixpk= 3454, nxpk= 20, iat= 799, 740, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  125 ARG  HG-         125 ARG  HB+         3.50    (#   3455:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 3455, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2026,2027,
 igr2=2023,2024,
 &end
#
#  127 VAL  MGY         125 ARG  HB+         5.50    (#   3456:20  Unique         3.37, 6.50 A)
 &rst
  ixpk= 3456, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2023,2024,
 &end
#
#  125 ARG  HD-         125 ARG  HB-         4.40    (#   3457:20  Unique         2.10, 2.80 A)
 &rst
  ixpk= 3457, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2029,2030,
 igr2=2023,2024,
 &end
#
#  125 ARG  HD-         125 ARG  HB+         5.50    (#   3458:20  Unique         2.10, 2.80 A)
 &rst
  ixpk= 3458, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2029,2030,
 igr2=2023,2024,
 &end
#
#  125 ARG  HD+         125 ARG  HB+         5.50    (#   3459:20  Unique         2.10, 2.80 A)
 &rst
  ixpk= 3459, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2029,2030,
 igr2=2023,2024,
 &end
#
#  125 ARG  HD+         125 ARG  HB-         4.40    (#   3460:20  Unique         2.10, 2.80 A)
 &rst
  ixpk= 3460, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2029,2030,
 igr2=2023,2024,
 &end
#
#  125 ARG  HA          125 ARG  HB+         4.40    (#   3461:20  Unique         2.36, 2.75 A)
 &rst
  ixpk= 3461, nxpk= 20, iat=2021,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2023,2024,
 &end
#
#   33 TRP  HH2         125 ARG  HB+         4.40    (#   3462:20  Unique         3.01, 4.44 A)
 &rst
  ixpk= 3462, nxpk= 20, iat= 525,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2023,2024,
 &end
#
#  126 TRP  HN          125 ARG  HB+         5.50    (#   3463:20  Unique         3.14, 4.05 A)
 &rst
  ixpk= 3463, nxpk= 20, iat=2043,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2023,2024,
 &end
#
#    0 AMB  20-2:3465     0 AMB  20-1:3465   2.60    (#   3465:20  Double Ambig)
 &rst
  ixpk= 3465, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1248,1249,1254,1255,2023,2024,
 igr2=1251,1252,1251,1252,2026,2027,
 &end
#
#   78 LYS  HE+          78 LYS  HG-         4.40    (#   3466:20  Unique         2.06, 3.21 A)
 &rst
  ixpk= 3466, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1257,1258,
 igr2=1251,1252,
 &end
#
#  125 ARG  HD-         125 ARG  HG+         4.40    (#   3467:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 3467, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2029,2030,
 igr2=2026,2027,
 &end
#
#   78 LYS  HA           78 LYS  HG-         4.40    (#   3468:20  Unique         2.44, 3.02 A)
 &rst
  ixpk= 3468, nxpk= 20, iat=1246,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1251,1252,
 &end
#
#   79 LEU  HN           78 LYS  HG-         5.50    (#   3470:20  Unique         4.40, 4.76 A)
 &rst
  ixpk= 3470, nxpk= 20, iat=1266,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1251,1252,
 &end
#
#   78 LYS  HN           78 LYS  HG-         4.40    (#   3471:20  Unique         2.08, 3.45 A)
 &rst
  ixpk= 3471, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1251,1252,
 &end
#
#   33 TRP  HH2         125 ARG  HD+         4.40    (#   3472:20  Unique         2.03, 3.48 A)
 &rst
  ixpk= 3472, nxpk= 20, iat= 525,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2029,2030,
 &end
#
#   33 TRP  HH2         125 ARG  HD-         3.50    (#   3473:20  Unique         2.03, 3.48 A)
 &rst
  ixpk= 3473, nxpk= 20, iat= 525,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2029,2030,
 &end
#
#  125 ARG  HE          125 ARG  HD+         5.50    (#   3474:20  Unique         2.27, 2.64 A)
 &rst
  ixpk= 3474, nxpk= 20, iat=2032,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2029,2030,
 &end
#
#  125 ARG  HE          125 ARG  HD-         4.40    (#   3475:20  Unique         2.27, 2.64 A)
 &rst
  ixpk= 3475, nxpk= 20, iat=2032,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2029,2030,
 &end
#
#  125 ARG  HB-         125 ARG  HD+         2.60    (#   3476:20  Unique         2.10, 2.80 A)
 &rst
  ixpk= 3476, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2023,2024,
 igr2=2029,2030,
 &end
#
#  125 ARG  HB+         125 ARG  HD-         2.60    (#   3477:20  Unique         2.10, 2.80 A)
 &rst
  ixpk= 3477, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2023,2024,
 igr2=2029,2030,
 &end
#
#  125 ARG  HB-         125 ARG  HD-         2.60    (#   3478:20  Unique         2.10, 2.80 A)
 &rst
  ixpk= 3478, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2023,2024,
 igr2=2029,2030,
 &end
#
#  125 ARG  HB+         125 ARG  HD+         2.60    (#   3479:20  Unique         2.10, 2.80 A)
 &rst
  ixpk= 3479, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2023,2024,
 igr2=2029,2030,
 &end
#
#  125 ARG  HG-         125 ARG  HD+         3.50    (#   3480:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 3480, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2026,2027,
 igr2=2029,2030,
 &end
#
#  125 ARG  HG-         125 ARG  HD-         3.50    (#   3481:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 3481, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2026,2027,
 igr2=2029,2030,
 &end
#
#  127 VAL  MGY         125 ARG  HD+         4.40    (#   3482:20  Unique         2.65, 6.10 A)
 &rst
  ixpk= 3482, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2029,2030,
 &end
#
#  127 VAL  MGY         125 ARG  HD-         4.40    (#   3483:20  Unique         2.65, 6.10 A)
 &rst
  ixpk= 3483, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2029,2030,
 &end
#
#    0 AMB  20-2:3484     0 AMB  20-1:3484   5.50    (#   3484:20  Double Ambig)
 &rst
  ixpk= 3484, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1419,2130,1364,1421,
 igr2=1306,1307,2477,2478,
 &end
#
#    0 AMB  20-2:3485     0 AMB  20-1:3485   5.50    (#   3485:20  Double Ambig)
 &rst
  ixpk= 3485, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2423,2424,1227,1228,1999,2000,
 igr2=2477,2478,1251,1252,2026,2027,
 &end
#
#  127 VAL  MGY         125 ARG  HG-         3.50    (#   3486:20  Unique         2.28, 5.66 A)
 &rst
  ixpk= 3486, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2026,2027,
 &end
#
#  125 ARG  HB+         125 ARG  HG-         3.50    (#   3487:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 3487, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2023,2024,
 igr2=2026,2027,
 &end
#
#  125 ARG  HD-         125 ARG  HG-         4.40    (#   3488:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 3488, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2029,2030,
 igr2=2026,2027,
 &end
#
#   33 TRP  HH2         125 ARG  HG+         5.50    (#   3489:20  Unique         2.77, 5.00 A)
 &rst
  ixpk= 3489, nxpk= 20, iat= 525,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2026,2027,
 &end
#
#   33 TRP  HH2         125 ARG  HG-         5.50    (#   3490:20  Unique         2.77, 5.00 A)
 &rst
  ixpk= 3490, nxpk= 20, iat= 525,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2026,2027,
 &end
#
#  164 LYS  HG+         164 LYS  HB+         3.50    (#   3491:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 3491, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2708,2709,
 igr2=2705,2706,
 &end
#
#    0 AMB  20-2:3492   126 TRP  HA          5.50    (#   3492:20  Single Ambig)
 &rst
  ixpk= 3492, nxpk= 20, iat=  -1,2045, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2023,2024, 218,
 &end
#
#  126 TRP  HB+         126 TRP  HA          3.50    (#   3493:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 3493, nxpk= 20, iat=  -1,2045, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2047,2048,
 &end
#
#   23 MET  HA          126 TRP  HA          4.40    (#   3494:20  Unique         2.41, 2.89 A)
 &rst
  ixpk= 3494, nxpk= 20, iat= 341,2045, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  127 VAL  MGX         126 TRP  HA          5.50    (#   3495:20  Unique         3.31, 4.79 A)
 &rst
  ixpk= 3495, nxpk= 20, iat=  -1,2045, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#  126 TRP  HN          126 TRP  HA          5.50    (#   3497:20  Unique         2.90, 2.94 A)
 &rst
  ixpk= 3497, nxpk= 20, iat=2043,2045, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  127 VAL  HN          126 TRP  HA          3.50    (#   3498:20  Unique         2.14, 2.23 A)
 &rst
  ixpk= 3498, nxpk= 20, iat=2067,2045, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  126 TRP  HN          126 TRP  HB+         5.50    (#   3499:20  Unique         2.41, 3.12 A)
 &rst
  ixpk= 3499, nxpk= 20, iat=2043,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2047,2048,
 &end
#
#  126 TRP  HD1         126 TRP  HB+         5.50    (#   3500:20  Unique         3.25, 3.60 A)
 &rst
  ixpk= 3500, nxpk= 20, iat=2051,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2047,2048,
 &end
#
#    0 AMB  20-2:3501     0 AMB  20-1:3501   5.50    (#   3501:20  Double Ambig)
 &rst
  ixpk= 3501, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2008, 271,
 igr2=2047,2048,2047,2048,
 &end
#
#  126 TRP  HA          126 TRP  HB+         5.50    (#   3502:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 3502, nxpk= 20, iat=2045,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2047,2048,
 &end
#
#  128 SER  HN          127 VAL  HB          3.50    (#   3517:20  Unique         1.87, 2.13 A)
 &rst
  ixpk= 3517, nxpk= 20, iat=2083,2071, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  131 TYR  HD          127 VAL  HB          4.40    (#   3518:20  Unique         1.96, 3.77 A)
 &rst
  ixpk= 3518, nxpk= 20, iat=  -1,2071, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2147,2156,
 &end
#
#  128 SER  HB+         127 VAL  HB          5.50    (#   3519:20  Unique         3.14, 4.46 A)
 &rst
  ixpk= 3519, nxpk= 20, iat=  -1,2071, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2087,2088,
 &end
#
#  127 VAL  MGY         127 VAL  HB          3.50    (#   3520:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3520, nxpk= 20, iat=  -1,2071, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#  127 VAL  MGX         127 VAL  HB          3.50    (#   3521:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3521, nxpk= 20, iat=  -1,2071, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#   22 VAL  MGX         127 VAL  MGX         2.60    (#   3523:20  Unique         2.06, 6.68 A)
 &rst
  ixpk= 3523, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  20-2:3524   127 VAL  MGX         2.60    (#   3524:20  Single Ambig)
 &rst
  ixpk= 3524, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=2071,2023,2024,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  126 TRP  HA          127 VAL  MGX         4.40    (#   3526:20  Unique         3.31, 4.79 A)
 &rst
  ixpk= 3526, nxpk= 20, iat=2045,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  127 VAL  HN          127 VAL  MGX         3.50    (#   3528:20  Unique         1.92, 3.51 A)
 &rst
  ixpk= 3528, nxpk= 20, iat=2067,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#   22 VAL  HN          127 VAL  MGX         5.50    (#   3529:20  Unique         3.17, 5.73 A)
 &rst
  ixpk= 3529, nxpk= 20, iat= 323,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  128 SER  HN          127 VAL  MGX         4.40    (#   3530:20  Unique         1.94, 4.09 A)
 &rst
  ixpk= 3530, nxpk= 20, iat=2083,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  131 TYR  HN          127 VAL  MGX         5.50    (#   3531:20  Unique         4.13, 6.39 A)
 &rst
  ixpk= 3531, nxpk= 20, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  127 VAL  HN          127 VAL  MGY         4.40    (#   3532:20  Unique         1.92, 3.51 A)
 &rst
  ixpk= 3532, nxpk= 20, iat=2067,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#   24 TRP  HN          127 VAL  MGY         5.50    (#   3533:20  Unique         4.31, 6.44 A)
 &rst
  ixpk= 3533, nxpk= 20, iat= 356,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  128 SER  HN          127 VAL  MGY         3.50    (#   3534:20  Unique         1.94, 4.09 A)
 &rst
  ixpk= 3534, nxpk= 20, iat=2083,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  126 TRP  HN          127 VAL  MGY         5.50    (#   3535:20  Unique         4.21, 6.00 A)
 &rst
  ixpk= 3535, nxpk= 20, iat=2043,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  20-2:3538   127 VAL  MGY         2.60    (#   3538:20  Single Ambig)
 &rst
  ixpk= 3538, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 364,2147,2156,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  20-2:3539   127 VAL  MGY         3.50    (#   3539:20  Single Ambig)
 &rst
  ixpk= 3539, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 369,2149,2154,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  126 TRP  HA          127 VAL  MGY         4.40    (#   3540:20  Unique         3.31, 4.79 A)
 &rst
  ixpk= 3540, nxpk= 20, iat=2045,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  128 SER  HB+         127 VAL  MGY         4.40    (#   3542:20  Unique         3.76, 6.46 A)
 &rst
  ixpk= 3542, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2087,2088,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  20-2:3543   127 VAL  MGY         5.50    (#   3543:20  Single Ambig)
 &rst
  ixpk= 3543, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1= 514, 515,2176,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  20-2:3544   127 VAL  MGY         5.50    (#   3544:20  Single Ambig)
 &rst
  ixpk= 3544, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2098,2099,2119,2120, 237, 238,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  20-2:3545   127 VAL  MGY         3.50    (#   3545:20  Single Ambig)
 &rst
  ixpk= 3545, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2143,2144,2029,2030,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  20-2:3546   127 VAL  MGY         2.60    (#   3546:20  Single Ambig)
 &rst
  ixpk= 3546, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=2071,2023,2024,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  125 ARG  HG-         127 VAL  MGY         3.50    (#   3547:20  Unique         2.28, 5.66 A)
 &rst
  ixpk= 3547, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2026,2027,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#   22 VAL  MGX         127 VAL  MGY         3.50    (#   3549:20  Unique         2.06, 6.68 A)
 &rst
  ixpk= 3549, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  128 SER  HB+         128 SER  HA          2.60    (#   3550:20  Unique         2.24, 2.77 A)
 &rst
  ixpk= 3550, nxpk= 20, iat=  -1,2085, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2087,2088,
 &end
#
#  128 SER  HN          128 SER  HA          3.50    (#   3552:20  Unique         2.74, 2.84 A)
 &rst
  ixpk= 3552, nxpk= 20, iat=2083,2085, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  129 TYR  HN          128 SER  HA          2.60    (#   3553:20  Unique         2.26, 2.40 A)
 &rst
  ixpk= 3553, nxpk= 20, iat=2094,2085, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  128 SER  HN          128 SER  HB+         2.60    (#   3554:20  Unique         2.09, 2.90 A)
 &rst
  ixpk= 3554, nxpk= 20, iat=2083,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2087,2088,
 &end
#
#  129 TYR  HN          128 SER  HB+         3.50    (#   3555:20  Unique         2.24, 3.35 A)
 &rst
  ixpk= 3555, nxpk= 20, iat=2094,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2087,2088,
 &end
#
#  130 TRP  HN          128 SER  HB+         4.40    (#   3556:20  Unique         2.11, 3.13 A)
 &rst
  ixpk= 3556, nxpk= 20, iat=2115,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2087,2088,
 &end
#
#  131 TYR  HN          128 SER  HB+         5.50    (#   3557:20  Unique         2.06, 3.17 A)
 &rst
  ixpk= 3557, nxpk= 20, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2087,2088,
 &end
#
#  128 SER  HA          128 SER  HB+         2.60    (#   3558:20  Unique         2.24, 2.77 A)
 &rst
  ixpk= 3558, nxpk= 20, iat=2085,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2087,2088,
 &end
#
#  127 VAL  HB          128 SER  HB+         5.50    (#   3560:20  Unique         3.14, 4.46 A)
 &rst
  ixpk= 3560, nxpk= 20, iat=2071,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2087,2088,
 &end
#
#  131 TYR  HB-         128 SER  HB+         4.40    (#   3561:20  Unique         1.99, 3.54 A)
 &rst
  ixpk= 3561, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2143,2144,
 igr2=2087,2088,
 &end
#
#  155 VAL  MGX         129 TYR  HB+         5.50    (#   3564:20  Unique         2.88, 5.13 A)
 &rst
  ixpk= 3564, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2570,2571,2572,2574,2575,2576,
 igr2=2098,2099,
 &end
#
#  129 TYR  HA          129 TYR  HB+         3.50    (#   3566:20  Unique         2.33, 2.51 A)
 &rst
  ixpk= 3566, nxpk= 20, iat=2096,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2098,2099,
 &end
#
#   55 PHE  HA           55 PHE  HB-         3.50    (#   3567:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 3567, nxpk= 20, iat= 846,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 848, 849,
 &end
#
#  129 TYR  HN          129 TYR  HB+         5.50    (#   3568:20  Unique         2.13, 3.08 A)
 &rst
  ixpk= 3568, nxpk= 20, iat=2094,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2098,2099,
 &end
#
#  129 TYR  HN          129 TYR  HB-         4.40    (#   3569:20  Unique         2.13, 3.08 A)
 &rst
  ixpk= 3569, nxpk= 20, iat=2094,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2098,2099,
 &end
#
#  129 TYR  HD          129 TYR  HB-         3.50    (#   3570:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 3570, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2102,2111,
 igr2=2098,2099,
 &end
#
#   22 VAL  MGY         129 TYR  HB-         5.50    (#   3572:20  Unique         2.84, 5.19 A)
 &rst
  ixpk= 3572, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2098,2099,
 &end
#
#  133 VAL  HB          130 TRP  HA          5.50    (#   3573:20  Unique         2.37, 2.78 A)
 &rst
  ixpk= 3573, nxpk= 20, iat=2178,2117, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    7 TYR  HD            7 TYR  HA          5.50    (#   3574:20  Unique         3.10, 3.41 A)
 &rst
  ixpk= 3574, nxpk= 20, iat=  -1,  85, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  91, 100,
 &end
#
#  130 TRP  HE3         130 TRP  HA          3.50    (#   3576:20  Unique         3.48, 4.57 A)
 &rst
  ixpk= 3576, nxpk= 20, iat=2134,2117, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  130 TRP  HE1         130 TRP  HB+         5.50    (#   3577:20  Unique         4.80, 5.09 A)
 &rst
  ixpk= 3577, nxpk= 20, iat=2125,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2119,2120,
 &end
#
#  130 TRP  HE1         130 TRP  HB-         5.50    (#   3578:20  Unique         4.80, 5.09 A)
 &rst
  ixpk= 3578, nxpk= 20, iat=2125,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2119,2120,
 &end
#
#  130 TRP  HN          130 TRP  HB-         5.50    (#   3579:20  Unique         2.21, 3.02 A)
 &rst
  ixpk= 3579, nxpk= 20, iat=2115,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2119,2120,
 &end
#
#  130 TRP  HD1         130 TRP  HB-         4.40    (#   3580:20  Unique         2.69, 3.42 A)
 &rst
  ixpk= 3580, nxpk= 20, iat=2123,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2119,2120,
 &end
#
#  130 TRP  HD1         130 TRP  HB+         5.50    (#   3581:20  Unique         2.69, 3.42 A)
 &rst
  ixpk= 3581, nxpk= 20, iat=2123,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2119,2120,
 &end
#
#  130 TRP  HN          130 TRP  HB+         5.50    (#   3582:20  Unique         2.21, 3.02 A)
 &rst
  ixpk= 3582, nxpk= 20, iat=2115,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2119,2120,
 &end
#
#  130 TRP  HA          130 TRP  HB-         4.40    (#   3584:20  Unique         2.23, 2.75 A)
 &rst
  ixpk= 3584, nxpk= 20, iat=2117,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2119,2120,
 &end
#
#  130 TRP  HA          130 TRP  HB+         3.50    (#   3585:20  Unique         2.23, 2.75 A)
 &rst
  ixpk= 3585, nxpk= 20, iat=2117,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2119,2120,
 &end
#
#    0 AMB  20-2:3586     0 AMB  20-1:3586   5.50    (#   3586:20  Double Ambig)
 &rst
  ixpk= 3586, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.25, r4=11.00,
 igr1=2197,2198,2396,2397,2531,2532,2533,
 igr2=2119,2120,2119,2120,2119,2120,
 &end
#
#    0 AMB  20-2:3588     0 AMB  20-1:3588   3.50    (#   3588:20  Double Ambig)
 &rst
  ixpk= 3588, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1055,1056,2071,2197,2198,
 igr2=1047,2141,
 &end
#
#  131 TYR  HB-         131 TYR  HA          3.50    (#   3589:20  Unique         2.30, 2.76 A)
 &rst
  ixpk= 3589, nxpk= 20, iat=  -1,2141, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2143,2144,
 &end
#
#  131 TYR  HD          131 TYR  HA          5.50    (#   3590:20  Unique         2.06, 3.43 A)
 &rst
  ixpk= 3590, nxpk= 20, iat=  -1,2141, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2147,2156,
 &end
#
#  131 TYR  HN          131 TYR  HA          4.40    (#   3591:20  Unique         2.73, 2.83 A)
 &rst
  ixpk= 3591, nxpk= 20, iat=2139,2141, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  132 PRO  HD+         131 TYR  HA          5.50    (#   3592:20  Unique         2.54, 3.85 A)
 &rst
  ixpk= 3592, nxpk= 20, iat=  -1,2141, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2161,2162,
 &end
#
#  127 VAL  MGX           0 AMB  20-1:3594   5.50    (#   3594:20  Single Ambig)
 &rst
  ixpk= 3594, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2143,2144,2143,2144,
 &end
#
#  127 VAL  HB          131 TYR  HB-         5.50    (#   3595:20  Unique         2.14, 2.84 A)
 &rst
  ixpk= 3595, nxpk= 20, iat=2071,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2143,2144,
 &end
#
#  128 SER  HB+         131 TYR  HB-         5.50    (#   3596:20  Unique         1.99, 3.54 A)
 &rst
  ixpk= 3596, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2087,2088,
 igr2=2143,2144,
 &end
#
#  131 TYR  HA          131 TYR  HB-         5.50    (#   3597:20  Unique         2.30, 2.76 A)
 &rst
  ixpk= 3597, nxpk= 20, iat=2141,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2143,2144,
 &end
#
#  131 TYR  HA          131 TYR  HB+         5.50    (#   3598:20  Unique         2.30, 2.76 A)
 &rst
  ixpk= 3598, nxpk= 20, iat=2141,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2143,2144,
 &end
#
#  131 TYR  HD          131 TYR  HB-         5.50    (#   3599:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 3599, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2147,2156,
 igr2=2143,2144,
 &end
#
#  131 TYR  HD          131 TYR  HB+         5.50    (#   3600:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 3600, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2147,2156,
 igr2=2143,2144,
 &end
#
#  131 TYR  HN          131 TYR  HB-         4.40    (#   3602:20  Unique         2.08, 2.64 A)
 &rst
  ixpk= 3602, nxpk= 20, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2143,2144,
 &end
#
#  131 TYR  HN          131 TYR  HB+         5.50    (#   3603:20  Unique         2.08, 2.64 A)
 &rst
  ixpk= 3603, nxpk= 20, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2143,2144,
 &end
#
#  130 TRP  HB+         131 TYR  HB-         5.50    (#   3604:20  Unique         5.26, 6.22 A)
 &rst
  ixpk= 3604, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2119,2120,
 igr2=2143,2144,
 &end
#
#  136 VAL  MGX         133 VAL  HA          3.50    (#   3606:20  Unique         1.93, 3.75 A)
 &rst
  ixpk= 3606, nxpk= 20, iat=  -1,2176, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2237,2238,2239,2241,2242,2243,
 &end
#
#  133 VAL  MGY         133 VAL  HA          2.60    (#   3607:20  Unique         1.99, 3.13 A)
 &rst
  ixpk= 3607, nxpk= 20, iat=  -1,2176, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:3608   133 VAL  HA          5.50    (#   3608:20  Single Ambig)
 &rst
  ixpk= 3608, nxpk= 20, iat=  -1,2176, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2320,2321,2457,2458,2194,2195,
 &end
#
#  133 VAL  HB          133 VAL  HA          3.50    (#   3609:20  Unique         2.61, 2.99 A)
 &rst
  ixpk= 3609, nxpk= 20, iat=2178,2176, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  144 TYR  HB+         133 VAL  HA          5.50    (#   3610:20  Unique         2.57, 4.04 A)
 &rst
  ixpk= 3610, nxpk= 20, iat=  -1,2176, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2372,2373,
 &end
#
#  145 ARG  HA          133 VAL  HA          5.50    (#   3611:20  Unique         4.45, 4.86 A)
 &rst
  ixpk= 3611, nxpk= 20, iat=2391,2176, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:3612   133 VAL  HA          5.50    (#   3612:20  Single Ambig)
 &rst
  ixpk= 3612, nxpk= 20, iat=  -1,2176, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2192,2216,
 &end
#
#  144 TYR  HD          133 VAL  HA          5.50    (#   3613:20  Unique         2.71, 5.37 A)
 &rst
  ixpk= 3613, nxpk= 20, iat=  -1,2176, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2376,2385,
 &end
#
#    0 AMB  20-2:3614   133 VAL  HA          3.50    (#   3614:20  Single Ambig)
 &rst
  ixpk= 3614, nxpk= 20, iat=  -1,2176, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2174, 561, 565,
 &end
#
#  134 ARG  HN          133 VAL  HA          4.40    (#   3615:20  Unique         3.38, 3.44 A)
 &rst
  ixpk= 3615, nxpk= 20, iat=2190,2176, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  136 VAL  HN          133 VAL  HA          5.50    (#   3616:20  Unique         3.30, 3.60 A)
 &rst
  ixpk= 3616, nxpk= 20, iat=2231,2176, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  134 ARG  HN          133 VAL  HB          4.40    (#   3619:20  Unique         2.82, 3.12 A)
 &rst
  ixpk= 3619, nxpk= 20, iat=2190,2178, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  133 VAL  HN          133 VAL  HB          3.50    (#   3620:20  Unique         2.30, 2.68 A)
 &rst
  ixpk= 3620, nxpk= 20, iat=2174,2178, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  133 VAL  HA          133 VAL  HB          3.50    (#   3621:20  Unique         2.61, 2.99 A)
 &rst
  ixpk= 3621, nxpk= 20, iat=2176,2178, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  133 VAL  MGY         133 VAL  HB          2.60    (#   3622:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3622, nxpk= 20, iat=  -1,2178, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:3623     0 AMB  20-1:3623   3.50    (#   3623:20  Double Ambig)
 &rst
  ixpk= 3623, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1=2396,2397,1494,2612,2613,2323,2324,
 igr2=2180,2181,2182,2184,2185,2186,1496,1497,1498,1500,
      1501,1502,2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:3624     0 AMB  20-1:3624   2.60    (#   3624:20  Double Ambig)
 &rst
  ixpk= 3624, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2552,2393,2394,
 igr2=2554,2555,2556,2558,2559,2560,2180,2181,2182,2184,
      2185,2186,
 &end
#
#    0 AMB  20-2:3625     0 AMB  20-1:3625   2.60    (#   3625:20  Double Ambig)
 &rst
  ixpk= 3625, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2176,1366,
 igr2=2180,2181,2182,2184,2185,2186,1496,1497,1498,1500,
      1501,1502,
 &end
#
#  145 ARG  HA          133 VAL  MGX         2.60    (#   3626:20  Unique         1.99, 3.72 A)
 &rst
  ixpk= 3626, nxpk= 20, iat=2391,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:3627     0 AMB  20-1:3627   4.40    (#   3627:20  Double Ambig)
 &rst
  ixpk= 3627, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.97, r4= 9.72,
 igr1=2192,2610,  78,  79,
 igr2=2180,2181,2182,2184,2185,2186,2554,2555,2556,2558,
      2559,2560,1496,1497,1498,1500,1501,1502,
 &end
#
#  153 SER  HB+         154 VAL  MGX         3.50    (#   3628:20  Unique         3.25, 5.99 A)
 &rst
  ixpk= 3628, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2541,2542,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#  133 VAL  HN          133 VAL  MGX         3.50    (#   3629:20  Unique         1.93, 3.67 A)
 &rst
  ixpk= 3629, nxpk= 20, iat=2174,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:3630     0 AMB  20-1:3630   3.50    (#   3630:20  Double Ambig)
 &rst
  ixpk= 3630, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2190,1421,
 igr2=2180,2181,2182,2184,2185,2186,1496,1497,1498,1500,
      1501,1502,
 &end
#
#  145 ARG  HN          133 VAL  MGX         4.40    (#   3631:20  Unique         3.16, 5.57 A)
 &rst
  ixpk= 3631, nxpk= 20, iat=2389,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#  134 ARG  HN          134 ARG  HA          3.50    (#   3633:20  Unique         2.87, 2.91 A)
 &rst
  ixpk= 3633, nxpk= 20, iat=2190,2192, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  134 ARG  HD+         134 ARG  HA          3.50    (#   3634:20  Unique         2.10, 3.13 A)
 &rst
  ixpk= 3634, nxpk= 20, iat=  -1,2192, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2200,2201,
 &end
#
#    0 AMB  20-2:3635   134 ARG  HA          3.50    (#   3635:20  Single Ambig)
 &rst
  ixpk= 3635, nxpk= 20, iat=  -1,2192, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2197,2198,2323,2324,
 &end
#
#    0 AMB  20-2:3636   134 ARG  HA          2.60    (#   3636:20  Single Ambig)
 &rst
  ixpk= 3636, nxpk= 20, iat=  -1,2192, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2194,2195,2320,2321,
 &end
#
#    0 AMB  20-2:3637   134 ARG  HA          2.60    (#   3637:20  Single Ambig)
 &rst
  ixpk= 3637, nxpk= 20, iat=  -1,2192, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2194,2195,2320,2321,
 &end
#
#    0 AMB  20-2:3638   134 ARG  HA          4.40    (#   3638:20  Single Ambig)
 &rst
  ixpk= 3638, nxpk= 20, iat=  -1,2192, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 &end
#
#  158 LEU  MDX         158 LEU  HA          2.60    (#   3639:20  Unique         2.10, 3.92 A)
 &rst
  ixpk= 3639, nxpk= 20, iat=  -1,2610, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:3642     0 AMB  20-1:3642   2.60    (#   3642:20  Double Ambig)
 &rst
  ixpk= 3642, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2323,2324,2197,2198,2221,2222,
 igr2=2320,2321,2194,2195,2194,2195,
 &end
#
#    0 AMB  20-2:3643     0 AMB  20-1:3643   2.60    (#   3643:20  Double Ambig)
 &rst
  ixpk= 3643, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2323,2324,2197,2198,2221,2222,
 igr2=2320,2321,2194,2195,
 &end
#
#    0 AMB  20-2:3644     0 AMB  20-1:3644   2.60    (#   3644:20  Double Ambig)
 &rst
  ixpk= 3644, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2326,2327,2200,2201,
 igr2=2320,2321,2194,2195,
 &end
#
#    0 AMB  20-2:3645     0 AMB  20-1:3645   2.60    (#   3645:20  Double Ambig)
 &rst
  ixpk= 3645, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2326,2327,2200,2201,
 igr2=2320,2321,2194,2195,
 &end
#
#  141 ARG  HA          141 ARG  HB+         5.50    (#   3646:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 3646, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2320,2321,
 &end
#
#  141 ARG  HA          141 ARG  HB-         4.40    (#   3647:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 3647, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2320,2321,
 &end
#
#    0 AMB  20-2:3648     0 AMB  20-1:3648   3.50    (#   3648:20  Double Ambig)
 &rst
  ixpk= 3648, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2192,2216,
 igr2=2194,2195,2320,2321,
 &end
#
#  134 ARG  HN          134 ARG  HB-         3.50    (#   3649:20  Unique         2.11, 2.78 A)
 &rst
  ixpk= 3649, nxpk= 20, iat=2190,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2194,2195,
 &end
#
#    0 AMB  20-2:3650     0 AMB  20-1:3650   4.40    (#   3650:20  Double Ambig)
 &rst
  ixpk= 3650, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2453,2340,
 igr2=2457,2458,2320,2321,
 &end
#
#    0 AMB  20-2:3651     0 AMB  20-1:3651   4.40    (#   3651:20  Double Ambig)
 &rst
  ixpk= 3651, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2329, 706,
 igr2=2320,2321, 710, 711,
 &end
#
#  103 GLN  HE2+         18 ARG  HG+         3.50    (#   3652:20  Unique         1.95, 3.96 A)
 &rst
  ixpk= 3652, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1715,1716,
 igr2= 265, 266,
 &end
#
#  145 ARG  HA          145 ARG  HG-         3.50    (#   3653:20  Unique         2.11, 2.72 A)
 &rst
  ixpk= 3653, nxpk= 20, iat=2391,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2396,2397,
 &end
#
#    0 AMB  20-2:3654     0 AMB  20-1:3654   2.60    (#   3654:20  Double Ambig)
 &rst
  ixpk= 3654, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 268, 269,2326,2327,2326,2327,
 igr2= 265, 266,2396,2397,2197,2198,
 &end
#
#    0 AMB  20-2:3655     0 AMB  20-1:3655   2.60    (#   3655:20  Double Ambig)
 &rst
  ixpk= 3655, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2326,2327, 268, 269,
 igr2=2323,2324, 265, 266,
 &end
#
#    0 AMB  20-2:3656     0 AMB  20-1:3656   2.60    (#   3656:20  Double Ambig)
 &rst
  ixpk= 3656, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2194,2195, 469, 470,2320,2321,
 igr2=2197,2198, 421, 422,2396,2397,
 &end
#
#    0 AMB  20-2:3657     0 AMB  20-1:3657   2.60    (#   3657:20  Double Ambig)
 &rst
  ixpk= 3657, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2320,2321,2194,2195,
 igr2=2323,2324,2197,2198,
 &end
#
#  134 ARG  HA          134 ARG  HD+         3.50    (#   3658:20  Unique         2.10, 3.13 A)
 &rst
  ixpk= 3658, nxpk= 20, iat=2192,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2200,2201,
 &end
#
#  134 ARG  HN          134 ARG  HD+         4.40    (#   3659:20  Unique         4.66, 5.14 A)
 &rst
  ixpk= 3659, nxpk= 20, iat=2190,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2200,2201,
 &end
#
#  134 ARG  HB+         134 ARG  HD+         2.60    (#   3660:20  Unique         2.08, 3.16 A)
 &rst
  ixpk= 3660, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2194,2195,
 igr2=2200,2201,
 &end
#
#    0 AMB  20-2:3661     0 AMB  20-1:3661   2.60    (#   3661:20  Double Ambig)
 &rst
  ixpk= 3661, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2194,2195,1025,1026,
 igr2=2200,2201,1031,1032,
 &end
#
#  134 ARG  HG-         134 ARG  HD+         2.60    (#   3662:20  Unique         2.26, 2.71 A)
 &rst
  ixpk= 3662, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2197,2198,
 igr2=2200,2201,
 &end
#
#    0 AMB  20-2:3663     0 AMB  20-1:3663   2.60    (#   3663:20  Double Ambig)
 &rst
  ixpk= 3663, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1025,1026,2197,2198,
 igr2=1031,1032,2200,2201,
 &end
#
#  135 GLN  HB-         135 GLN  HA          3.50    (#   3665:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 3665, nxpk= 20, iat=  -1,2216, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2218,2219,
 &end
#
#  135 GLN  HG-         135 GLN  HA          3.50    (#   3666:20  Unique         3.28, 3.57 A)
 &rst
  ixpk= 3666, nxpk= 20, iat=  -1,2216, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2221,2222,
 &end
#
#    0 AMB  20-2:3667   135 GLN  HA          2.60    (#   3667:20  Single Ambig)
 &rst
  ixpk= 3667, nxpk= 20, iat=  -1,2216, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2221,2222,2323,2324,
 &end
#
#    0 AMB  20-2:3668   135 GLN  HA          4.40    (#   3668:20  Single Ambig)
 &rst
  ixpk= 3668, nxpk= 20, iat=  -1,2216, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2194,2195,2320,2321,
 &end
#
#  135 GLN  HB+         135 GLN  HA          2.60    (#   3669:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 3669, nxpk= 20, iat=  -1,2216, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2218,2219,
 &end
#
#  135 GLN  HE2-        135 GLN  HA          5.50    (#   3670:20  Unique         2.83, 3.75 A)
 &rst
  ixpk= 3670, nxpk= 20, iat=  -1,2216, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2226,2227,
 &end
#
#  135 GLN  HE2+        135 GLN  HA          5.50    (#   3671:20  Unique         2.83, 3.75 A)
 &rst
  ixpk= 3671, nxpk= 20, iat=  -1,2216, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2226,2227,
 &end
#
#  135 GLN  HN          135 GLN  HA          3.50    (#   3672:20  Unique         2.87, 2.92 A)
 &rst
  ixpk= 3672, nxpk= 20, iat=2214,2216, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  136 VAL  HN          135 GLN  HA          3.50    (#   3673:20  Unique         2.97, 3.30 A)
 &rst
  ixpk= 3673, nxpk= 20, iat=2231,2216, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  135 GLN  HA          135 GLN  HB+         3.50    (#   3675:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 3675, nxpk= 20, iat=2216,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2218,2219,
 &end
#
#   47 GLU  HA           47 GLU  HB+         3.50    (#   3676:20  Unique         2.45, 2.77 A)
 &rst
  ixpk= 3676, nxpk= 20, iat= 708,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 710, 711,
 &end
#
#  135 GLN  HG+         135 GLN  HB+         3.50    (#   3677:20  Unique         2.32, 2.55 A)
 &rst
  ixpk= 3677, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2221,2222,
 igr2=2218,2219,
 &end
#
#    0 AMB  20-2:3678     0 AMB  20-1:3678   3.50    (#   3678:20  Double Ambig)
 &rst
  ixpk= 3678, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2167,2168,2221,2222,
 igr2=2218,2219,2218,2219,
 &end
#
#    0 AMB  20-2:3679   135 GLN  HB-         3.50    (#   3679:20  Single Ambig)
 &rst
  ixpk= 3679, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2167,2168,2221,2222,
 igr2=2218,2219,
 &end
#
#  135 GLN  HG+         135 GLN  HB-         3.50    (#   3680:20  Unique         2.32, 2.55 A)
 &rst
  ixpk= 3680, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2221,2222,
 igr2=2218,2219,
 &end
#
#  135 GLN  HA          135 GLN  HB-         4.40    (#   3681:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 3681, nxpk= 20, iat=2216,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2218,2219,
 &end
#
#  135 GLN  HN          135 GLN  HB-         3.50    (#   3682:20  Unique         2.45, 3.17 A)
 &rst
  ixpk= 3682, nxpk= 20, iat=2214,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2218,2219,
 &end
#
#  135 GLN  HE2+        135 GLN  HG+         4.40    (#   3685:20  Unique         2.13, 3.19 A)
 &rst
  ixpk= 3685, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2226,2227,
 igr2=2221,2222,
 &end
#
#  135 GLN  HE2+        135 GLN  HG-         5.50    (#   3686:20  Unique         2.13, 3.19 A)
 &rst
  ixpk= 3686, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2226,2227,
 igr2=2221,2222,
 &end
#
#  135 GLN  HE2-        135 GLN  HG-         5.50    (#   3687:20  Unique         2.13, 3.19 A)
 &rst
  ixpk= 3687, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2226,2227,
 igr2=2221,2222,
 &end
#
#  136 VAL  MGX         136 VAL  HA          2.60    (#   3688:20  Unique         2.04, 3.43 A)
 &rst
  ixpk= 3688, nxpk= 20, iat=  -1,2233, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2237,2238,2239,2241,2242,2243,
 &end
#
#  136 VAL  MGY         136 VAL  HA          2.60    (#   3689:20  Unique         2.04, 3.43 A)
 &rst
  ixpk= 3689, nxpk= 20, iat=  -1,2233, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2237,2238,2239,2241,2242,2243,
 &end
#
#  137 VAL  MGY         136 VAL  HA          4.40    (#   3690:20  Unique         3.75, 5.71 A)
 &rst
  ixpk= 3690, nxpk= 20, iat=  -1,2233, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2253,2254,2255,2257,2258,2259,
 &end
#
#  150 GLU  HG-          71 THR  HA          3.50    (#   3692:20  Unique         2.63, 4.20 A)
 &rst
  ixpk= 3692, nxpk= 20, iat=  -1,1106, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2499,2500,
 &end
#
#  136 VAL  HN          136 VAL  HA          3.50    (#   3693:20  Unique         2.74, 2.79 A)
 &rst
  ixpk= 3693, nxpk= 20, iat=2231,2233, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  137 VAL  HN          136 VAL  HA          2.60    (#   3694:20  Unique         2.23, 2.42 A)
 &rst
  ixpk= 3694, nxpk= 20, iat=2247,2233, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  161 ASN  HD2-        157 SER  HA          4.60    (#   3695:20  Unique         2.07, 2.50 A)
 &rst
  ixpk= 3695, nxpk= 20, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 5.16, r4= 5.91,
 igr1=2668,2669,
 &end
#
#    0 AMB  20-2:3697     0 AMB  20-1:3697   3.50    (#   3697:20  Double Ambig)
 &rst
  ixpk= 3697, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2231,2051,
 igr2=2235, 343, 344,
 &end
#
#    0 AMB  20-2:3699     0 AMB  20-1:3699   4.40    (#   3699:20  Double Ambig)
 &rst
  ixpk= 3699, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 138, 587,
 igr2= 135, 136, 589, 590,
 &end
#
#  136 VAL  HA          136 VAL  HB          2.60    (#   3700:20  Unique         2.39, 2.54 A)
 &rst
  ixpk= 3700, nxpk= 20, iat=2233,2235, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  136 VAL  MGX           0 AMB  20-1:3701   2.60    (#   3701:20  Single Ambig)
 &rst
  ixpk= 3701, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2237,2238,2239,2241,2242,2243,
 igr2=2235,2251,
 &end
#
#    0 AMB  20-2:3702     0 AMB  20-1:3702   2.60    (#   3702:20  Double Ambig)
 &rst
  ixpk= 3702, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2253,2254,2255,2257,2258,2259,2237,2238,2239,2241,
      2242,2243,
 igr2=2251,2235,
 &end
#
#    0 AMB  20-2:3703     0 AMB  20-1:3703   2.60    (#   3703:20  Double Ambig)
 &rst
  ixpk= 3703, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.89, r4= 5.64,
 igr1=2253,2254,2255,2257,2258,2259,2301,2302, 220, 221,
       222,
 igr2=2251,2235, 343, 344,
 &end
#
#    0 AMB  20-2:3705   136 VAL  MGX         5.50    (#   3705:20  Single Ambig)
 &rst
  ixpk= 3705, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.51, r4=12.26,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,2167,2168,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  20-2:3706   136 VAL  MGX         3.50    (#   3706:20  Single Ambig)
 &rst
  ixpk= 3706, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2323,2324,2304,2305,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  20-2:3707   136 VAL  MGX         3.50    (#   3707:20  Single Ambig)
 &rst
  ixpk= 3707, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2320,2321,2323,2324,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  20-2:3708   136 VAL  MGX         2.60    (#   3708:20  Single Ambig)
 &rst
  ixpk= 3708, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2235,2251,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  20-2:3709   136 VAL  MGX         4.40    (#   3709:20  Single Ambig)
 &rst
  ixpk= 3709, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2372,2373,2326,2327,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  141 ARG  HA          136 VAL  MGX         3.50    (#   3710:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3710, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  136 VAL  HA          136 VAL  MGX         3.50    (#   3711:20  Unique         2.04, 3.43 A)
 &rst
  ixpk= 3711, nxpk= 20, iat=2233,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  144 TYR  HD          136 VAL  MGX         3.50    (#   3713:20  Unique         1.98, 4.84 A)
 &rst
  ixpk= 3713, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2376,2385,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  20-2:3714   136 VAL  MGX         3.50    (#   3714:20  Single Ambig)
 &rst
  ixpk= 3714, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2378,2383,2174,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  135 GLN  HN          136 VAL  MGX         3.50    (#   3715:20  Unique         3.31, 5.30 A)
 &rst
  ixpk= 3715, nxpk= 20, iat=2214,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  136 VAL  HN          136 VAL  MGX         2.60    (#   3716:20  Unique         1.91, 3.46 A)
 &rst
  ixpk= 3716, nxpk= 20, iat=2231,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  140 LYS  HN          136 VAL  MGX         5.50    (#   3717:20  Unique         3.52, 5.99 A)
 &rst
  ixpk= 3717, nxpk= 20, iat=2294,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  137 VAL  HN          136 VAL  MGX         4.40    (#   3718:20  Unique         1.92, 3.87 A)
 &rst
  ixpk= 3718, nxpk= 20, iat=2247,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  136 VAL  HN          136 VAL  MGY         2.60    (#   3719:20  Unique         1.91, 3.46 A)
 &rst
  ixpk= 3719, nxpk= 20, iat=2231,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  136 VAL  HA          136 VAL  MGY         2.60    (#   3720:20  Unique         2.04, 3.43 A)
 &rst
  ixpk= 3720, nxpk= 20, iat=2233,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  141 ARG  HA          136 VAL  MGY         3.50    (#   3721:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3721, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  20-2:3722   136 VAL  MGY         2.60    (#   3722:20  Single Ambig)
 &rst
  ixpk= 3722, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2235,2251,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  140 LYS  HB-         136 VAL  MGY         2.60    (#   3723:20  Unique         2.27, 5.82 A)
 &rst
  ixpk= 3723, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2298,2299,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  20-2:3724   136 VAL  MGY         2.60    (#   3724:20  Single Ambig)
 &rst
  ixpk= 3724, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2323,2324,2304,2305,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  137 VAL  MGX         137 VAL  HA          2.60    (#   3726:20  Unique         2.16, 3.31 A)
 &rst
  ixpk= 3726, nxpk= 20, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2253,2254,2255,2257,2258,2259,
 &end
#
#  137 VAL  MGY         137 VAL  HA          2.60    (#   3727:20  Unique         2.16, 3.31 A)
 &rst
  ixpk= 3727, nxpk= 20, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2253,2254,2255,2257,2258,2259,
 &end
#
#  137 VAL  HB          137 VAL  HA          2.60    (#   3729:20  Unique         2.37, 2.71 A)
 &rst
  ixpk= 3729, nxpk= 20, iat=2251,2249, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  138 SER  HA          137 VAL  HA          4.40    (#   3730:20  Unique         4.30, 4.32 A)
 &rst
  ixpk= 3730, nxpk= 20, iat=2265,2249, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  137 VAL  HN          137 VAL  HA          3.50    (#   3731:20  Unique         2.70, 2.83 A)
 &rst
  ixpk= 3731, nxpk= 20, iat=2247,2249, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3732   137 VAL  HA          5.50    (#   3732:20  Single Ambig)
 &rst
  ixpk= 3732, nxpk= 20, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2274,2294,
 &end
#
#  138 SER  HN          137 VAL  HA          2.60    (#   3733:20  Unique         2.14, 2.27 A)
 &rst
  ixpk= 3733, nxpk= 20, iat=2263,2249, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  137 VAL  HN            0 AMB  20-1:3734   2.80    (#   3734:20  Single Ambig)
 &rst
  ixpk= 3734, nxpk= 20, iat=2247,  -1, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr2=2235,2251,
 &end
#
#  150 GLU  HN          149 LYS  HB+         3.50    (#   3735:20  Unique         2.43, 3.41 A)
 &rst
  ixpk= 3735, nxpk= 20, iat=2492,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2474,2475,
 &end
#
#  146 ARG  HA          149 LYS  HB+         3.50    (#   3736:20  Unique         1.98, 2.67 A)
 &rst
  ixpk= 3736, nxpk= 20, iat=2415,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2474,2475,
 &end
#
#    0 AMB  20-2:3737     0 AMB  20-1:3737   2.60    (#   3737:20  Double Ambig)
 &rst
  ixpk= 3737, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.08, r4= 4.83,
 igr1= 629, 630, 631,2167,2168,
 igr2= 135, 136,2235,
 &end
#
#  138 SER  HN          137 VAL  MGY         2.60    (#   3738:20  Unique         1.91, 3.86 A)
 &rst
  ixpk= 3738, nxpk= 20, iat=2263,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  138 SER  HN          137 VAL  MGX         3.50    (#   3739:20  Unique         1.91, 3.86 A)
 &rst
  ixpk= 3739, nxpk= 20, iat=2263,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  137 VAL  HN          137 VAL  MGY         2.60    (#   3741:20  Unique         1.97, 3.73 A)
 &rst
  ixpk= 3741, nxpk= 20, iat=2247,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  137 VAL  HN          137 VAL  MGX         2.60    (#   3742:20  Unique         1.97, 3.73 A)
 &rst
  ixpk= 3742, nxpk= 20, iat=2247,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3743   137 VAL  MGY         3.50    (#   3743:20  Single Ambig)
 &rst
  ixpk= 3743, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2274,2294,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3744   137 VAL  MGX         3.50    (#   3744:20  Single Ambig)
 &rst
  ixpk= 3744, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2274,2294,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  139 PHE  HD          137 VAL  MGY         2.60    (#   3745:20  Unique         2.00, 5.29 A)
 &rst
  ixpk= 3745, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2282,2290,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  139 PHE  HD          137 VAL  MGX         3.50    (#   3746:20  Unique         2.00, 5.29 A)
 &rst
  ixpk= 3746, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2282,2290,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  141 ARG  HN          137 VAL  MGY         3.50    (#   3747:20  Unique         3.75, 5.82 A)
 &rst
  ixpk= 3747, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  141 ARG  HN          137 VAL  MGX         3.50    (#   3748:20  Unique         3.75, 5.82 A)
 &rst
  ixpk= 3748, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  137 VAL  HA          137 VAL  MGY         2.60    (#   3749:20  Unique         2.16, 3.31 A)
 &rst
  ixpk= 3749, nxpk= 20, iat=2249,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  137 VAL  HA          137 VAL  MGX         2.60    (#   3750:20  Unique         2.16, 3.31 A)
 &rst
  ixpk= 3750, nxpk= 20, iat=2249,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3751   137 VAL  MGX         4.40    (#   3751:20  Single Ambig)
 &rst
  ixpk= 3751, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=2267,2268,2296,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3752   137 VAL  MGY         3.50    (#   3752:20  Single Ambig)
 &rst
  ixpk= 3752, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2267,2268,2296,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3753   137 VAL  MGY         4.40    (#   3753:20  Single Ambig)
 &rst
  ixpk= 3753, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.76, r4= 8.51,
 igr1=2265, 503, 504, 503, 504,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3754   137 VAL  MGX         5.50    (#   3754:20  Single Ambig)
 &rst
  ixpk= 3754, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.70, r4=10.45,
 igr1=2265, 503, 504, 503, 504,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  136 VAL  HA          137 VAL  MGY         3.50    (#   3755:20  Unique         3.75, 5.71 A)
 &rst
  ixpk= 3755, nxpk= 20, iat=2233,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  136 VAL  HA          137 VAL  MGX         3.50    (#   3756:20  Unique         3.75, 5.71 A)
 &rst
  ixpk= 3756, nxpk= 20, iat=2233,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  140 LYS  HE-         137 VAL  MGX         4.40    (#   3757:20  Unique         2.04, 4.84 A)
 &rst
  ixpk= 3757, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2307,2308,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  139 PHE  HB-         137 VAL  MGY         5.50    (#   3758:20  Unique         1.94, 4.73 A)
 &rst
  ixpk= 3758, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2278,2279,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3759   137 VAL  MGY         2.60    (#   3759:20  Single Ambig)
 &rst
  ixpk= 3759, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2251,2235,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3760   137 VAL  MGX         2.60    (#   3760:20  Single Ambig)
 &rst
  ixpk= 3760, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2251,2235,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  140 LYS  HD-         137 VAL  MGX         3.50    (#   3762:20  Unique         2.24, 5.58 A)
 &rst
  ixpk= 3762, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2304,2305,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  140 LYS  HD-         137 VAL  MGY         3.50    (#   3763:20  Unique         2.24, 5.58 A)
 &rst
  ixpk= 3763, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2304,2305,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  140 LYS  HD+         137 VAL  MGX         3.50    (#   3764:20  Unique         2.24, 5.58 A)
 &rst
  ixpk= 3764, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2304,2305,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  140 LYS  HB-         137 VAL  MGX         3.50    (#   3765:20  Unique         2.00, 4.91 A)
 &rst
  ixpk= 3765, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2298,2299,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#  140 LYS  HB-         137 VAL  MGY         3.50    (#   3766:20  Unique         2.00, 4.91 A)
 &rst
  ixpk= 3766, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2298,2299,
 igr2=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  20-2:3767     0 AMB  20-1:3767   3.50    (#   3767:20  Double Ambig)
 &rst
  ixpk= 3767, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2263,2470,
 igr2=2265,2391,
 &end
#
#    0 AMB  20-2:3768     0 AMB  20-1:3768   3.50    (#   3768:20  Double Ambig)
 &rst
  ixpk= 3768, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2294,2274,2413,
 igr2=2265,2391,
 &end
#
#    0 AMB  20-2:3769   145 ARG  HA          5.50    (#   3769:20  Single Ambig)
 &rst
  ixpk= 3769, nxpk= 20, iat=  -1,2391, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 561, 565, 559, 567,
 &end
#
#  138 SER  HB+         138 SER  HA          2.60    (#   3770:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 3770, nxpk= 20, iat=  -1,2265, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2267,2268,
 &end
#
#    0 AMB  20-2:3771     0 AMB  20-1:3771   4.40    (#   3771:20  Double Ambig)
 &rst
  ixpk= 3771, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2399,2400,2399,2400,
 igr2=2391,2265,
 &end
#
#  145 ARG  HB+         145 ARG  HA          2.60    (#   3772:20  Unique         2.38, 2.78 A)
 &rst
  ixpk= 3772, nxpk= 20, iat=  -1,2391, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2393,2394,
 &end
#
#    0 AMB  20-2:3773     0 AMB  20-1:3773   3.50    (#   3773:20  Double Ambig)
 &rst
  ixpk= 3773, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2396,2397,2323,2324,
 igr2=2391,2265,
 &end
#
#  145 ARG  HG-         145 ARG  HA          3.50    (#   3774:20  Unique         2.11, 2.72 A)
 &rst
  ixpk= 3774, nxpk= 20, iat=  -1,2391, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2396,2397,
 &end
#
#  133 VAL  MGY         145 ARG  HA          2.60    (#   3775:20  Unique         1.99, 3.72 A)
 &rst
  ixpk= 3775, nxpk= 20, iat=  -1,2391, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:3776   138 SER  HA          4.40    (#   3776:20  Single Ambig)
 &rst
  ixpk= 3776, nxpk= 20, iat=  -1,2265, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2253,2254,2255,2257,2258,2259,2301,2302,
 &end
#
#    0 AMB  20-2:3777     0 AMB  20-1:3777   4.40    (#   3777:20  Double Ambig)
 &rst
  ixpk= 3777, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.63, r4= 9.38,
 igr1= 224, 225, 227, 228, 229,2237,2238,2239,2241,2242,
      2243,1693,1694,1695,1697,1698,1699,2301,2302,
 igr2= 200,2265,2391,
 &end
#
#   14 VAL  MGX          14 VAL  HA          3.50    (#   3778:20  Unique         2.16, 3.12 A)
 &rst
  ixpk= 3778, nxpk= 20, iat=  -1, 200, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#  138 SER  HN          138 SER  HB+         3.50    (#   3779:20  Unique         2.09, 2.83 A)
 &rst
  ixpk= 3779, nxpk= 20, iat=2263,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2267,2268,
 &end
#
#    0 AMB  20-2:3780     0 AMB  20-1:3780   3.50    (#   3780:20  Double Ambig)
 &rst
  ixpk= 3780, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2608,2548,
 igr2=2601,2602,2601,2602,
 &end
#
#  138 SER  HA          138 SER  HB+         2.60    (#   3781:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 3781, nxpk= 20, iat=2265,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2267,2268,
 &end
#
#  137 VAL  MGY         138 SER  HB+         3.50    (#   3782:20  Unique         3.30, 6.13 A)
 &rst
  ixpk= 3782, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2253,2254,2255,2257,2258,2259,
 igr2=2267,2268,
 &end
#
#    0 AMB  20-2:3783     0 AMB  20-1:3783   4.40    (#   3783:20  Double Ambig)
 &rst
  ixpk= 3783, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2323,2324,2320,2321,2612,2613,
 igr2=2267,2268,2267,2268,2601,2602,
 &end
#
#  156 MET  HB+         157 SER  HB+         3.50    (#   3784:20  Unique         3.58, 5.12 A)
 &rst
  ixpk= 3784, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2584,2585,
 igr2=2601,2602,
 &end
#
#  139 PHE  HB-         139 PHE  HA          3.50    (#   3785:20  Unique         2.34, 2.73 A)
 &rst
  ixpk= 3785, nxpk= 20, iat=  -1,2276, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2278,2279,
 &end
#
#    0 AMB  20-2:3787   139 PHE  HA          4.40    (#   3787:20  Single Ambig)
 &rst
  ixpk= 3787, nxpk= 20, iat=  -1,2276, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2274,2294,
 &end
#
#  139 PHE  HD          139 PHE  HB-         3.50    (#   3791:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 3791, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2282,2290,
 igr2=2278,2279,
 &end
#
#  139 PHE  HD          139 PHE  HB+         2.60    (#   3792:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 3792, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2282,2290,
 igr2=2278,2279,
 &end
#
#    0 AMB  20-2:3793     0 AMB  20-1:3793   5.50    (#   3793:20  Double Ambig)
 &rst
  ixpk= 3793, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2274,2294,
 igr2=2278,2279,2278,2279,
 &end
#
#    0 AMB  20-2:3794   139 PHE  HB-         3.50    (#   3794:20  Single Ambig)
 &rst
  ixpk= 3794, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2274,2294,
 igr2=2278,2279,
 &end
#
#  140 LYS  HN          140 LYS  HA          3.50    (#   3795:20  Unique         2.86, 2.93 A)
 &rst
  ixpk= 3795, nxpk= 20, iat=2294,2296, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3796   140 LYS  HA          5.50    (#   3796:20  Single Ambig)
 &rst
  ixpk= 3796, nxpk= 20, iat=  -1,2296, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2356,2251,2235,
 &end
#
#  140 LYS  HB+         140 LYS  HA          3.50    (#   3797:20  Unique         2.37, 2.78 A)
 &rst
  ixpk= 3797, nxpk= 20, iat=  -1,2296, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2298,2299,
 &end
#
#  140 LYS  HB-         140 LYS  HA          4.40    (#   3798:20  Unique         2.37, 2.78 A)
 &rst
  ixpk= 3798, nxpk= 20, iat=  -1,2296, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2298,2299,
 &end
#
#    0 AMB  20-2:3800     0 AMB  20-1:3800   3.50    (#   3800:20  Double Ambig)
 &rst
  ixpk= 3800, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=2301,2302,2237,2238,2239,2241,2242,2243,
 igr2=2298,2299,2298,2299,
 &end
#
#    0 AMB  20-2:3801   140 LYS  HB-         3.50    (#   3801:20  Single Ambig)
 &rst
  ixpk= 3801, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2301,2302,2237,2238,2239,2241,2242,2243,
 igr2=2298,2299,
 &end
#
#  140 LYS  HA          140 LYS  HB+         3.50    (#   3802:20  Unique         2.37, 2.78 A)
 &rst
  ixpk= 3802, nxpk= 20, iat=2296,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2298,2299,
 &end
#
#  140 LYS  HA          140 LYS  HB-         5.50    (#   3803:20  Unique         2.37, 2.78 A)
 &rst
  ixpk= 3803, nxpk= 20, iat=2296,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2298,2299,
 &end
#
#  140 LYS  HN          140 LYS  HB+         5.50    (#   3804:20  Unique         2.28, 3.14 A)
 &rst
  ixpk= 3804, nxpk= 20, iat=2294,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2298,2299,
 &end
#
#  140 LYS  HN          140 LYS  HB-         5.50    (#   3805:20  Unique         2.28, 3.14 A)
 &rst
  ixpk= 3805, nxpk= 20, iat=2294,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2298,2299,
 &end
#
#  140 LYS  HB+         140 LYS  HG+         2.60    (#   3806:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 3806, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2298,2299,
 igr2=2301,2302,
 &end
#
#  140 LYS  HA          140 LYS  HG+         3.50    (#   3808:20  Unique         2.03, 2.89 A)
 &rst
  ixpk= 3808, nxpk= 20, iat=2296,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2301,2302,
 &end
#
#    0 AMB  20-2:3810     0 AMB  20-1:3810   5.50    (#   3810:20  Double Ambig)
 &rst
  ixpk= 3810, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1594,1595,1555,1556,
 igr2=2301,2302,2301,2302,
 &end
#
#   83 LEU  HN           79 LEU  MDX         4.40    (#   3811:20  Unique         4.33, 6.19 A)
 &rst
  ixpk= 3811, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1275,1276,1277,1279,1280,1281,
 &end
#
#   62 ARG  HN           62 ARG  HB-         3.50    (#   3812:20  Unique         2.53, 3.15 A)
 &rst
  ixpk= 3812, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#    0 AMB  20-2:3813     0 AMB  20-1:3813   2.60    (#   3813:20  Double Ambig)
 &rst
  ixpk= 3813, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2298,2299, 978, 979,
 igr2=2307,2308, 984, 985,
 &end
#
#  142 ASP  HN          141 ARG  HA          5.50    (#   3815:20  Unique         3.50, 3.52 A)
 &rst
  ixpk= 3815, nxpk= 20, iat=2340,2318, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  141 ARG  HN          141 ARG  HA          3.50    (#   3816:20  Unique         2.86, 2.87 A)
 &rst
  ixpk= 3816, nxpk= 20, iat=2316,2318, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  144 TYR  HD          141 ARG  HA          5.50    (#   3817:20  Unique         3.27, 5.21 A)
 &rst
  ixpk= 3817, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2376,2385,
 &end
#
#    0 AMB  20-2:3818   141 ARG  HA          4.40    (#   3818:20  Single Ambig)
 &rst
  ixpk= 3818, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2372,2373,2326,2327,
 &end
#
#  144 TYR  HB-         141 ARG  HA          5.50    (#   3819:20  Unique         2.42, 3.40 A)
 &rst
  ixpk= 3819, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2372,2373,
 &end
#
#  141 ARG  HB+         141 ARG  HA          3.50    (#   3820:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 3820, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2320,2321,
 &end
#
#    0 AMB  20-2:3821   141 ARG  HA          2.60    (#   3821:20  Single Ambig)
 &rst
  ixpk= 3821, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2323,2324,2320,2321,
 &end
#
#  141 ARG  HG-         141 ARG  HA          4.40    (#   3822:20  Unique         2.09, 3.22 A)
 &rst
  ixpk= 3822, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2323,2324,
 &end
#
#    0 AMB  20-2:3823   141 ARG  HA          5.50    (#   3823:20  Single Ambig)
 &rst
  ixpk= 3823, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,2358,2359,2360,2362,2363,2364,
 &end
#
#  136 VAL  MGX         141 ARG  HA          3.50    (#   3824:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3824, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2237,2238,2239,2241,2242,2243,
 &end
#
#  136 VAL  MGY         141 ARG  HA          2.60    (#   3825:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3825, nxpk= 20, iat=  -1,2318, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2237,2238,2239,2241,2242,2243,
 &end
#
#  133 VAL  HB            0 AMB  20-1:3826   4.40    (#   3826:20  Single Ambig)
 &rst
  ixpk= 3826, nxpk= 20, iat=2178,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2457,2458,2194,2195,2320,2321,
 &end
#
#  141 ARG  HA          141 ARG  HB+         4.40    (#   3827:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 3827, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2320,2321,
 &end
#
#  141 ARG  HA          141 ARG  HB-         5.50    (#   3828:20  Unique         2.37, 2.64 A)
 &rst
  ixpk= 3828, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2320,2321,
 &end
#
#    0 AMB  20-2:3829     0 AMB  20-1:3829   3.50    (#   3829:20  Double Ambig)
 &rst
  ixpk= 3829, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2316,2123,
 igr2=2320,2321,2457,2458,
 &end
#
#  142 ASP  HN          141 ARG  HG-         5.50    (#   3831:20  Unique         1.93, 3.78 A)
 &rst
  ixpk= 3831, nxpk= 20, iat=2340,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2323,2324,
 &end
#
#  141 ARG  HN          141 ARG  HG+         5.50    (#   3832:20  Unique         1.93, 3.42 A)
 &rst
  ixpk= 3832, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2323,2324,
 &end
#
#    0 AMB  20-2:3833     0 AMB  20-1:3833   4.40    (#   3833:20  Double Ambig)
 &rst
  ixpk= 3833, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1034, 446, 454,
 igr2= 265, 266,1931,1932,
 &end
#
#    0 AMB  20-2:3834     0 AMB  20-1:3834   4.40    (#   3834:20  Double Ambig)
 &rst
  ixpk= 3834, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1151,1152,1131,
 igr2=1125,1126,1125,1126,
 &end
#
#  141 ARG  HA          141 ARG  HG-         4.40    (#   3835:20  Unique         2.09, 3.22 A)
 &rst
  ixpk= 3835, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2323,2324,
 &end
#
#  141 ARG  HA          141 ARG  HG+         3.50    (#   3836:20  Unique         2.09, 3.22 A)
 &rst
  ixpk= 3836, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2323,2324,
 &end
#
#    0 AMB  20-2:3837     0 AMB  20-1:3837   3.50    (#   3837:20  Double Ambig)
 &rst
  ixpk= 3837, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 igr2=2323,2324,2197,2198,
 &end
#
#    0 AMB  20-2:3838     0 AMB  20-1:3838   3.50    (#   3838:20  Double Ambig)
 &rst
  ixpk= 3838, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 igr2=2323,2324,2323,2324,
 &end
#
#  136 VAL  MGX         141 ARG  HG+         4.40    (#   3839:20  Unique         1.99, 5.30 A)
 &rst
  ixpk= 3839, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2237,2238,2239,2241,2242,2243,
 igr2=2323,2324,
 &end
#
#  141 ARG  HA          141 ARG  HD+         4.40    (#   3841:20  Unique         2.50, 4.50 A)
 &rst
  ixpk= 3841, nxpk= 20, iat=2318,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2326,2327,
 &end
#
#    0 AMB  20-2:3842   142 ASP  HA          4.40    (#   3842:20  Single Ambig)
 &rst
  ixpk= 3842, nxpk= 20, iat=  -1,2342, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=2358,2359,2360,2362,2363,2364,2180,2181,2182,2184,
      2185,2186,2180,2181,2182,2184,2185,2186,
 &end
#
#  145 ARG  HB+         142 ASP  HA          4.40    (#   3843:20  Unique         2.34, 3.16 A)
 &rst
  ixpk= 3843, nxpk= 20, iat=  -1,2342, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2393,2394,
 &end
#
#  142 ASP  HB+         142 ASP  HA          2.60    (#   3844:20  Unique         2.31, 2.72 A)
 &rst
  ixpk= 3844, nxpk= 20, iat=  -1,2342, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2344,2345,
 &end
#
#  145 ARG  HD+         142 ASP  HA          3.50    (#   3845:20  Unique         2.43, 3.79 A)
 &rst
  ixpk= 3845, nxpk= 20, iat=  -1,2342, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2399,2400,
 &end
#
#    0 AMB  20-2:3847   142 ASP  HA          5.50    (#   3847:20  Single Ambig)
 &rst
  ixpk= 3847, nxpk= 20, iat=  -1,2342, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2391,2265,
 &end
#
#  146 ARG  HN          142 ASP  HA          5.50    (#   3849:20  Unique         3.78, 4.17 A)
 &rst
  ixpk= 3849, nxpk= 20, iat=2413,2342, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  143 VAL  HN          142 ASP  HA          4.40    (#   3850:20  Unique         3.54, 3.56 A)
 &rst
  ixpk= 3850, nxpk= 20, iat=2352,2342, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  142 ASP  HN          142 ASP  HA          3.50    (#   3851:20  Unique         2.80, 2.82 A)
 &rst
  ixpk= 3851, nxpk= 20, iat=2340,2342, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  145 ARG  HN          142 ASP  HA          4.40    (#   3852:20  Unique         3.43, 3.52 A)
 &rst
  ixpk= 3852, nxpk= 20, iat=2389,2342, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  143 VAL  HN          142 ASP  HB+         2.60    (#   3853:20  Unique         2.37, 3.05 A)
 &rst
  ixpk= 3853, nxpk= 20, iat=2352,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2344,2345,
 &end
#
#    7 TYR  HD            5 ASP  HB-         5.50    (#   3854:20  Unique         2.73, 5.40 A)
 &rst
  ixpk= 3854, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  91, 100,
 igr2=  68,  69,
 &end
#
#  143 VAL  HA          142 ASP  HB+         5.50    (#   3855:20  Unique         3.92, 4.43 A)
 &rst
  ixpk= 3855, nxpk= 20, iat=2354,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2344,2345,
 &end
#
#  143 VAL  HN          143 VAL  HA          3.50    (#   3857:20  Unique         2.80, 2.81 A)
 &rst
  ixpk= 3857, nxpk= 20, iat=2352,2354, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  146 ARG  HN          143 VAL  HA          4.40    (#   3858:20  Unique         3.42, 3.56 A)
 &rst
  ixpk= 3858, nxpk= 20, iat=2413,2354, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  146 ARG  HD+         143 VAL  HA          3.50    (#   3859:20  Unique         2.97, 4.11 A)
 &rst
  ixpk= 3859, nxpk= 20, iat=  -1,2354, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2423,2424,
 &end
#
#  142 ASP  HB+         143 VAL  HA          5.50    (#   3860:20  Unique         3.92, 4.43 A)
 &rst
  ixpk= 3860, nxpk= 20, iat=  -1,2354, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2344,2345,
 &end
#
#  146 ARG  HB+         143 VAL  HA          2.60    (#   3861:20  Unique         2.70, 3.58 A)
 &rst
  ixpk= 3861, nxpk= 20, iat=  -1,2354, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2417,2418,
 &end
#
#  143 VAL  HB          143 VAL  HA          3.50    (#   3862:20  Unique         2.34, 2.39 A)
 &rst
  ixpk= 3862, nxpk= 20, iat=2356,2354, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  143 VAL  MGY         143 VAL  HA          2.60    (#   3863:20  Unique         2.38, 3.53 A)
 &rst
  ixpk= 3863, nxpk= 20, iat=  -1,2354, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#  147 VAL  MGY         143 VAL  HA          5.50    (#   3864:20  Unique         3.84, 6.47 A)
 &rst
  ixpk= 3864, nxpk= 20, iat=  -1,2354, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:3865   143 VAL  HB          5.50    (#   3865:20  Single Ambig)
 &rst
  ixpk= 3865, nxpk= 20, iat=  -1,2356, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2423,2424,2372,2373,2326,2327,
 &end
#
#  143 VAL  HA          143 VAL  HB          4.40    (#   3866:20  Unique         2.34, 2.39 A)
 &rst
  ixpk= 3866, nxpk= 20, iat=2354,2356, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   77 TYR  HE          143 VAL  HB          5.50    (#   3867:20  Unique         4.50, 7.23 A)
 &rst
  ixpk= 3867, nxpk= 20, iat=  -1,2356, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1233,1238,
 &end
#
#  143 VAL  HN          143 VAL  HB          2.60    (#   3868:20  Unique         2.62, 2.68 A)
 &rst
  ixpk= 3868, nxpk= 20, iat=2352,2356, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#   75 LEU  HB-         143 VAL  HB          5.50    (#   3869:20  Unique         2.92, 3.79 A)
 &rst
  ixpk= 3869, nxpk= 20, iat=  -1,2356, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1184,1185,
 &end
#
#  143 VAL  MGY         143 VAL  HB          2.60    (#   3870:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 3870, nxpk= 20, iat=  -1,2356, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#  147 VAL  MGY         143 VAL  MGX         2.60    (#   3871:20  Unique         2.55, 6.61 A)
 &rst
  ixpk= 3871, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  147 VAL  MGX         143 VAL  MGX         4.40    (#   3872:20  Unique         2.55, 6.61 A)
 &rst
  ixpk= 3872, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#    0 AMB  20-2:3873   143 VAL  MGX         3.50    (#   3873:20  Single Ambig)
 &rst
  ixpk= 3873, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1187,2417,2418,1586,1587,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   75 LEU  HB-         143 VAL  MGX         3.50    (#   3874:20  Unique         1.96, 4.21 A)
 &rst
  ixpk= 3874, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1184,1185,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  143 VAL  HB          143 VAL  MGX         2.60    (#   3875:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 3875, nxpk= 20, iat=2356,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  147 VAL  HA          143 VAL  MGX         5.50    (#   3876:20  Unique         5.50, 7.62 A)
 &rst
  ixpk= 3876, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#    0 AMB  20-2:3877   143 VAL  MGX         3.50    (#   3877:20  Single Ambig)
 &rst
  ixpk= 3877, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2372,2373,2423,2424,1227,1228,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  143 VAL  HA          143 VAL  MGX         2.60    (#   3878:20  Unique         2.38, 3.53 A)
 &rst
  ixpk= 3878, nxpk= 20, iat=2354,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  144 TYR  HA          143 VAL  MGX         3.50    (#   3879:20  Unique         3.27, 4.50 A)
 &rst
  ixpk= 3879, nxpk= 20, iat=2370,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  140 LYS  HA          143 VAL  MGX         3.50    (#   3880:20  Unique         2.03, 4.40 A)
 &rst
  ixpk= 3880, nxpk= 20, iat=2296,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   97 GLN  HE2-        143 VAL  MGX         5.50    (#   3882:20  Unique         2.58, 6.24 A)
 &rst
  ixpk= 3882, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1594,1595,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  144 TYR  HD          143 VAL  MGX         2.60    (#   3883:20  Unique         1.97, 5.32 A)
 &rst
  ixpk= 3883, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2376,2385,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  144 TYR  HE          143 VAL  MGX         4.40    (#   3884:20  Unique         3.29, 6.37 A)
 &rst
  ixpk= 3884, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2378,2383,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   35 PHE  HD          143 VAL  MGX         4.40    (#   3885:20  Unique         6.81,11.03 A)
 &rst
  ixpk= 3885, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 559, 567,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   99 TRP  HZ2         143 VAL  MGX         3.50    (#   3886:20  Unique         3.33, 5.43 A)
 &rst
  ixpk= 3886, nxpk= 20, iat=1634,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  143 VAL  HN          143 VAL  MGX         3.50    (#   3887:20  Unique         1.81, 3.65 A)
 &rst
  ixpk= 3887, nxpk= 20, iat=2352,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#    0 AMB  20-2:3888   143 VAL  MGX         5.50    (#   3888:20  Single Ambig)
 &rst
  ixpk= 3888, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2437,2453,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  144 TYR  HN          143 VAL  MGX         3.50    (#   3889:20  Unique         1.83, 3.43 A)
 &rst
  ixpk= 3889, nxpk= 20, iat=2368,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   99 TRP  HE1         143 VAL  MGX         3.50    (#   3890:20  Unique         2.72, 5.04 A)
 &rst
  ixpk= 3890, nxpk= 20, iat=1631,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  143 VAL  HN          143 VAL  MGY         2.60    (#   3891:20  Unique         1.81, 3.65 A)
 &rst
  ixpk= 3891, nxpk= 20, iat=2352,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  142 ASP  HN          143 VAL  MGY         4.40    (#   3892:20  Unique         3.56, 5.90 A)
 &rst
  ixpk= 3892, nxpk= 20, iat=2340,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  144 TYR  HN          143 VAL  MGY         3.50    (#   3893:20  Unique         1.83, 3.43 A)
 &rst
  ixpk= 3893, nxpk= 20, iat=2368,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   35 PHE  HD          143 VAL  MGY         4.40    (#   3894:20  Unique         6.81,11.03 A)
 &rst
  ixpk= 3894, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 559, 567,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  144 TYR  HD          143 VAL  MGY         2.60    (#   3895:20  Unique         1.97, 5.32 A)
 &rst
  ixpk= 3895, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2376,2385,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   77 TYR  HA          143 VAL  MGY         5.50    (#   3896:20  Unique         6.16, 8.80 A)
 &rst
  ixpk= 3896, nxpk= 20, iat=1225,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  140 LYS  HA          143 VAL  MGY         4.40    (#   3898:20  Unique         2.03, 4.40 A)
 &rst
  ixpk= 3898, nxpk= 20, iat=2296,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  143 VAL  HA          143 VAL  MGY         2.60    (#   3899:20  Unique         2.38, 3.53 A)
 &rst
  ixpk= 3899, nxpk= 20, iat=2354,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#    0 AMB  20-2:3900   143 VAL  MGY         3.50    (#   3900:20  Single Ambig)
 &rst
  ixpk= 3900, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2372,2373,1227,1228,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  142 ASP  HB+         143 VAL  MGY         4.40    (#   3901:20  Unique         3.82, 6.33 A)
 &rst
  ixpk= 3901, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2344,2345,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  143 VAL  HB          143 VAL  MGY         2.60    (#   3902:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 3902, nxpk= 20, iat=2356,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  146 ARG  HB+         143 VAL  MGY         3.50    (#   3903:20  Unique         3.93, 6.43 A)
 &rst
  ixpk= 3903, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2417,2418,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#   75 LEU  HB-         143 VAL  MGY         3.50    (#   3904:20  Unique         1.96, 4.21 A)
 &rst
  ixpk= 3904, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1184,1185,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  147 VAL  MGY         143 VAL  MGY         4.40    (#   3905:20  Unique         2.55, 6.61 A)
 &rst
  ixpk= 3905, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  147 VAL  MGY         144 TYR  HA          4.40    (#   3906:20  Unique         2.06, 4.12 A)
 &rst
  ixpk= 3906, nxpk= 20, iat=  -1,2370, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  HB          144 TYR  HA          5.50    (#   3907:20  Unique         2.63, 3.52 A)
 &rst
  ixpk= 3907, nxpk= 20, iat=2441,2370, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  144 TYR  HB-         144 TYR  HA          4.40    (#   3908:20  Unique         2.56, 2.83 A)
 &rst
  ixpk= 3908, nxpk= 20, iat=  -1,2370, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2372,2373,
 &end
#
#  144 TYR  HB+         144 TYR  HA          4.40    (#   3909:20  Unique         2.56, 2.83 A)
 &rst
  ixpk= 3909, nxpk= 20, iat=  -1,2370, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2372,2373,
 &end
#
#  144 TYR  HD          144 TYR  HA          3.50    (#   3910:20  Unique         1.95, 3.29 A)
 &rst
  ixpk= 3910, nxpk= 20, iat=  -1,2370, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2376,2385,
 &end
#
#  144 TYR  HE          144 TYR  HA          5.50    (#   3911:20  Unique         4.29, 5.01 A)
 &rst
  ixpk= 3911, nxpk= 20, iat=  -1,2370, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2378,2383,
 &end
#
#  144 TYR  HN          144 TYR  HA          4.40    (#   3912:20  Unique         2.80, 2.83 A)
 &rst
  ixpk= 3912, nxpk= 20, iat=2368,2370, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:3913   144 TYR  HA          4.40    (#   3913:20  Single Ambig)
 &rst
  ixpk= 3913, nxpk= 20, iat=  -1,2370, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2437,2453,
 &end
#
#  144 TYR  HN          144 TYR  HB+         4.40    (#   3914:20  Unique         2.07, 2.80 A)
 &rst
  ixpk= 3914, nxpk= 20, iat=2368,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2372,2373,
 &end
#
#  144 TYR  HN          144 TYR  HB-         5.50    (#   3915:20  Unique         2.07, 2.80 A)
 &rst
  ixpk= 3915, nxpk= 20, iat=2368,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2372,2373,
 &end
#
#  144 TYR  HD          144 TYR  HB-         4.40    (#   3916:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 3916, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2376,2385,
 igr2=2372,2373,
 &end
#
#  144 TYR  HD          144 TYR  HB+         5.50    (#   3917:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 3917, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2376,2385,
 igr2=2372,2373,
 &end
#
#  144 TYR  HA          144 TYR  HB+         4.40    (#   3918:20  Unique         2.56, 2.83 A)
 &rst
  ixpk= 3918, nxpk= 20, iat=2370,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2372,2373,
 &end
#
#  144 TYR  HA          144 TYR  HB-         5.50    (#   3919:20  Unique         2.56, 2.83 A)
 &rst
  ixpk= 3919, nxpk= 20, iat=2370,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2372,2373,
 &end
#
#    0 AMB  20-2:3920   144 TYR  HB-         5.50    (#   3920:20  Single Ambig)
 &rst
  ixpk= 3920, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2180,2181,2182,2184,2185,2186,2358,2359,2360,2362,
      2363,2364,
 igr2=2372,2373,
 &end
#
#    0 AMB  20-2:3921     0 AMB  20-1:3921   5.50    (#   3921:20  Double Ambig)
 &rst
  ixpk= 3921, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1=2180,2181,2182,2184,2185,2186,2358,2359,2360,2362,
      2363,2364,
 igr2=2372,2373,2372,2373,
 &end
#
#  141 ARG  HN          138 SER  HA          5.50    (#   3922:20  Unique         2.87, 3.41 A)
 &rst
  ixpk= 3922, nxpk= 20, iat=2316,2265, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  145 ARG  HN          145 ARG  HA          3.50    (#   3923:20  Unique         2.81, 2.84 A)
 &rst
  ixpk= 3923, nxpk= 20, iat=2389,2391, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  158 LEU  HN          160 GLU  HB-         5.50    (#   3925:20  Unique         3.40, 4.63 A)
 &rst
  ixpk= 3925, nxpk= 20, iat=2608,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2648,2649,
 &end
#
#  145 ARG  HA          145 ARG  HB+         2.60    (#   3926:20  Unique         2.38, 2.78 A)
 &rst
  ixpk= 3926, nxpk= 20, iat=2391,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2393,2394,
 &end
#
#    0 AMB  20-2:3927     0 AMB  20-1:3927   2.60    (#   3927:20  Double Ambig)
 &rst
  ixpk= 3927, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2396,2397,2323,2324,2320,2321,
 igr2=2393,2394,2393,2394,2393,2394,
 &end
#
#  145 ARG  HG-         145 ARG  HB+         2.60    (#   3928:20  Unique         2.25, 2.72 A)
 &rst
  ixpk= 3928, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2396,2397,
 igr2=2393,2394,
 &end
#
#    0 AMB  20-2:3929     0 AMB  20-1:3929   5.50    (#   3929:20  Double Ambig)
 &rst
  ixpk= 3929, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1325,1326,1325,1326,
 &end
#
#  145 ARG  HN          145 ARG  HG-         5.50    (#   3930:20  Unique         2.79, 3.96 A)
 &rst
  ixpk= 3930, nxpk= 20, iat=2389,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2396,2397,
 &end
#
#    0 AMB  20-2:3931     0 AMB  20-1:3931   5.50    (#   3931:20  Double Ambig)
 &rst
  ixpk= 3931, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2128,2413,
 igr2=2396,2397,2396,2397,
 &end
#
#    0 AMB  20-2:3932     0 AMB  20-1:3932   2.60    (#   3932:20  Double Ambig)
 &rst
  ixpk= 3932, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1331,1332,2399,2400,
 igr2=1289,1290,2396,2397,
 &end
#
#  146 ARG  HD+         145 ARG  HG-         2.60    (#   3933:20  Unique         3.09, 5.89 A)
 &rst
  ixpk= 3933, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2423,2424,
 igr2=2396,2397,
 &end
#
#    0 AMB  20-2:3934   145 ARG  HG-         3.50    (#   3934:20  Single Ambig)
 &rst
  ixpk= 3934, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 igr2=2396,2397,
 &end
#
#    0 AMB  20-2:3936     0 AMB  20-1:3936   5.50    (#   3936:20  Double Ambig)
 &rst
  ixpk= 3936, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2178,1550,1551,
 igr2=2399,2400, 114, 115,
 &end
#
#  145 ARG  HN          145 ARG  HD+         5.50    (#   3937:20  Unique         3.67, 4.67 A)
 &rst
  ixpk= 3937, nxpk= 20, iat=2389,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2399,2400,
 &end
#
#  142 ASP  HN          145 ARG  HD+         5.50    (#   3938:20  Unique         4.05, 5.68 A)
 &rst
  ixpk= 3938, nxpk= 20, iat=2340,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2399,2400,
 &end
#
#  149 LYS  HN          146 ARG  HA          4.40    (#   3940:20  Unique         3.19, 3.33 A)
 &rst
  ixpk= 3940, nxpk= 20, iat=2470,2415, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:3941   146 ARG  HA          4.40    (#   3941:20  Single Ambig)
 &rst
  ixpk= 3941, nxpk= 20, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2437,2453,
 &end
#
#  146 ARG  HN          146 ARG  HA          3.50    (#   3942:20  Unique         2.83, 2.85 A)
 &rst
  ixpk= 3942, nxpk= 20, iat=2413,2415, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  146 ARG  HD+         146 ARG  HA          3.50    (#   3943:20  Unique         2.65, 3.46 A)
 &rst
  ixpk= 3943, nxpk= 20, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2423,2424,
 &end
#
#  149 LYS  HE+         146 ARG  HA          5.50    (#   3944:20  Unique         2.47, 3.68 A)
 &rst
  ixpk= 3944, nxpk= 20, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2483,2484,
 &end
#
#    0 AMB  20-2:3945   146 ARG  HA          2.60    (#   3945:20  Single Ambig)
 &rst
  ixpk= 3945, nxpk= 20, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2420,2421,2417,2418,
 &end
#
#  146 ARG  HG-         146 ARG  HA          2.60    (#   3946:20  Unique         2.09, 2.86 A)
 &rst
  ixpk= 3946, nxpk= 20, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2420,2421,
 &end
#
#    0 AMB  20-2:3947   146 ARG  HA          5.50    (#   3947:20  Single Ambig)
 &rst
  ixpk= 3947, nxpk= 20, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1189,1190,1191,1193,1194,1195,1189,1190,1191,1193,
      1194,1195,
 &end
#
#  147 VAL  MGY         146 ARG  HB+         4.40    (#   3948:20  Unique         3.74, 6.06 A)
 &rst
  ixpk= 3948, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=2417,2418,
 &end
#
#   75 LEU  MDX         146 ARG  HB+         2.60    (#   3949:20  Unique         1.97, 3.77 A)
 &rst
  ixpk= 3949, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1189,1190,1191,1193,1194,1195,
 igr2=2417,2418,
 &end
#
#  146 ARG  HG-         146 ARG  HB+         2.60    (#   3950:20  Unique         2.22, 2.62 A)
 &rst
  ixpk= 3950, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2420,2421,
 igr2=2417,2418,
 &end
#
#  147 VAL  HA          146 ARG  HB+         5.50    (#   3951:20  Unique         3.87, 4.36 A)
 &rst
  ixpk= 3951, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2417,2418,
 &end
#
#  146 ARG  HD+         146 ARG  HB+         2.60    (#   3952:20  Unique         2.15, 3.13 A)
 &rst
  ixpk= 3952, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2423,2424,
 igr2=2417,2418,
 &end
#
#  143 VAL  HA          146 ARG  HB+         4.40    (#   3953:20  Unique         2.70, 3.58 A)
 &rst
  ixpk= 3953, nxpk= 20, iat=2354,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2417,2418,
 &end
#
#  146 ARG  HA          146 ARG  HB+         2.60    (#   3954:20  Unique         2.67, 2.83 A)
 &rst
  ixpk= 3954, nxpk= 20, iat=2415,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2417,2418,
 &end
#
#  146 ARG  HN          146 ARG  HB+         2.60    (#   3955:20  Unique         2.10, 2.78 A)
 &rst
  ixpk= 3955, nxpk= 20, iat=2413,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2417,2418,
 &end
#
#  147 VAL  HN          146 ARG  HB+         3.50    (#   3956:20  Unique         2.70, 2.92 A)
 &rst
  ixpk= 3956, nxpk= 20, iat=2437,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2417,2418,
 &end
#
#  145 ARG  HN          146 ARG  HB+         5.50    (#   3957:20  Unique         4.34, 5.16 A)
 &rst
  ixpk= 3957, nxpk= 20, iat=2389,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2417,2418,
 &end
#
#    0 AMB  20-2:3958     0 AMB  20-1:3958   5.50    (#   3958:20  Double Ambig)
 &rst
  ixpk= 3958, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.80, r4=10.55,
 igr1=2697,1741,2342, 284,
 igr2= 265, 266, 265, 266,2420,2421, 265, 266,
 &end
#
#  146 ARG  HN          146 ARG  HG-         3.50    (#   3959:20  Unique         3.68, 4.13 A)
 &rst
  ixpk= 3959, nxpk= 20, iat=2413,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2420,2421,
 &end
#
#  146 ARG  HN          146 ARG  HG+         3.50    (#   3960:20  Unique         3.68, 4.13 A)
 &rst
  ixpk= 3960, nxpk= 20, iat=2413,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2420,2421,
 &end
#
#  147 VAL  HN          146 ARG  HG+         5.50    (#   3961:20  Unique         4.86, 4.98 A)
 &rst
  ixpk= 3961, nxpk= 20, iat=2437,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2420,2421,
 &end
#
#  146 ARG  HN          146 ARG  HD+         2.60    (#   3962:20  Unique         2.41, 3.04 A)
 &rst
  ixpk= 3962, nxpk= 20, iat=2413,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2423,2424,
 &end
#
#    0 AMB  20-2:3963     0 AMB  20-1:3963   5.50    (#   3963:20  Double Ambig)
 &rst
  ixpk= 3963, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.70, r4=10.45,
 igr1=2376,2385,1629,2515,2523,
 igr2=2423,2424,2423,2424,2423,2424,
 &end
#
#  146 ARG  HA          146 ARG  HD+         3.50    (#   3964:20  Unique         2.65, 3.46 A)
 &rst
  ixpk= 3964, nxpk= 20, iat=2415,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2423,2424,
 &end
#
#  143 VAL  HA          146 ARG  HD+         3.50    (#   3965:20  Unique         2.97, 4.11 A)
 &rst
  ixpk= 3965, nxpk= 20, iat=2354,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2423,2424,
 &end
#
#    0 AMB  20-2:3966     0 AMB  20-1:3966   2.60    (#   3966:20  Double Ambig)
 &rst
  ixpk= 3966, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2417,2418,2420,2421,
 igr2=2423,2424,2423,2424,
 &end
#
#  147 VAL  MGY         147 VAL  HA          2.60    (#   3967:20  Unique         2.30, 3.33 A)
 &rst
  ixpk= 3967, nxpk= 20, iat=  -1,2439, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  MGX         147 VAL  HA          2.60    (#   3968:20  Unique         2.30, 3.33 A)
 &rst
  ixpk= 3968, nxpk= 20, iat=  -1,2439, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#   71 THR  MG2         147 VAL  HA          3.50    (#   3969:20  Unique         2.11, 3.43 A)
 &rst
  ixpk= 3969, nxpk= 20, iat=  -1,2439, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1110,1111,1112,
 &end
#
#  147 VAL  HB          147 VAL  HA          3.50    (#   3970:20  Unique         2.40, 2.69 A)
 &rst
  ixpk= 3970, nxpk= 20, iat=2441,2439, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3971   147 VAL  HA          3.50    (#   3971:20  Single Ambig)
 &rst
  ixpk= 3971, nxpk= 20, iat=  -1,2439, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2496,2497,2457,2458,
 &end
#
#    0 AMB  20-2:3972   147 VAL  HA          3.50    (#   3972:20  Single Ambig)
 &rst
  ixpk= 3972, nxpk= 20, iat=  -1,2439, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2496,2497,2417,2418,1187,
 &end
#
#    0 AMB  20-2:3974   147 VAL  HA          4.40    (#   3974:20  Single Ambig)
 &rst
  ixpk= 3974, nxpk= 20, iat=  -1,2439, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=2492,1151,1152,
 &end
#
#    0 AMB  20-2:3975   147 VAL  HA          2.60    (#   3975:20  Single Ambig)
 &rst
  ixpk= 3975, nxpk= 20, iat=  -1,2439, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2437,2453,
 &end
#
#    0 AMB  20-2:3976   147 VAL  HA          4.40    (#   3976:20  Single Ambig)
 &rst
  ixpk= 3976, nxpk= 20, iat=  -1,2439, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=1629,2515,2523,
 &end
#
#  147 VAL  MGY         147 VAL  HB          2.60    (#   3978:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 3978, nxpk= 20, iat=  -1,2441, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  MGX         147 VAL  HB          2.60    (#   3979:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 3979, nxpk= 20, iat=  -1,2441, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:3980   147 VAL  HB          5.50    (#   3980:20  Single Ambig)
 &rst
  ixpk= 3980, nxpk= 20, iat=  -1,2441, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1=1187,2417,2418,2496,2497,1586,1587,
 &end
#
#  147 VAL  HA          147 VAL  HB          3.50    (#   3981:20  Unique         2.40, 2.69 A)
 &rst
  ixpk= 3981, nxpk= 20, iat=2439,2441, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  144 TYR  HA          147 VAL  HB          4.40    (#   3982:20  Unique         2.63, 3.52 A)
 &rst
  ixpk= 3982, nxpk= 20, iat=2370,2441, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:3983   147 VAL  HB          5.50    (#   3983:20  Single Ambig)
 &rst
  ixpk= 3983, nxpk= 20, iat=  -1,2441, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1629,2376,2385,
 &end
#
#  146 ARG  HN          147 VAL  HB          5.50    (#   3984:20  Unique         4.60, 4.92 A)
 &rst
  ixpk= 3984, nxpk= 20, iat=2413,2441, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:3985   147 VAL  HB          2.60    (#   3985:20  Single Ambig)
 &rst
  ixpk= 3985, nxpk= 20, iat=  -1,2441, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2437,2453,
 &end
#
#  144 TYR  HN          147 VAL  MGY         5.50    (#   3986:20  Unique         4.36, 6.47 A)
 &rst
  ixpk= 3986, nxpk= 20, iat=2368,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  HN          147 VAL  MGY         2.60    (#   3987:20  Unique         1.93, 3.74 A)
 &rst
  ixpk= 3987, nxpk= 20, iat=2437,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  146 ARG  HN          147 VAL  MGY         4.40    (#   3988:20  Unique         3.60, 5.97 A)
 &rst
  ixpk= 3988, nxpk= 20, iat=2413,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:3989   147 VAL  MGY         5.50    (#   3989:20  Single Ambig)
 &rst
  ixpk= 3989, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=1640,1594,1595,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:3990   147 VAL  MGY         2.60    (#   3990:20  Single Ambig)
 &rst
  ixpk= 3990, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1629,2376,2385,2515,2523,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:3992   147 VAL  MGY         5.50    (#   3992:20  Single Ambig)
 &rst
  ixpk= 3992, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2455,1106, 174, 175,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:3993   147 VAL  MGY         5.50    (#   3993:20  Single Ambig)
 &rst
  ixpk= 3993, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1108,1158,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  144 TYR  HA          147 VAL  MGY         3.50    (#   3994:20  Unique         2.06, 4.12 A)
 &rst
  ixpk= 3994, nxpk= 20, iat=2370,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#   99 TRP  HB+         147 VAL  MGY         5.50    (#   3995:20  Unique         1.99, 4.09 A)
 &rst
  ixpk= 3995, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1625,1626,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#   99 TRP  HB-         147 VAL  MGY         5.50    (#   3996:20  Unique         1.99, 4.09 A)
 &rst
  ixpk= 3996, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1625,1626,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  HA          147 VAL  MGY         2.60    (#   3997:20  Unique         2.30, 3.33 A)
 &rst
  ixpk= 3997, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:3998   147 VAL  MGY         3.50    (#   3998:20  Single Ambig)
 &rst
  ixpk= 3998, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2417,2418,2496,2497,1586,1587,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:3999   147 VAL  MGY         4.40    (#   3999:20  Single Ambig)
 &rst
  ixpk= 3999, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2457,2458,2396,2397,1612,1613,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#   75 LEU  MDX         147 VAL  MGY         2.60    (#   4000:20  Unique         1.93, 5.77 A)
 &rst
  ixpk= 4000, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1189,1190,1191,1193,1194,1195,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  HB          147 VAL  MGY         2.60    (#   4001:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 4001, nxpk= 20, iat=2441,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4003   147 VAL  MGY         2.60    (#   4003:20  Single Ambig)
 &rst
  ixpk= 4003, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1110,1111,1112,2358,2359,2360,2362,2363,2364,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#   14 VAL  MGX         147 VAL  MGX         2.60    (#   4006:20  Unique         3.99, 7.22 A)
 &rst
  ixpk= 4006, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#   14 VAL  MGY         147 VAL  MGX         4.40    (#   4007:20  Unique         3.99, 7.22 A)
 &rst
  ixpk= 4007, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  HB          147 VAL  MGX         2.60    (#   4008:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 4008, nxpk= 20, iat=2441,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#   75 LEU  MDX         147 VAL  MGX         3.50    (#   4009:20  Unique         1.93, 5.77 A)
 &rst
  ixpk= 4009, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1189,1190,1191,1193,1194,1195,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  143 VAL  MGX         147 VAL  MGX         2.60    (#   4010:20  Unique         2.55, 6.61 A)
 &rst
  ixpk= 4010, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2358,2359,2360,2362,2363,2364,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4011   147 VAL  MGX         4.40    (#   4011:20  Single Ambig)
 &rst
  ixpk= 4011, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2417,2418,2496,2497,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  HA          147 VAL  MGX         2.60    (#   4012:20  Unique         2.30, 3.33 A)
 &rst
  ixpk= 4012, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#   99 TRP  HB-         147 VAL  MGX         4.40    (#   4013:20  Unique         1.99, 4.09 A)
 &rst
  ixpk= 4013, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1625,1626,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#   99 TRP  HB+         147 VAL  MGX         3.50    (#   4014:20  Unique         1.99, 4.09 A)
 &rst
  ixpk= 4014, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1625,1626,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4015   147 VAL  MGX         5.50    (#   4015:20  Single Ambig)
 &rst
  ixpk= 4015, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2511,2512,2423,2424,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#  144 TYR  HA          147 VAL  MGX         4.40    (#   4016:20  Unique         2.06, 4.12 A)
 &rst
  ixpk= 4016, nxpk= 20, iat=2370,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4017   147 VAL  MGX         4.40    (#   4017:20  Single Ambig)
 &rst
  ixpk= 4017, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.76, r4= 8.51,
 igr1=2455, 174, 175, 174, 175,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4019   147 VAL  MGX         3.50    (#   4019:20  Single Ambig)
 &rst
  ixpk= 4019, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2376,2385,2515,2523,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4020   147 VAL  MGX         3.50    (#   4020:20  Single Ambig)
 &rst
  ixpk= 4020, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1640,1594,1595,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4021   147 VAL  MGX         4.40    (#   4021:20  Single Ambig)
 &rst
  ixpk= 4021, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2413,2492,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4022   147 VAL  MGX         5.50    (#   4022:20  Single Ambig)
 &rst
  ixpk= 4022, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1621,2352,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4023   147 VAL  MGX         2.60    (#   4023:20  Single Ambig)
 &rst
  ixpk= 4023, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2437,2453,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4024     0 AMB  20-1:4024   2.60    (#   4024:20  Double Ambig)
 &rst
  ixpk= 4024, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2453,2659,
 igr2=2455,2646,2629,
 &end
#
#    0 AMB  20-2:4025     0 AMB  20-1:4025   2.60    (#   4025:20  Double Ambig)
 &rst
  ixpk= 4025, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2651,2652,2634,2635,2634,2635,2634,2635,
 igr2=2646,2629,
 &end
#
#  159 GLN  HB+         159 GLN  HA          2.60    (#   4026:20  Unique         2.29, 2.46 A)
 &rst
  ixpk= 4026, nxpk= 20, iat=  -1,2629, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2631,2632,
 &end
#
#  148 MET  ME          148 MET  HA          3.50    (#   4027:20  Unique         2.00, 3.39 A)
 &rst
  ixpk= 4027, nxpk= 20, iat=  -1,2455, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2464,2465,2466,
 &end
#
#  147 VAL  MGX         148 MET  HA          5.50    (#   4028:20  Unique         3.35, 4.96 A)
 &rst
  ixpk= 4028, nxpk= 20, iat=  -1,2455, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4029     0 AMB  20-1:4029   3.50    (#   4029:20  Double Ambig)
 &rst
  ixpk= 4029, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2627,2527,2492,
 igr2=2629,2455,
 &end
#
#    0 AMB  20-2:4030     0 AMB  20-1:4030   5.50    (#   4030:20  Double Ambig)
 &rst
  ixpk= 4030, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 282,2608,
 igr2=2629,2646,
 &end
#
#  160 GLU  HN            0 AMB  20-1:4031   2.60    (#   4031:20  Single Ambig)
 &rst
  ixpk= 4031, nxpk= 20, iat=2644,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2646,2629,
 &end
#
#  149 LYS  HN          149 LYS  HA          3.50    (#   4033:20  Unique         2.82, 2.84 A)
 &rst
  ixpk= 4033, nxpk= 20, iat=2470,2472, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:4034   149 LYS  HA          3.50    (#   4034:20  Single Ambig)
 &rst
  ixpk= 4034, nxpk= 20, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2527,2492,
 &end
#
#  130 TRP  HH2         149 LYS  HA          2.60    (#   4035:20  Unique         4.37, 9.21 A)
 &rst
  ixpk= 4035, nxpk= 20, iat=2130,2472, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  149 LYS  HE+         149 LYS  HA          5.50    (#   4036:20  Unique         3.77, 5.33 A)
 &rst
  ixpk= 4036, nxpk= 20, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2483,2484,
 &end
#
#  149 LYS  HB+         149 LYS  HA          2.60    (#   4037:20  Unique         2.33, 2.70 A)
 &rst
  ixpk= 4037, nxpk= 20, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2474,2475,
 &end
#
#  149 LYS  HB-         149 LYS  HA          3.50    (#   4038:20  Unique         2.33, 2.70 A)
 &rst
  ixpk= 4038, nxpk= 20, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2474,2475,
 &end
#
#    0 AMB  20-2:4039   149 LYS  HA          3.50    (#   4039:20  Single Ambig)
 &rst
  ixpk= 4039, nxpk= 20, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2477,2478,2480,2481,
 &end
#
#    0 AMB  20-2:4040   149 LYS  HA          3.50    (#   4040:20  Single Ambig)
 &rst
  ixpk= 4040, nxpk= 20, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2477,2478,2531,2532,2533,
 &end
#
#    0 AMB  20-2:4041     0 AMB  20-1:4041   4.40    (#   4041:20  Double Ambig)
 &rst
  ixpk= 4041, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2470, 738,
 igr2=2477,2478, 793, 794,
 &end
#
#  149 LYS  HB+         149 LYS  HG+         3.50    (#   4042:20  Unique         2.23, 2.65 A)
 &rst
  ixpk= 4042, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2474,2475,
 igr2=2477,2478,
 &end
#
#  149 LYS  HB+         149 LYS  HG-         3.50    (#   4043:20  Unique         2.23, 2.65 A)
 &rst
  ixpk= 4043, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2474,2475,
 igr2=2477,2478,
 &end
#
#    0 AMB  20-2:4044     0 AMB  20-1:4044   2.60    (#   4044:20  Double Ambig)
 &rst
  ixpk= 4044, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1= 790, 791,2474,2475, 817, 818,
 igr2= 793, 794,2477,2478,
 &end
#
#    0 AMB  20-2:4045     0 AMB  20-1:4045   3.50    (#   4045:20  Double Ambig)
 &rst
  ixpk= 4045, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 790, 791,2474,2475, 817, 818,
 igr2= 793, 794,2477,2478, 793, 794,
 &end
#
#    0 AMB  20-2:4046     0 AMB  20-1:4046   2.60    (#   4046:20  Double Ambig)
 &rst
  ixpk= 4046, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2483,2484,1257,1258,
 igr2=2480,2481,1254,1255,
 &end
#
#  149 LYS  HA          149 LYS  HD-         3.50    (#   4047:20  Unique         2.19, 4.05 A)
 &rst
  ixpk= 4047, nxpk= 20, iat=2472,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2480,2481,
 &end
#
#    0 AMB  20-2:4048     0 AMB  20-1:4048   2.60    (#   4048:20  Double Ambig)
 &rst
  ixpk= 4048, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2474,2475, 289, 290,
 igr2=2480,2481, 262, 263,
 &end
#
#  149 LYS  HB+         149 LYS  HE+         3.50    (#   4050:20  Unique         2.02, 3.51 A)
 &rst
  ixpk= 4050, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2474,2475,
 igr2=2483,2484,
 &end
#
#    0 AMB  20-2:4051     0 AMB  20-1:4051   2.60    (#   4051:20  Double Ambig)
 &rst
  ixpk= 4051, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.60, r4= 6.35,
 igr1= 790, 791, 793, 794,1254,1255,1309,1310,1248,1249,
      
 igr2= 796, 797, 796, 797,1257,1258,1312,1313,1257,1258,
      
 &end
#
#    0 AMB  20-2:4053     0 AMB  20-1:4053   5.50    (#   4053:20  Double Ambig)
 &rst
  ixpk= 4053, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1151,1152,1423,
 igr2=2483,2484,1312,1313,
 &end
#
#    0 AMB  20-2:4054   150 GLU  HA          2.60    (#   4054:20  Single Ambig)
 &rst
  ixpk= 4054, nxpk= 20, iat=  -1,2494, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2492,2527,
 &end
#
#  147 VAL  MGY           0 AMB  20-1:4055   4.40    (#   4055:20  Single Ambig)
 &rst
  ixpk= 4055, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=1187,2496,2497,
 &end
#
#  147 VAL  MGY         150 GLU  HB-         5.50    (#   4056:20  Unique         4.15, 6.83 A)
 &rst
  ixpk= 4056, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=2496,2497,
 &end
#
#   71 THR  MG2         150 GLU  HB-         2.60    (#   4058:20  Unique         2.62, 4.21 A)
 &rst
  ixpk= 4058, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1110,1111,1112,
 igr2=2496,2497,
 &end
#
#  150 GLU  HG-         150 GLU  HB+         2.60    (#   4059:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4059, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2499,2500,
 igr2=2496,2497,
 &end
#
#  150 GLU  HG+         150 GLU  HB+         2.60    (#   4060:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4060, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2499,2500,
 igr2=2496,2497,
 &end
#
#  150 GLU  HG-         150 GLU  HB-         2.60    (#   4061:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4061, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2499,2500,
 igr2=2496,2497,
 &end
#
#  150 GLU  HG+         150 GLU  HB-         2.60    (#   4062:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4062, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2499,2500,
 igr2=2496,2497,
 &end
#
#  147 VAL  HA          150 GLU  HB-         3.50    (#   4063:20  Unique         3.23, 4.25 A)
 &rst
  ixpk= 4063, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2496,2497,
 &end
#
#  147 VAL  HA          150 GLU  HB+         4.40    (#   4064:20  Unique         3.23, 4.25 A)
 &rst
  ixpk= 4064, nxpk= 20, iat=2439,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2496,2497,
 &end
#
#  150 GLU  HA          150 GLU  HB+         2.60    (#   4065:20  Unique         2.36, 2.81 A)
 &rst
  ixpk= 4065, nxpk= 20, iat=2494,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2496,2497,
 &end
#
#  150 GLU  HA          150 GLU  HB-         2.60    (#   4066:20  Unique         2.36, 2.81 A)
 &rst
  ixpk= 4066, nxpk= 20, iat=2494,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2496,2497,
 &end
#
#  151 PHE  HD          150 GLU  HB-         3.50    (#   4067:20  Unique         3.00, 5.08 A)
 &rst
  ixpk= 4067, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2515,2523,
 igr2=2496,2497,
 &end
#
#    0 AMB  20-2:4068     0 AMB  20-1:4068   5.50    (#   4068:20  Double Ambig)
 &rst
  ixpk= 4068, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=1629,2515,2523,
 igr2=1187,2496,2497,
 &end
#
#  150 GLU  HN          150 GLU  HB+         2.60    (#   4070:20  Unique         2.07, 2.74 A)
 &rst
  ixpk= 4070, nxpk= 20, iat=2492,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2496,2497,
 &end
#
#  150 GLU  HN          150 GLU  HB-         2.60    (#   4071:20  Unique         2.07, 2.74 A)
 &rst
  ixpk= 4071, nxpk= 20, iat=2492,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2496,2497,
 &end
#
#    0 AMB  20-2:4072     0 AMB  20-1:4072   3.50    (#   4072:20  Double Ambig)
 &rst
  ixpk= 4072, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2492,1151,1152,2627,
 igr2=2499,2500,2499,2500,2651,2652,
 &end
#
#    0 AMB  20-2:4073   150 GLU  HG-         3.50    (#   4073:20  Single Ambig)
 &rst
  ixpk= 4073, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2492,1151,1152,
 igr2=2499,2500,
 &end
#
#  151 PHE  HD          150 GLU  HG+         4.40    (#   4074:20  Unique         2.56, 6.74 A)
 &rst
  ixpk= 4074, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2515,2523,
 igr2=2499,2500,
 &end
#
#  151 PHE  HD          150 GLU  HG-         4.40    (#   4075:20  Unique         2.56, 6.74 A)
 &rst
  ixpk= 4075, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2515,2523,
 igr2=2499,2500,
 &end
#
#   22 VAL  HA           22 VAL  HB          4.40    (#   4076:20  Unique         2.50, 2.68 A)
 &rst
  ixpk= 4076, nxpk= 20, iat= 325, 327, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  150 GLU  HA          150 GLU  HG-         2.60    (#   4077:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 4077, nxpk= 20, iat=2494,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2499,2500,
 &end
#
#  150 GLU  HB+         150 GLU  HG+         2.60    (#   4078:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4078, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2496,2497,
 igr2=2499,2500,
 &end
#
#  150 GLU  HB+         150 GLU  HG-         2.60    (#   4079:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4079, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2496,2497,
 igr2=2499,2500,
 &end
#
#  150 GLU  HB-         150 GLU  HG-         2.60    (#   4080:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4080, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2496,2497,
 igr2=2499,2500,
 &end
#
#  150 GLU  HB-         150 GLU  HG+         2.60    (#   4081:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4081, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2496,2497,
 igr2=2499,2500,
 &end
#
#   71 THR  MG2         150 GLU  HG-         3.50    (#   4082:20  Unique         3.19, 5.21 A)
 &rst
  ixpk= 4082, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1110,1111,1112,
 igr2=2499,2500,
 &end
#
#   71 THR  MG2         150 GLU  HG+         4.40    (#   4083:20  Unique         3.19, 5.21 A)
 &rst
  ixpk= 4083, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1110,1111,1112,
 igr2=2499,2500,
 &end
#
#  151 PHE  HB-         151 PHE  HA          4.40    (#   4084:20  Unique         2.39, 2.75 A)
 &rst
  ixpk= 4084, nxpk= 20, iat=  -1,2509, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2511,2512,
 &end
#
#  151 PHE  HB+         151 PHE  HA          4.40    (#   4085:20  Unique         2.39, 2.75 A)
 &rst
  ixpk= 4085, nxpk= 20, iat=  -1,2509, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2511,2512,
 &end
#
#  151 PHE  HD          151 PHE  HA          2.60    (#   4086:20  Unique         1.88, 3.31 A)
 &rst
  ixpk= 4086, nxpk= 20, iat=  -1,2509, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2515,2523,
 &end
#
#  151 PHE  HN          151 PHE  HB+         5.50    (#   4088:20  Unique         2.43, 3.05 A)
 &rst
  ixpk= 4088, nxpk= 20, iat=2507,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2511,2512,
 &end
#
#  151 PHE  HN          151 PHE  HB-         5.50    (#   4089:20  Unique         2.43, 3.05 A)
 &rst
  ixpk= 4089, nxpk= 20, iat=2507,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2511,2512,
 &end
#
#  151 PHE  HD          151 PHE  HB-         4.40    (#   4090:20  Unique         2.36, 3.06 A)
 &rst
  ixpk= 4090, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2515,2523,
 igr2=2511,2512,
 &end
#
#  151 PHE  HD          151 PHE  HB+         3.50    (#   4091:20  Unique         2.36, 3.06 A)
 &rst
  ixpk= 4091, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2515,2523,
 igr2=2511,2512,
 &end
#
#  151 PHE  HA          151 PHE  HB+         5.50    (#   4092:20  Unique         2.39, 2.75 A)
 &rst
  ixpk= 4092, nxpk= 20, iat=2509,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2511,2512,
 &end
#
#  151 PHE  HA          151 PHE  HB-         5.50    (#   4093:20  Unique         2.39, 2.75 A)
 &rst
  ixpk= 4093, nxpk= 20, iat=2509,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2511,2512,
 &end
#
#  101 LEU  MDY         151 PHE  HB-         5.50    (#   4094:20  Unique         1.93, 4.54 A)
 &rst
  ixpk= 4094, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=2511,2512,
 &end
#
#  101 LEU  MDY         151 PHE  HB+         5.50    (#   4095:20  Unique         1.93, 4.54 A)
 &rst
  ixpk= 4095, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=2511,2512,
 &end
#
#  155 VAL  MGX         152 ALA  HA          4.40    (#   4096:20  Unique         1.95, 3.85 A)
 &rst
  ixpk= 4096, nxpk= 20, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2570,2571,2572,2574,2575,2576,
 &end
#
#  155 VAL  MGY         152 ALA  HA          3.50    (#   4097:20  Unique         1.95, 3.85 A)
 &rst
  ixpk= 4097, nxpk= 20, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:4098   152 ALA  HA          2.60    (#   4098:20  Single Ambig)
 &rst
  ixpk= 4098, nxpk= 20, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2531,2532,2533,2568,
 &end
#
#    0 AMB  20-2:4099   152 ALA  HA          5.50    (#   4099:20  Single Ambig)
 &rst
  ixpk= 4099, nxpk= 20, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2587,2588, 237, 238,
 &end
#
#    0 AMB  20-2:4100   152 ALA  HA          5.50    (#   4100:20  Single Ambig)
 &rst
  ixpk= 4100, nxpk= 20, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2591,2592,2593,2552,
 &end
#
#  129 TYR  HD          152 ALA  HA          4.40    (#   4102:20  Unique         2.41, 4.31 A)
 &rst
  ixpk= 4102, nxpk= 20, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2102,2111,
 &end
#
#  152 ALA  HN          152 ALA  HA          3.50    (#   4103:20  Unique         2.76, 2.80 A)
 &rst
  ixpk= 4103, nxpk= 20, iat=2527,2529, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  153 SER  HN          152 ALA  HA          5.50    (#   4105:20  Unique         3.41, 3.44 A)
 &rst
  ixpk= 4105, nxpk= 20, iat=2537,2529, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  130 TRP  HE1         152 ALA  MB          5.50    (#   4106:20  Unique         2.98, 4.91 A)
 &rst
  ixpk= 4106, nxpk= 20, iat=2125,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=2531,2532,2533,
 &end
#
#  153 SER  HN          152 ALA  MB          3.50    (#   4107:20  Unique         3.05, 3.76 A)
 &rst
  ixpk= 4107, nxpk= 20, iat=2537,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2531,2532,2533,
 &end
#
#    0 AMB  20-2:4108   152 ALA  MB          5.50    (#   4108:20  Single Ambig)
 &rst
  ixpk= 4108, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=2580,2094,2453,
 igr2=2531,2532,2533,
 &end
#
#  152 ALA  HN          152 ALA  MB          2.60    (#   4109:20  Unique         2.10, 2.88 A)
 &rst
  ixpk= 4109, nxpk= 20, iat=2527,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=2531,2532,2533,
 &end
#
#  130 TRP  HH2         152 ALA  MB          3.50    (#   4110:20  Unique         4.90, 9.17 A)
 &rst
  ixpk= 4110, nxpk= 20, iat=2130,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2531,2532,2533,
 &end
#
#  129 TYR  HD          152 ALA  MB          4.40    (#   4111:20  Unique         1.98, 4.63 A)
 &rst
  ixpk= 4111, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2102,2111,
 igr2=2531,2532,2533,
 &end
#
#  149 LYS  HA          152 ALA  MB          3.50    (#   4113:20  Unique         2.35, 3.65 A)
 &rst
  ixpk= 4113, nxpk= 20, iat=2472,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2531,2532,2533,
 &end
#
#  153 SER  HA          152 ALA  MB          4.40    (#   4114:20  Unique         4.08, 4.89 A)
 &rst
  ixpk= 4114, nxpk= 20, iat=2539,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=2531,2532,2533,
 &end
#
#    0 AMB  20-2:4115   152 ALA  MB          4.40    (#   4115:20  Single Ambig)
 &rst
  ixpk= 4115, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.91, r4= 7.66,
 igr1=2541,2542,2415, 301, 302,
 igr2=2531,2532,2533,
 &end
#
#  152 ALA  HA          152 ALA  MB          2.60    (#   4116:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 4116, nxpk= 20, iat=2529,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=2531,2532,2533,
 &end
#
#  156 MET  HG+         152 ALA  MB          5.50    (#   4117:20  Unique         3.89, 5.59 A)
 &rst
  ixpk= 4117, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2587,2588,
 igr2=2531,2532,2533,
 &end
#
#  156 MET  ME          152 ALA  MB          3.50    (#   4118:20  Unique         2.23, 4.32 A)
 &rst
  ixpk= 4118, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2591,2592,2593,
 igr2=2531,2532,2533,
 &end
#
#    0 AMB  20-2:4120   152 ALA  MB          4.40    (#   4120:20  Single Ambig)
 &rst
  ixpk= 4120, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2570,2571,2572,2574,2575,2576,2180,2181,2182,2184,
      2185,2186,
 igr2=2531,2532,2533,
 &end
#
#  155 VAL  MGX         152 ALA  MB          5.50    (#   4121:20  Unique         3.58, 5.89 A)
 &rst
  ixpk= 4121, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2570,2571,2572,2574,2575,2576,
 igr2=2531,2532,2533,
 &end
#
#    0 AMB  20-2:4122   153 SER  HA          4.40    (#   4122:20  Single Ambig)
 &rst
  ixpk= 4122, nxpk= 20, iat=  -1,2539, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2531,2532,2533,2568,
 &end
#
#  156 MET  HB+         153 SER  HA          3.50    (#   4123:20  Unique         3.10, 4.27 A)
 &rst
  ixpk= 4123, nxpk= 20, iat=  -1,2539, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2584,2585,
 &end
#
#  156 MET  HG+         153 SER  HA          5.50    (#   4124:20  Unique         2.24, 2.96 A)
 &rst
  ixpk= 4124, nxpk= 20, iat=  -1,2539, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2587,2588,
 &end
#
#  153 SER  HB+         153 SER  HA          2.60    (#   4125:20  Unique         2.29, 2.74 A)
 &rst
  ixpk= 4125, nxpk= 20, iat=  -1,2539, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2541,2542,
 &end
#
#  154 VAL  HN          153 SER  HA          4.40    (#   4127:20  Unique         3.48, 3.52 A)
 &rst
  ixpk= 4127, nxpk= 20, iat=2548,2539, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:4128   153 SER  HA          5.50    (#   4128:20  Single Ambig)
 &rst
  ixpk= 4128, nxpk= 20, iat=  -1,2539, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2597,2128,
 &end
#
#  156 MET  HN          153 SER  HA          3.50    (#   4129:20  Unique         3.47, 3.70 A)
 &rst
  ixpk= 4129, nxpk= 20, iat=2580,2539, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  153 SER  HN          153 SER  HA          3.50    (#   4130:20  Unique         2.79, 2.82 A)
 &rst
  ixpk= 4130, nxpk= 20, iat=2537,2539, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  153 SER  HN          153 SER  HB+         2.60    (#   4131:20  Unique         2.15, 2.64 A)
 &rst
  ixpk= 4131, nxpk= 20, iat=2537,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2541,2542,
 &end
#
#  154 VAL  HN          153 SER  HB+         3.50    (#   4132:20  Unique         2.47, 3.32 A)
 &rst
  ixpk= 4132, nxpk= 20, iat=2548,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2541,2542,
 &end
#
#    0 AMB  20-2:4133     0 AMB  20-1:4133   2.60    (#   4133:20  Double Ambig)
 &rst
  ixpk= 4133, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2539,2494,
 igr2=2541,2542,2541,2542,
 &end
#
#  152 ALA  HA          153 SER  HB+         5.50    (#   4134:20  Unique         5.50, 5.84 A)
 &rst
  ixpk= 4134, nxpk= 20, iat=2529,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2541,2542,
 &end
#
#    0 AMB  20-2:4135     0 AMB  20-1:4135   4.40    (#   4135:20  Double Ambig)
 &rst
  ixpk= 4135, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=2584,2585,2474,2475,
 igr2=2541,2542,2541,2542,
 &end
#
#    0 AMB  20-2:4136     0 AMB  20-1:4136   4.40    (#   4136:20  Double Ambig)
 &rst
  ixpk= 4136, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.25, r4= 8.00,
 igr1=2531,2532,2533,2496,2497,
 igr2=2541,2542,2541,2542,
 &end
#
#  154 VAL  MGY         153 SER  HB+         5.50    (#   4137:20  Unique         3.25, 5.99 A)
 &rst
  ixpk= 4137, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2554,2555,2556,2558,2559,2560,
 igr2=2541,2542,
 &end
#
#  101 LEU  MDY         154 VAL  HA          5.50    (#   4138:20  Unique         4.68, 6.88 A)
 &rst
  ixpk= 4138, nxpk= 20, iat=  -1,2550, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#  154 VAL  MGY         154 VAL  HA          2.60    (#   4139:20  Unique         2.14, 3.14 A)
 &rst
  ixpk= 4139, nxpk= 20, iat=  -1,2550, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2554,2555,2556,2558,2559,2560,
 &end
#
#  154 VAL  MGX         154 VAL  HA          2.60    (#   4140:20  Unique         2.14, 3.14 A)
 &rst
  ixpk= 4140, nxpk= 20, iat=  -1,2550, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2554,2555,2556,2558,2559,2560,
 &end
#
#  154 VAL  HB          154 VAL  HA          3.50    (#   4141:20  Unique         2.55, 2.97 A)
 &rst
  ixpk= 4141, nxpk= 20, iat=2552,2550, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  157 SER  HB+         154 VAL  HA          3.50    (#   4142:20  Unique         3.19, 4.27 A)
 &rst
  ixpk= 4142, nxpk= 20, iat=  -1,2550, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2601,2602,
 &end
#
#  153 SER  HA          154 VAL  HA          5.50    (#   4143:20  Unique         4.73, 4.76 A)
 &rst
  ixpk= 4143, nxpk= 20, iat=2539,2550, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  154 VAL  HN          154 VAL  HA          3.50    (#   4145:20  Unique         2.81, 2.84 A)
 &rst
  ixpk= 4145, nxpk= 20, iat=2548,2550, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  155 VAL  HN          154 VAL  HA          3.50    (#   4146:20  Unique         3.51, 3.53 A)
 &rst
  ixpk= 4146, nxpk= 20, iat=2564,2550, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:4147   154 VAL  HB          4.40    (#   4147:20  Single Ambig)
 &rst
  ixpk= 4147, nxpk= 20, iat=  -1,2552, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=2612,2613,2568,
 &end
#
#    0 AMB  20-2:4148   154 VAL  HB          5.50    (#   4148:20  Single Ambig)
 &rst
  ixpk= 4148, nxpk= 20, iat=  -1,2552, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1087,1088,1089,1068,1069,
 &end
#
#    0 AMB  20-2:4150     0 AMB  20-1:4150   5.50    (#   4150:20  Double Ambig)
 &rst
  ixpk= 4150, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1=2372,2373, 237, 238,
 igr2=2180,2181,2182,2184,2185,2186,2554,2555,2556,2558,
      2559,2560,
 &end
#
#  154 VAL  HN          154 VAL  MGY         2.60    (#   4151:20  Unique         1.76, 3.61 A)
 &rst
  ixpk= 4151, nxpk= 20, iat=2548,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#  154 VAL  HB          154 VAL  MGY         2.60    (#   4152:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4152, nxpk= 20, iat=2552,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#  101 LEU  MDY         154 VAL  MGY         2.60    (#   4154:20  Unique         1.99, 5.19 A)
 &rst
  ixpk= 4154, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:4155   155 VAL  HA          2.60    (#   4155:20  Single Ambig)
 &rst
  ixpk= 4155, nxpk= 20, iat=  -1,2566, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2570,2571,2572,2574,2575,2576,2617,2618,2619,2621,
      2622,2623,
 &end
#
#    0 AMB  20-2:4156   155 VAL  HA          2.60    (#   4156:20  Single Ambig)
 &rst
  ixpk= 4156, nxpk= 20, iat=  -1,2566, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2570,2571,2572,2574,2575,2576,2554,2555,2556,2558,
      2559,2560,
 &end
#
#    0 AMB  20-2:4157   155 VAL  HA          3.50    (#   4157:20  Single Ambig)
 &rst
  ixpk= 4157, nxpk= 20, iat=  -1,2566, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2612,2613,2568,
 &end
#
#  158 LEU  HB+         155 VAL  HA          3.50    (#   4158:20  Unique         1.90, 2.49 A)
 &rst
  ixpk= 4158, nxpk= 20, iat=  -1,2566, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2612,2613,
 &end
#
#    0 AMB  20-2:4159   155 VAL  HA          4.40    (#   4159:20  Single Ambig)
 &rst
  ixpk= 4159, nxpk= 20, iat=  -1,2566, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr1=2552,2648,2649,
 &end
#
#    0 AMB  20-2:4160   155 VAL  HA          5.50    (#   4160:20  Single Ambig)
 &rst
  ixpk= 4160, nxpk= 20, iat=  -1,2566, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2610,2582,
 &end
#
#  155 VAL  HN          155 VAL  HA          3.50    (#   4161:20  Unique         2.76, 2.78 A)
 &rst
  ixpk= 4161, nxpk= 20, iat=2564,2566, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  156 MET  HN          155 VAL  HA          4.40    (#   4162:20  Unique         3.51, 3.52 A)
 &rst
  ixpk= 4162, nxpk= 20, iat=2580,2566, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:4165   155 VAL  HB          5.50    (#   4165:20  Single Ambig)
 &rst
  ixpk= 4165, nxpk= 20, iat=  -1,2568, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2582,2610,
 &end
#
#    0 AMB  20-2:4167     0 AMB  20-1:4167   2.60    (#   4167:20  Double Ambig)
 &rst
  ixpk= 4167, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1= 832,2568,2612,2613,
 igr2= 900, 901, 902, 904, 905, 906,2570,2571,2572,2574,
      2575,2576,
 &end
#
#    0 AMB  20-2:4168     0 AMB  20-1:4168   3.50    (#   4168:20  Double Ambig)
 &rst
  ixpk= 4168, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.49, r4= 8.24,
 igr1=2552, 829, 830, 313, 314,1009, 817, 818,
 igr2=2570,2571,2572,2574,2575,2576, 900, 901, 902, 904,
       905, 906,
 &end
#
#    0 AMB  20-2:4169   155 VAL  MGX         3.50    (#   4169:20  Single Ambig)
 &rst
  ixpk= 4169, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2098,2099, 237, 238,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#  129 TYR  HD          155 VAL  MGX         3.50    (#   4171:20  Unique         2.28, 5.07 A)
 &rst
  ixpk= 4171, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2102,2111,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#  104 LEU  HN          104 LEU  MDX         4.40    (#   4172:20  Unique         3.59, 4.96 A)
 &rst
  ixpk= 4172, nxpk= 20, iat=1720,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1729,1730,1731,1733,1734,1735,
 &end
#
#  156 MET  HN          155 VAL  MGY         3.50    (#   4173:20  Unique         2.02, 4.37 A)
 &rst
  ixpk= 4173, nxpk= 20, iat=2580,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#  155 VAL  HN          155 VAL  MGY         2.60    (#   4174:20  Unique         1.87, 3.49 A)
 &rst
  ixpk= 4174, nxpk= 20, iat=2564,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:4175   155 VAL  MGY         5.50    (#   4175:20  Single Ambig)
 &rst
  ixpk= 4175, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2587,2588, 237, 238,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:4176   155 VAL  MGY         2.60    (#   4176:20  Single Ambig)
 &rst
  ixpk= 4176, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2568,2612,2613,2531,2532,2533,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:4177     0 AMB  20-1:4177   2.60    (#   4177:20  Double Ambig)
 &rst
  ixpk= 4177, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=2612,2613,2615, 218,
 igr2=2570,2571,2572,2574,2575,2576,1729,1730,1731,1733,
      1734,1735,
 &end
#
#    0 AMB  20-2:4178     0 AMB  20-1:4178   3.50    (#   4178:20  Double Ambig)
 &rst
  ixpk= 4178, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1009,2552,
 igr2=1729,1730,1731,1733,1734,1735,2570,2571,2572,2574,
      2575,2576,
 &end
#
#  155 VAL  HA          156 MET  HA          5.50    (#   4180:20  Unique         4.79, 4.83 A)
 &rst
  ixpk= 4180, nxpk= 20, iat=2566,2582, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:4181   156 MET  HA          3.50    (#   4181:20  Single Ambig)
 &rst
  ixpk= 4181, nxpk= 20, iat=  -1,2582, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2597,2627,
 &end
#
#  158 LEU  HN          156 MET  HA          4.40    (#   4182:20  Unique         3.69, 3.90 A)
 &rst
  ixpk= 4182, nxpk= 20, iat=2608,2582, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  156 MET  HN          156 MET  HA          2.60    (#   4184:20  Unique         2.77, 2.79 A)
 &rst
  ixpk= 4184, nxpk= 20, iat=2580,2582, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  156 MET  HG-         156 MET  HB+         2.60    (#   4185:20  Unique         2.37, 2.57 A)
 &rst
  ixpk= 4185, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2587,2588,
 igr2=2584,2585,
 &end
#
#  156 MET  HG+         156 MET  HB+         2.60    (#   4186:20  Unique         2.37, 2.57 A)
 &rst
  ixpk= 4186, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2587,2588,
 igr2=2584,2585,
 &end
#
#  156 MET  HA          156 MET  HB+         2.60    (#   4187:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 4187, nxpk= 20, iat=2582,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2584,2585,
 &end
#
#  156 MET  HN          156 MET  HB+         2.60    (#   4188:20  Unique         2.53, 3.09 A)
 &rst
  ixpk= 4188, nxpk= 20, iat=2580,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2584,2585,
 &end
#
#  155 VAL  MGX         156 MET  HG-         5.50    (#   4191:20  Unique         2.53, 6.27 A)
 &rst
  ixpk= 4191, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2570,2571,2572,2574,2575,2576,
 igr2=2587,2588,
 &end
#
#  119 PRO  HG-         119 PRO  HB-         3.50    (#   4192:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 4192, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1931,1932,
 igr2=1934,1935,
 &end
#
#  119 PRO  HG+         119 PRO  HB-         2.60    (#   4193:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 4193, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1931,1932,
 igr2=1934,1935,
 &end
#
#    0 AMB  20-2:4195     0 AMB  20-1:4195   4.40    (#   4195:20  Double Ambig)
 &rst
  ixpk= 4195, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1= 442, 443,2663,2664,
 igr2=1934,1935,2587,2588,
 &end
#
#  119 PRO  HD+         119 PRO  HB-         4.40    (#   4196:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4196, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1928,1929,
 igr2=1934,1935,
 &end
#
#  156 MET  HA          156 MET  HG-         3.50    (#   4197:20  Unique         3.10, 3.48 A)
 &rst
  ixpk= 4197, nxpk= 20, iat=2582,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2587,2588,
 &end
#
#  119 PRO  HA          119 PRO  HB-         2.60    (#   4198:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4198, nxpk= 20, iat=1937,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1934,1935,
 &end
#
#  114 GLN  HA          119 PRO  HB-         4.40    (#   4200:20  Unique         2.32, 4.01 A)
 &rst
  ixpk= 4200, nxpk= 20, iat=1862,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1934,1935,
 &end
#
#   28 PHE  HD          119 PRO  HB-         5.50    (#   4201:20  Unique         6.55, 7.56 A)
 &rst
  ixpk= 4201, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 446, 454,
 igr2=1934,1935,
 &end
#
#    0 AMB  20-2:4202   156 MET  HG-         5.50    (#   4202:20  Single Ambig)
 &rst
  ixpk= 4202, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2548,2608,
 igr2=2587,2588,
 &end
#
#    0 AMB  20-2:4203     0 AMB  20-1:4203   5.50    (#   4203:20  Double Ambig)
 &rst
  ixpk= 4203, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2548, 282,2608,
 igr2=2587,2588, 237, 238,2587,2588,
 &end
#
#    0 AMB  20-2:4204   156 MET  HG-         5.50    (#   4204:20  Single Ambig)
 &rst
  ixpk= 4204, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2597,2527,2627,
 igr2=2587,2588,
 &end
#
#  156 MET  HN          156 MET  HG-         2.60    (#   4205:20  Unique         1.95, 2.82 A)
 &rst
  ixpk= 4205, nxpk= 20, iat=2580,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2587,2588,
 &end
#
#  157 SER  HB+         157 SER  HA          2.60    (#   4206:20  Unique         2.40, 2.78 A)
 &rst
  ixpk= 4206, nxpk= 20, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2601,2602,
 &end
#
#  160 GLU  HG+         157 SER  HA          4.40    (#   4208:20  Unique         1.93, 4.54 A)
 &rst
  ixpk= 4208, nxpk= 20, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2651,2652,
 &end
#
#    0 AMB  20-2:4209     0 AMB  20-1:4209   4.40    (#   4209:20  Double Ambig)
 &rst
  ixpk= 4209, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2580,2659,
 igr2=2601,2602,2601,2602,
 &end
#
#  157 SER  HA          157 SER  HB+         2.60    (#   4211:20  Unique         2.40, 2.78 A)
 &rst
  ixpk= 4211, nxpk= 20, iat=2599,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2601,2602,
 &end
#
#  154 VAL  HA          157 SER  HB+         3.50    (#   4212:20  Unique         3.19, 4.27 A)
 &rst
  ixpk= 4212, nxpk= 20, iat=2550,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2601,2602,
 &end
#
#    0 AMB  20-2:4213     0 AMB  20-1:4213   4.40    (#   4213:20  Double Ambig)
 &rst
  ixpk= 4213, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2612,2613,2615,
 igr2=2601,2602,2601,2602,
 &end
#
#    0 AMB  20-2:4214     0 AMB  20-1:4214   4.40    (#   4214:20  Double Ambig)
 &rst
  ixpk= 4214, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=1919,1920,1921,2554,2555,2556,2558,2559,2560,
 igr2=1906,1907,2601,2602,
 &end
#
#   22 VAL  MGY         148 MET  HA          4.40    (#   4215:20  Unique         5.31, 7.40 A)
 &rst
  ixpk= 4215, nxpk= 20, iat=  -1,2455, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:4216   134 ARG  HA          4.40    (#   4216:20  Single Ambig)
 &rst
  ixpk= 4216, nxpk= 20, iat=  -1,2192, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 &end
#
#  158 LEU  HB-         158 LEU  HA          2.60    (#   4217:20  Unique         2.26, 2.65 A)
 &rst
  ixpk= 4217, nxpk= 20, iat=  -1,2610, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2612,2613,
 &end
#
#    0 AMB  20-2:4218   158 LEU  HA          2.60    (#   4218:20  Single Ambig)
 &rst
  ixpk= 4218, nxpk= 20, iat=  -1,2610, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=2612,2613,2615,
 &end
#
#  134 ARG  HD+         134 ARG  HA          4.40    (#   4219:20  Unique         2.10, 3.13 A)
 &rst
  ixpk= 4219, nxpk= 20, iat=  -1,2192, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2200,2201,
 &end
#
#  155 VAL  HA          158 LEU  HA          5.50    (#   4220:20  Unique         4.62, 4.76 A)
 &rst
  ixpk= 4220, nxpk= 20, iat=2566,2610, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  158 LEU  HN          158 LEU  HA          3.50    (#   4221:20  Unique         2.94, 2.94 A)
 &rst
  ixpk= 4221, nxpk= 20, iat=2608,2610, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:4222   158 LEU  HA          3.50    (#   4222:20  Single Ambig)
 &rst
  ixpk= 4222, nxpk= 20, iat=  -1,2610, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2627,2597,
 &end
#
#  158 LEU  HN          158 LEU  HB-         3.50    (#   4225:20  Unique         2.29, 2.82 A)
 &rst
  ixpk= 4225, nxpk= 20, iat=2608,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2612,2613,
 &end
#
#  159 GLN  HN          158 LEU  HB-         3.50    (#   4226:20  Unique         2.05, 3.03 A)
 &rst
  ixpk= 4226, nxpk= 20, iat=2627,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2612,2613,
 &end
#
#  159 GLN  HN          158 LEU  HB+         3.50    (#   4227:20  Unique         2.05, 3.03 A)
 &rst
  ixpk= 4227, nxpk= 20, iat=2627,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2612,2613,
 &end
#
#  158 LEU  HN          158 LEU  HB+         2.60    (#   4228:20  Unique         2.29, 2.82 A)
 &rst
  ixpk= 4228, nxpk= 20, iat=2608,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2612,2613,
 &end
#
#  158 LEU  HA          158 LEU  HB-         2.60    (#   4229:20  Unique         2.26, 2.65 A)
 &rst
  ixpk= 4229, nxpk= 20, iat=2610,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2612,2613,
 &end
#
#  158 LEU  HA          158 LEU  HB+         3.50    (#   4230:20  Unique         2.26, 2.65 A)
 &rst
  ixpk= 4230, nxpk= 20, iat=2610,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2612,2613,
 &end
#
#   18 ARG  HA          158 LEU  HB-         5.50    (#   4232:20  Unique         4.84, 5.27 A)
 &rst
  ixpk= 4232, nxpk= 20, iat= 260,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2612,2613,
 &end
#
#  155 VAL  HA          158 LEU  HB-         5.50    (#   4233:20  Unique         1.90, 2.49 A)
 &rst
  ixpk= 4233, nxpk= 20, iat=2566,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2612,2613,
 &end
#
#  155 VAL  HA          158 LEU  HB+         4.40    (#   4234:20  Unique         1.90, 2.49 A)
 &rst
  ixpk= 4234, nxpk= 20, iat=2566,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2612,2613,
 &end
#
#    0 AMB  20-2:4236     0 AMB  20-1:4236   2.60    (#   4236:20  Double Ambig)
 &rst
  ixpk= 4236, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2617,2618,2619,2621,2622,2623,2554,2555,2556,2558,
      2559,2560,2570,2571,2572,2574,2575,2576,
 igr2=2612,2613,2612,2613,2612,2613,
 &end
#
#    0 AMB  20-2:4237   158 LEU  HB-         2.60    (#   4237:20  Single Ambig)
 &rst
  ixpk= 4237, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2617,2618,2619,2621,2622,2623,2570,2571,2572,2574,
      2575,2576,
 igr2=2612,2613,
 &end
#
#    0 AMB  20-2:4238   158 LEU  HG          2.60    (#   4238:20  Single Ambig)
 &rst
  ixpk= 4238, nxpk= 20, iat=  -1,2615, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2617,2618,2619,2621,2622,2623,2570,2571,2572,2574,
      2575,2576,
 &end
#
#    0 AMB  20-2:4239   158 LEU  HG          3.50    (#   4239:20  Single Ambig)
 &rst
  ixpk= 4239, nxpk= 20, iat=  -1,2615, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2570,2571,2572,2574,2575,2576,1073,1074,1075,1077,
      1078,1079,
 &end
#
#  158 LEU  HB-         158 LEU  HG          2.60    (#   4240:20  Unique         2.37, 2.71 A)
 &rst
  ixpk= 4240, nxpk= 20, iat=  -1,2615, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2612,2613,
 &end
#
#  155 VAL  HA          158 LEU  HG          4.40    (#   4241:20  Unique         3.51, 3.86 A)
 &rst
  ixpk= 4241, nxpk= 20, iat=2566,2615, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  158 LEU  HA          158 LEU  HG          3.50    (#   4242:20  Unique         3.42, 3.50 A)
 &rst
  ixpk= 4242, nxpk= 20, iat=2610,2615, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:4243   158 LEU  HG          4.40    (#   4243:20  Single Ambig)
 &rst
  ixpk= 4243, nxpk= 20, iat=  -1,2615, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2608, 282,
 &end
#
#  159 GLN  HN          158 LEU  HG          5.50    (#   4244:20  Unique         2.48, 2.56 A)
 &rst
  ixpk= 4244, nxpk= 20, iat=2627,2615, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:4245   158 LEU  MDX         5.50    (#   4245:20  Single Ambig)
 &rst
  ixpk= 4245, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1703, 323,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#   20 GLY  HN          158 LEU  MDX         5.50    (#   4246:20  Unique         2.85, 4.98 A)
 &rst
  ixpk= 4246, nxpk= 20, iat= 299,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4247   158 LEU  MDX         3.50    (#   4247:20  Single Ambig)
 &rst
  ixpk= 4247, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 282,2608,2548,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4248   158 LEU  MDX         4.40    (#   4248:20  Single Ambig)
 &rst
  ixpk= 4248, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2627,2668,2669,2597,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  103 GLN  HE2+        158 LEU  MDX         4.40    (#   4249:20  Unique         1.93, 3.51 A)
 &rst
  ixpk= 4249, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1715,1716,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  103 GLN  HE2-        158 LEU  MDX         4.40    (#   4250:20  Unique         1.93, 3.51 A)
 &rst
  ixpk= 4250, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1715,1716,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  103 GLN  HA          158 LEU  MDX         5.50    (#   4251:20  Unique         4.26, 6.04 A)
 &rst
  ixpk= 4251, nxpk= 20, iat=1705,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  158 LEU  HA          158 LEU  MDX         3.50    (#   4253:20  Unique         2.10, 3.92 A)
 &rst
  ixpk= 4253, nxpk= 20, iat=2610,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#   18 ARG  HA          158 LEU  MDX         3.50    (#   4254:20  Unique         2.07, 3.59 A)
 &rst
  ixpk= 4254, nxpk= 20, iat= 260,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  155 VAL  HA          158 LEU  MDX         3.50    (#   4255:20  Unique         2.66, 4.52 A)
 &rst
  ixpk= 4255, nxpk= 20, iat=2566,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#   18 ARG  HD+         158 LEU  MDX         5.50    (#   4256:20  Unique         1.96, 5.45 A)
 &rst
  ixpk= 4256, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 268, 269,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4257   158 LEU  MDX         3.50    (#   4257:20  Single Ambig)
 &rst
  ixpk= 4257, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1710,1711,2631,2632,2691,2692,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4258   158 LEU  MDX         2.60    (#   4258:20  Single Ambig)
 &rst
  ixpk= 4258, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2612,2613,2615,1707,1708,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  158 LEU  HB-         158 LEU  MDX         2.60    (#   4259:20  Unique         2.20, 3.30 A)
 &rst
  ixpk= 4259, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2612,2613,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  158 LEU  HB-         158 LEU  MDY         2.60    (#   4263:20  Unique         2.20, 3.30 A)
 &rst
  ixpk= 4263, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2612,2613,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4264   158 LEU  MDY         2.60    (#   4264:20  Single Ambig)
 &rst
  ixpk= 4264, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2612,2613,2615,1707,1708,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4265   158 LEU  MDY         3.50    (#   4265:20  Single Ambig)
 &rst
  ixpk= 4265, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1710,1711,2631,2632,2691,2692,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4266   158 LEU  MDY         5.50    (#   4266:20  Single Ambig)
 &rst
  ixpk= 4266, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2634,2635,2634,2635,2651,2652,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#   18 ARG  HD+         158 LEU  MDY         4.40    (#   4267:20  Unique         1.96, 5.45 A)
 &rst
  ixpk= 4267, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 268, 269,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  155 VAL  HA          158 LEU  MDY         3.50    (#   4268:20  Unique         2.66, 4.52 A)
 &rst
  ixpk= 4268, nxpk= 20, iat=2566,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  158 LEU  HA          158 LEU  MDY         2.60    (#   4269:20  Unique         2.10, 3.92 A)
 &rst
  ixpk= 4269, nxpk= 20, iat=2610,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#   18 ARG  HA          158 LEU  MDY         3.50    (#   4270:20  Unique         2.07, 3.59 A)
 &rst
  ixpk= 4270, nxpk= 20, iat= 260,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4271   158 LEU  MDY         4.40    (#   4271:20  Single Ambig)
 &rst
  ixpk= 4271, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2697, 284,1066,1741,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  103 GLN  HE2-        158 LEU  MDY         3.50    (#   4273:20  Unique         1.93, 3.51 A)
 &rst
  ixpk= 4273, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1715,1716,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  103 GLN  HE2+        158 LEU  MDY         4.40    (#   4274:20  Unique         1.93, 3.51 A)
 &rst
  ixpk= 4274, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1715,1716,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4275   158 LEU  MDY         3.50    (#   4275:20  Single Ambig)
 &rst
  ixpk= 4275, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 282,2608,2548,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4276   158 LEU  MDY         3.50    (#   4276:20  Single Ambig)
 &rst
  ixpk= 4276, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2627,2668,2669,2597,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4277   158 LEU  MDY         5.50    (#   4277:20  Single Ambig)
 &rst
  ixpk= 4277, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 258,2644,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4279     0 AMB  20-1:4279   5.50    (#   4279:20  Double Ambig)
 &rst
  ixpk= 4279, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.07, r4= 8.82,
 igr1= 271, 294, 295,2639,2640,
 igr2=2629,2610,
 &end
#
#  151 PHE  HD          148 MET  HA          5.50    (#   4280:20  Unique         2.28, 4.15 A)
 &rst
  ixpk= 4280, nxpk= 20, iat=  -1,2455, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#    0 AMB  20-2:4281     0 AMB  20-1:4281   5.50    (#   4281:20  Double Ambig)
 &rst
  ixpk= 4281, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 294, 295,2639,2640,
 igr2=2629,2646,
 &end
#
#    0 AMB  20-2:4282     0 AMB  20-1:4282   2.60    (#   4282:20  Double Ambig)
 &rst
  ixpk= 4282, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2631,2632,2648,2649,
 igr2=2629,2646,
 &end
#
#  158 LEU  MDY         158 LEU  HA          2.60    (#   4283:20  Unique         2.10, 3.92 A)
 &rst
  ixpk= 4283, nxpk= 20, iat=  -1,2610, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4284     0 AMB  20-1:4284   2.60    (#   4284:20  Double Ambig)
 &rst
  ixpk= 4284, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2634,2635,2634,2635,
 igr2=2631,2632,2631,2632,
 &end
#
#    0 AMB  20-2:4285   159 GLN  HB-         2.60    (#   4285:20  Single Ambig)
 &rst
  ixpk= 4285, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=2634,2635,2634,2635,
 igr2=2631,2632,
 &end
#
#  159 GLN  HA          159 GLN  HB-         2.60    (#   4286:20  Unique         2.29, 2.46 A)
 &rst
  ixpk= 4286, nxpk= 20, iat=2629,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2631,2632,
 &end
#
#   19 GLN  HA          159 GLN  HB+         4.40    (#   4287:20  Unique         2.14, 3.18 A)
 &rst
  ixpk= 4287, nxpk= 20, iat= 284,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2631,2632,
 &end
#
#    0 AMB  20-2:4289     0 AMB  20-1:4289   4.40    (#   4289:20  Double Ambig)
 &rst
  ixpk= 4289, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=2639,2640, 294, 295,
 igr2=2631,2632,2631,2632,
 &end
#
#  159 GLN  HN          159 GLN  HB+         3.50    (#   4290:20  Unique         2.32, 2.99 A)
 &rst
  ixpk= 4290, nxpk= 20, iat=2627,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2631,2632,
 &end
#
#  159 GLN  HN          159 GLN  HB-         3.50    (#   4291:20  Unique         2.32, 2.99 A)
 &rst
  ixpk= 4291, nxpk= 20, iat=2627,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2631,2632,
 &end
#
#    0 AMB  20-2:4292     0 AMB  20-1:4292   3.50    (#   4292:20  Double Ambig)
 &rst
  ixpk= 4292, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2644, 258,
 igr2=2631,2632,2631,2632,
 &end
#
#    0 AMB  20-2:4293   159 GLN  HB-         3.50    (#   4293:20  Single Ambig)
 &rst
  ixpk= 4293, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2644, 258,
 igr2=2631,2632,
 &end
#
#   20 GLY  HN          159 GLN  HB-         5.50    (#   4294:20  Unique         2.95, 3.65 A)
 &rst
  ixpk= 4294, nxpk= 20, iat= 299,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2631,2632,
 &end
#
#   13 ILE  HN           57 GLU  HG+         5.50    (#   4295:20  Unique         4.14, 6.06 A)
 &rst
  ixpk= 4295, nxpk= 20, iat= 179,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 886, 887,
 &end
#
#  159 GLN  HE2+        159 GLN  HG-         2.60    (#   4296:20  Unique         2.16, 3.27 A)
 &rst
  ixpk= 4296, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2639,2640,
 igr2=2634,2635,
 &end
#
#  159 GLN  HN            0 AMB  20-1:4297   2.60    (#   4297:20  Single Ambig)
 &rst
  ixpk= 4297, nxpk= 20, iat=2627,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr2=2634,2635,2634,2635,
 &end
#
#  159 GLN  HE2-          0 AMB  20-1:4298   3.50    (#   4298:20  Single Ambig)
 &rst
  ixpk= 4298, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2639,2640,
 igr2=2634,2635,2634,2635,
 &end
#
#  103 GLN  HE2-          0 AMB  20-1:4299   4.40    (#   4299:20  Single Ambig)
 &rst
  ixpk= 4299, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1715,1716,
 igr2=2634,2635,2634,2635,
 &end
#
#  160 GLU  HB-         160 GLU  HA          2.60    (#   4301:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 4301, nxpk= 20, iat=  -1,2646, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2648,2649,
 &end
#
#    0 AMB  20-2:4302   160 GLU  HA          2.60    (#   4302:20  Single Ambig)
 &rst
  ixpk= 4302, nxpk= 20, iat=  -1,2646, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2651,2652,2634,2635,
 &end
#
#   24 TRP  HN           23 MET  HA          3.50    (#   4303:20  Unique         2.14, 2.22 A)
 &rst
  ixpk= 4303, nxpk= 20, iat= 356, 341, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  161 ASN  HD2+        160 GLU  HB+         3.85    (#   4304:20  Unique         2.23, 3.83 A)
 &rst
  ixpk= 4304, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.85, r4= 5.60,
 igr1=2668,2669,
 igr2=2648,2649,
 &end
#
#    0 AMB  20-2:4305     0 AMB  20-1:4305   4.40    (#   4305:20  Double Ambig)
 &rst
  ixpk= 4305, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2711,2712, 265, 266,1945,1946,
 igr2=2648,2649,2648,2649, 868, 869,
 &end
#
#  160 GLU  HB-         160 GLU  HG+         2.60    (#   4307:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 4307, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2648,2649,
 igr2=2651,2652,
 &end
#
#  160 GLU  HB+         160 GLU  HG+         2.60    (#   4308:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 4308, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2648,2649,
 igr2=2651,2652,
 &end
#
#  160 GLU  HA          160 GLU  HG+         2.60    (#   4309:20  Unique         2.25, 2.99 A)
 &rst
  ixpk= 4309, nxpk= 20, iat=2646,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2651,2652,
 &end
#
#    0 AMB  20-2:4310     0 AMB  20-1:4310   4.40    (#   4310:20  Double Ambig)
 &rst
  ixpk= 4310, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2627,2597,
 igr2=2651,2652,2651,2652,
 &end
#
#  160 GLU  HN          160 GLU  HG+         2.60    (#   4311:20  Unique         2.22, 3.06 A)
 &rst
  ixpk= 4311, nxpk= 20, iat=2644,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2651,2652,
 &end
#
#  161 ASN  HN          160 GLU  HG+         4.40    (#   4312:20  Unique         2.27, 4.45 A)
 &rst
  ixpk= 4312, nxpk= 20, iat=2659,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2651,2652,
 &end
#
#  162 THR  MG2         161 ASN  HB-         5.50    (#   4317:20  Unique         3.87, 5.48 A)
 &rst
  ixpk= 4317, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2679,2680,2681,
 igr2=2663,2664,
 &end
#
#    0 AMB  20-2:4318   161 ASN  HB-         5.50    (#   4318:20  Single Ambig)
 &rst
  ixpk= 4318, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2648,2649,2631,2632,2584,2585,
 igr2=2663,2664,
 &end
#
#    0 AMB  20-2:4319     0 AMB  20-1:4319   5.50    (#   4319:20  Double Ambig)
 &rst
  ixpk= 4319, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2648,2649,2631,2632,2584,2585,
 igr2=2663,2664,2663,2664,2663,2664,
 &end
#
#  162 THR  HN          162 THR  HA          3.50    (#   4323:20  Unique         2.28, 2.87 A)
 &rst
  ixpk= 4323, nxpk= 20, iat=2673,2675, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  161 ASN  HN          162 THR  HA          5.50    (#   4324:20  Unique         4.61, 5.00 A)
 &rst
  ixpk= 4324, nxpk= 20, iat=2659,2675, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  162 THR  HB          162 THR  HA          2.60    (#   4325:20  Unique         2.53, 2.63 A)
 &rst
  ixpk= 4325, nxpk= 20, iat=2677,2675, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  163 PRO  HD+         162 THR  HA          2.60    (#   4326:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 4326, nxpk= 20, iat=  -1,2675, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2688,2689,
 &end
#
#  163 PRO  HD-         162 THR  HA          2.60    (#   4327:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 4327, nxpk= 20, iat=  -1,2675, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2688,2689,
 &end
#
#  161 ASN  HB-         162 THR  HA          5.50    (#   4329:20  Unique         4.37, 4.73 A)
 &rst
  ixpk= 4329, nxpk= 20, iat=  -1,2675, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2663,2664,
 &end
#
#    0 AMB  20-2:4330   162 THR  HA          4.40    (#   4330:20  Single Ambig)
 &rst
  ixpk= 4330, nxpk= 20, iat=  -1,2675, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2691,2692,2631,2632,
 &end
#
#    0 AMB  20-2:4331   162 THR  HA          5.50    (#   4331:20  Single Ambig)
 &rst
  ixpk= 4331, nxpk= 20, iat=  -1,2675, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2694,2695,2651,2652,
 &end
#
#  162 THR  MG2         162 THR  HA          3.50    (#   4332:20  Unique         2.07, 2.90 A)
 &rst
  ixpk= 4332, nxpk= 20, iat=  -1,2675, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2679,2680,2681,
 &end
#
#  162 THR  MG2         162 THR  HB          2.60    (#   4333:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 4333, nxpk= 20, iat=  -1,2677, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr1=2679,2680,2681,
 &end
#
#  163 PRO  HD-         162 THR  HB          4.40    (#   4335:20  Unique         1.89, 2.71 A)
 &rst
  ixpk= 4335, nxpk= 20, iat=  -1,2677, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2688,2689,
 &end
#
#  163 PRO  HD+         162 THR  HB          4.40    (#   4336:20  Unique         1.89, 2.71 A)
 &rst
  ixpk= 4336, nxpk= 20, iat=  -1,2677, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2688,2689,
 &end
#
#  162 THR  HA          162 THR  HB          3.50    (#   4337:20  Unique         2.53, 2.63 A)
 &rst
  ixpk= 4337, nxpk= 20, iat=2675,2677, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:4340   162 THR  HB          3.50    (#   4340:20  Single Ambig)
 &rst
  ixpk= 4340, nxpk= 20, iat=  -1,2677, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2673,2701,
 &end
#
#  162 THR  HN          162 THR  MG2         4.40    (#   4341:20  Unique         2.75, 3.94 A)
 &rst
  ixpk= 4341, nxpk= 20, iat=2673,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=2679,2680,2681,
 &end
#
#    0 AMB  20-2:4342   162 THR  MG2         4.40    (#   4342:20  Single Ambig)
 &rst
  ixpk= 4342, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2659, 299,
 igr2=2679,2680,2681,
 &end
#
#    0 AMB  20-2:4345   162 THR  MG2         5.50    (#   4345:20  Single Ambig)
 &rst
  ixpk= 4345, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=2627,2668,2669,
 igr2=2679,2680,2681,
 &end
#
#  162 THR  HA          162 THR  MG2         3.50    (#   4347:20  Unique         2.07, 2.90 A)
 &rst
  ixpk= 4347, nxpk= 20, iat=2675,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2679,2680,2681,
 &end
#
#    0 AMB  20-2:4348   162 THR  MG2         5.50    (#   4348:20  Single Ambig)
 &rst
  ixpk= 4348, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2697,1741,
 igr2=2679,2680,2681,
 &end
#
#  162 THR  HB          162 THR  MG2         2.60    (#   4349:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 4349, nxpk= 20, iat=2677,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=2679,2680,2681,
 &end
#
#  163 PRO  HD+         162 THR  MG2         4.40    (#   4350:20  Unique         2.35, 3.81 A)
 &rst
  ixpk= 4350, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2688,2689,
 igr2=2679,2680,2681,
 &end
#
#  163 PRO  HD-         162 THR  MG2         4.40    (#   4351:20  Unique         2.35, 3.81 A)
 &rst
  ixpk= 4351, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2688,2689,
 igr2=2679,2680,2681,
 &end
#
#  161 ASN  HB+         162 THR  MG2         4.40    (#   4352:20  Unique         3.87, 5.48 A)
 &rst
  ixpk= 4352, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2663,2664,
 igr2=2679,2680,2681,
 &end
#
#  163 PRO  HB-         163 PRO  HA          2.60    (#   4353:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4353, nxpk= 20, iat=  -1,2697, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2694,2695,
 &end
#
#  163 PRO  HB+         163 PRO  HA          2.60    (#   4354:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4354, nxpk= 20, iat=  -1,2697, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2694,2695,
 &end
#
#  163 PRO  HD+         163 PRO  HA          4.40    (#   4355:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 4355, nxpk= 20, iat=  -1,2697, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2688,2689,
 &end
#
#  164 LYS  HN          163 PRO  HA          2.80    (#   4358:20  Unique         2.16, 2.43 A)
 &rst
  ixpk= 4358, nxpk= 20, iat=2701,2697, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  164 LYS  HN          163 PRO  HB+         4.40    (#   4359:20  Unique         2.11, 3.42 A)
 &rst
  ixpk= 4359, nxpk= 20, iat=2701,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2694,2695,
 &end
#
#   10 ASN  HD2-          0 AMB  20-1:4360   5.50    (#   4360:20  Single Ambig)
 &rst
  ixpk= 4360, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 151, 152,
 igr2= 108, 109, 108, 109,
 &end
#
#  163 PRO  HA          163 PRO  HB+         2.60    (#   4361:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4361, nxpk= 20, iat=2697,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2694,2695,
 &end
#
#  163 PRO  HD+         163 PRO  HB+         4.40    (#   4362:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4362, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2688,2689,
 igr2=2694,2695,
 &end
#
#  163 PRO  HD+         163 PRO  HB-         4.40    (#   4363:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4363, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2688,2689,
 igr2=2694,2695,
 &end
#
#  163 PRO  HD-         163 PRO  HB+         4.40    (#   4364:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4364, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2688,2689,
 igr2=2694,2695,
 &end
#
#  163 PRO  HD-         163 PRO  HB-         3.50    (#   4365:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4365, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2688,2689,
 igr2=2694,2695,
 &end
#
#    0 AMB  20-2:4366     0 AMB  20-1:4366   5.50    (#   4366:20  Double Ambig)
 &rst
  ixpk= 4366, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.06, r4= 9.81,
 igr1=2679,2680,2681,1564,1565,
 igr2=2691,2692, 132, 133,
 &end
#
#  163 PRO  HB+         163 PRO  HG+         2.60    (#   4367:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 4367, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2694,2695,
 igr2=2691,2692,
 &end
#
#  163 PRO  HB-         163 PRO  HG+         2.60    (#   4369:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 4369, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2694,2695,
 igr2=2691,2692,
 &end
#
#  163 PRO  HD-         163 PRO  HG+         3.50    (#   4371:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4371, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2688,2689,
 igr2=2691,2692,
 &end
#
#  163 PRO  HD+         163 PRO  HG+         3.50    (#   4372:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4372, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2688,2689,
 igr2=2691,2692,
 &end
#
#  163 PRO  HA          163 PRO  HG+         4.40    (#   4373:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 4373, nxpk= 20, iat=2697,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2691,2692,
 &end
#
#  162 THR  HA          163 PRO  HG+         5.50    (#   4374:20  Unique         4.51, 4.55 A)
 &rst
  ixpk= 4374, nxpk= 20, iat=2675,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2691,2692,
 &end
#
#    0 AMB  20-2:4375     0 AMB  20-1:4375   5.50    (#   4375:20  Double Ambig)
 &rst
  ixpk= 4375, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2675,  85,
 igr2=2691,2692, 132, 133,
 &end
#
#  162 THR  MG2         163 PRO  HD+         4.40    (#   4377:20  Unique         2.35, 3.81 A)
 &rst
  ixpk= 4377, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2679,2680,2681,
 igr2=2688,2689,
 &end
#
#  162 THR  MG2         163 PRO  HD-         4.40    (#   4378:20  Unique         2.35, 3.81 A)
 &rst
  ixpk= 4378, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2679,2680,2681,
 igr2=2688,2689,
 &end
#
#  163 PRO  HG+         163 PRO  HD+         2.60    (#   4379:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4379, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2691,2692,
 igr2=2688,2689,
 &end
#
#    0 AMB  20-2:4380   163 PRO  HD-         2.60    (#   4380:20  Single Ambig)
 &rst
  ixpk= 4380, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2691,2692, 262, 263,2694,2695,
 igr2=2688,2689,
 &end
#
#    0 AMB  20-2:4381     0 AMB  20-1:4381   2.60    (#   4381:20  Double Ambig)
 &rst
  ixpk= 4381, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2691,2692, 262, 263,
 igr2=2688,2689,2688,2689,
 &end
#
#  163 PRO  HG+         163 PRO  HD-         2.60    (#   4382:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4382, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2691,2692,
 igr2=2688,2689,
 &end
#
#  163 PRO  HB+         163 PRO  HD+         3.50    (#   4383:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4383, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2694,2695,
 igr2=2688,2689,
 &end
#
#  163 PRO  HB+         163 PRO  HD-         4.40    (#   4384:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4384, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2694,2695,
 igr2=2688,2689,
 &end
#
#    0 AMB  20-2:4387   163 PRO  HD-         4.40    (#   4387:20  Single Ambig)
 &rst
  ixpk= 4387, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2610,2629,
 igr2=2688,2689,
 &end
#
#  162 THR  HB          163 PRO  HD+         4.40    (#   4388:20  Unique         1.89, 2.71 A)
 &rst
  ixpk= 4388, nxpk= 20, iat=2677,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2688,2689,
 &end
#
#    0 AMB  20-2:4389     0 AMB  20-1:4389   4.40    (#   4389:20  Double Ambig)
 &rst
  ixpk= 4389, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2610,2629,
 igr2=2688,2689,2688,2689,
 &end
#
#  162 THR  HB          163 PRO  HD-         4.40    (#   4390:20  Unique         1.89, 2.71 A)
 &rst
  ixpk= 4390, nxpk= 20, iat=2677,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2688,2689,
 &end
#
#  163 PRO  HA          163 PRO  HD-         4.40    (#   4393:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 4393, nxpk= 20, iat=2697,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2688,2689,
 &end
#
#  163 PRO  HA          163 PRO  HD+         4.40    (#   4394:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 4394, nxpk= 20, iat=2697,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2688,2689,
 &end
#
#  162 THR  HA          163 PRO  HD+         2.60    (#   4395:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 4395, nxpk= 20, iat=2675,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2688,2689,
 &end
#
#  162 THR  HA          163 PRO  HD-         2.60    (#   4396:20  Unique         2.32, 2.40 A)
 &rst
  ixpk= 4396, nxpk= 20, iat=2675,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2688,2689,
 &end
#
#    0 AMB  20-2:4397   163 PRO  HD-         5.50    (#   4397:20  Single Ambig)
 &rst
  ixpk= 4397, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2673,2701,
 igr2=2688,2689,
 &end
#
#  164 LYS  HN          164 LYS  HA          3.50    (#   4398:20  Unique         2.77, 2.87 A)
 &rst
  ixpk= 4398, nxpk= 20, iat=2701,2703, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  163 PRO  HD+         164 LYS  HA          5.52    (#   4399:20  Unique         5.61, 6.30 A)
 &rst
  ixpk= 4399, nxpk= 20, iat=  -1,2703, r1= 0.00, r2= 1.80, r3= 6.20, r4= 6.95,
 igr1=2688,2689,
 &end
#
#  164 LYS  HG+         164 LYS  HA          4.40    (#   4401:20  Unique         2.18, 3.62 A)
 &rst
  ixpk= 4401, nxpk= 20, iat=  -1,2703, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2708,2709,
 &end
#
#  164 LYS  HB-         164 LYS  HA          3.50    (#   4402:20  Unique         2.31, 2.57 A)
 &rst
  ixpk= 4402, nxpk= 20, iat=  -1,2703, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2705,2706,
 &end
#
#  164 LYS  HB+         164 LYS  HA          2.60    (#   4403:20  Unique         2.31, 2.57 A)
 &rst
  ixpk= 4403, nxpk= 20, iat=  -1,2703, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=2705,2706,
 &end
#
#  164 LYS  HA          164 LYS  HB-         5.50    (#   4404:20  Unique         2.31, 2.57 A)
 &rst
  ixpk= 4404, nxpk= 20, iat=2703,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2705,2706,
 &end
#
#  164 LYS  HN          164 LYS  HB+         5.50    (#   4405:20  Unique         2.23, 3.18 A)
 &rst
  ixpk= 4405, nxpk= 20, iat=2701,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2705,2706,
 &end
#
#  164 LYS  HB+         164 LYS  HG+         2.60    (#   4406:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 4406, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2705,2706,
 igr2=2708,2709,
 &end
#
#  164 LYS  HA          164 LYS  HD+         3.50    (#   4407:20  Unique         2.01, 3.93 A)
 &rst
  ixpk= 4407, nxpk= 20, iat=2703,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2711,2712,
 &end
#
#    0 AMB  20-2:4408     0 AMB  20-1:4408   4.40    (#   4408:20  Double Ambig)
 &rst
  ixpk= 4408, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1456,2675,
 igr2=1464,1465,2711,2712,
 &end
#
#   90 PRO  HA           89 LYS  HD+         4.40    (#   4409:20  Unique         4.29, 6.09 A)
 &rst
  ixpk= 4409, nxpk= 20, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1464,1465,
 &end
#
#    0 AMB  20-2:4411     0 AMB  20-1:4411   5.50    (#   4411:20  Double Ambig)
 &rst
  ixpk= 4411, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2697,1442,
 igr2=2711,2712,1464,1465,
 &end
#
#    0 AMB  20-2:4412     0 AMB  20-1:4412   5.50    (#   4412:20  Double Ambig)
 &rst
  ixpk= 4412, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=1483,1484,2634,2635,2651,2652,
 igr2=1464,1465,2711,2712,2711,2712,
 &end
#
#  129 TYR  HB+         129 TYR  HA          4.40    (#   4413:20  Unique         2.33, 2.51 A)
 &rst
  ixpk= 4413, nxpk= 20, iat=  -1,2096, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2098,2099,
 &end
#
#  129 TYR  HD          129 TYR  HA          4.40    (#   4414:20  Unique         2.91, 4.07 A)
 &rst
  ixpk= 4414, nxpk= 20, iat=  -1,2096, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2102,2111,
 &end
#
#  138 SER  HN          138 SER  HB-         3.50    (#   4416:20  Unique         2.09, 2.83 A)
 &rst
  ixpk= 4416, nxpk= 20, iat=2263,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2267,2268,
 &end
#
#    0 AMB  20-2:4418     0 AMB  20-1:4418   4.40    (#   4418:20  Double Ambig)
 &rst
  ixpk= 4418, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2274,2115,
 igr2=2267,2268,2141,
 &end
#
#    0 AMB  20-2:4419     0 AMB  20-1:4419   4.40    (#   4419:20  Double Ambig)
 &rst
  ixpk= 4419, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1=2253,2254,2255,2257,2258,2259,2073,2074,2075,2077,
      2078,2079,
 igr2=2267,2268,2141,
 &end
#
#   94 GLY  HN           93 ILE  HA          5.50    (#   4422:20  Unique         3.03, 3.10 A)
 &rst
  ixpk= 4422, nxpk= 20, iat=1536,1519, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  118 THR  HN          119 PRO  HD-         5.50    (#   4431:20  Unique         4.25, 4.50 A)
 &rst
  ixpk= 4431, nxpk= 20, iat=1913,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1928,1929,
 &end
#
#  118 THR  HN          119 PRO  HD+         5.50    (#   4432:20  Unique         4.25, 4.50 A)
 &rst
  ixpk= 4432, nxpk= 20, iat=1913,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1928,1929,
 &end
#
#  118 THR  HA          119 PRO  HD-         2.60    (#   4433:20  Unique         1.92, 2.17 A)
 &rst
  ixpk= 4433, nxpk= 20, iat=1915,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1928,1929,
 &end
#
#  118 THR  HA          119 PRO  HD+         2.60    (#   4434:20  Unique         1.92, 2.17 A)
 &rst
  ixpk= 4434, nxpk= 20, iat=1915,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1928,1929,
 &end
#
#  118 THR  HB          119 PRO  HD-         5.50    (#   4437:20  Unique         3.44, 4.11 A)
 &rst
  ixpk= 4437, nxpk= 20, iat=1917,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1928,1929,
 &end
#
#  118 THR  HB          119 PRO  HD+         4.40    (#   4438:20  Unique         3.44, 4.11 A)
 &rst
  ixpk= 4438, nxpk= 20, iat=1917,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1928,1929,
 &end
#
#  119 PRO  HG+         119 PRO  HD-         3.50    (#   4439:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4439, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1931,1932,
 igr2=1928,1929,
 &end
#
#  119 PRO  HG+         119 PRO  HD+         2.60    (#   4440:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4440, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1931,1932,
 igr2=1928,1929,
 &end
#
#  119 PRO  HG-         119 PRO  HD+         3.50    (#   4441:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4441, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1931,1932,
 igr2=1928,1929,
 &end
#
#  119 PRO  HG-         119 PRO  HD-         3.50    (#   4442:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4442, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1931,1932,
 igr2=1928,1929,
 &end
#
#  118 THR  MG2         119 PRO  HD-         4.40    (#   4443:20  Unique         3.16, 4.64 A)
 &rst
  ixpk= 4443, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1919,1920,1921,
 igr2=1928,1929,
 &end
#
#  118 THR  MG2         119 PRO  HD+         3.50    (#   4444:20  Unique         3.16, 4.64 A)
 &rst
  ixpk= 4444, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1919,1920,1921,
 igr2=1928,1929,
 &end
#
#  119 PRO  HB-         119 PRO  HD+         4.40    (#   4445:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4445, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1934,1935,
 igr2=1928,1929,
 &end
#
#  119 PRO  HB-         119 PRO  HD-         5.50    (#   4446:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4446, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1934,1935,
 igr2=1928,1929,
 &end
#
#   79 LEU  HA           80 PRO  HD+         3.50    (#   4448:20  Unique         2.25, 2.29 A)
 &rst
  ixpk= 4448, nxpk= 20, iat=1268,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1286,1287,
 &end
#
#    0 AMB  20-2:4450     0 AMB  20-1:4450   2.60    (#   4450:20  Double Ambig)
 &rst
  ixpk= 4450, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1286,1287,1286,1287,
 &end
#
#   80 PRO  HG-          80 PRO  HD+         3.50    (#   4451:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4451, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1289,1290,
 igr2=1286,1287,
 &end
#
#   79 LEU  HA           80 PRO  HD-         3.50    (#   4453:20  Unique         2.25, 2.29 A)
 &rst
  ixpk= 4453, nxpk= 20, iat=1268,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1286,1287,
 &end
#
#   80 PRO  HG-          80 PRO  HD-         2.60    (#   4455:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4455, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1289,1290,
 igr2=1286,1287,
 &end
#
#    0 AMB  20-2:4456    80 PRO  HD-         2.60    (#   4456:20  Single Ambig)
 &rst
  ixpk= 4456, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 igr2=1286,1287,
 &end
#
#   55 PHE  HA           59 GLY  HA-         5.50    (#   4457:20  Unique         1.86, 2.84 A)
 &rst
  ixpk= 4457, nxpk= 20, iat= 846,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 912, 913,
 &end
#
#    0 AMB  20-2:4458    59 GLY  HA-         5.50    (#   4458:20  Single Ambig)
 &rst
  ixpk= 4458, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 854, 858, 894,
 igr2= 912, 913,
 &end
#
#    0 AMB  20-2:4459     0 AMB  20-1:4459   5.50    (#   4459:20  Double Ambig)
 &rst
  ixpk= 4459, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 854, 858, 894,
 igr2= 912, 913, 912, 913,
 &end
#
#    0 AMB  20-2:4464   102 LEU  HB-         5.50    (#   4464:20  Single Ambig)
 &rst
  ixpk= 4464, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1009, 202,
 igr2=1688,1689,
 &end
#
#    0 AMB  20-2:4468     0 AMB  20-1:4468   4.40    (#   4468:20  Double Ambig)
 &rst
  ixpk= 4468, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1408,1409,2566,
 igr2=1390,1391, 268, 269,
 &end
#
#    0 AMB  20-2:4469     8 ARG  HD-         4.40    (#   4469:20  Single Ambig)
 &rst
  ixpk= 4469, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1510,1511,  11,  12,
 igr2= 114, 115,
 &end
#
#   41 ASN  HD2-         52 ARG  HD+         5.50    (#   4474:20  Unique         2.13, 4.69 A)
 &rst
  ixpk= 4474, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 796, 797,
 &end
#
#   56 GLU  HG+          52 ARG  HD+         4.40    (#   4476:20  Unique         3.73, 5.72 A)
 &rst
  ixpk= 4476, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 871, 872,
 igr2= 796, 797,
 &end
#
#   41 ASN  HB+          52 ARG  HD+         4.40    (#   4477:20  Unique         3.23, 5.35 A)
 &rst
  ixpk= 4477, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 639, 640,
 igr2= 796, 797,
 &end
#
#    0 AMB  20-2:4478     0 AMB  20-1:4478   3.50    (#   4478:20  Double Ambig)
 &rst
  ixpk= 4478, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 871, 872, 725, 726,
 igr2= 796, 797, 796, 797,
 &end
#
#    0 AMB  20-2:4480     0 AMB  20-1:4480   2.60    (#   4480:20  Double Ambig)
 &rst
  ixpk= 4480, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2708,2709,2304,2305,1461,1462,
 igr2=2714,2715,2307,2308,1467,1468,
 &end
#
#   89 LYS  HD+          89 LYS  HE+         2.60    (#   4481:20  Unique         2.23, 2.70 A)
 &rst
  ixpk= 4481, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1464,1465,
 igr2=1467,1468,
 &end
#
#    0 AMB  20-2:4482     0 AMB  20-1:4482   2.60    (#   4482:20  Double Ambig)
 &rst
  ixpk= 4482, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 975, 976,1494,1480,1481,
 igr2= 984, 985,1467,1468,1467,1468,
 &end
#
#  141 ARG  HN          140 LYS  HE-         4.40    (#   4485:20  Unique         4.91, 5.92 A)
 &rst
  ixpk= 4485, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2307,2308,
 &end
#
#  140 LYS  HD-         140 LYS  HE-         3.50    (#   4486:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4486, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2304,2305,
 igr2=2307,2308,
 &end
#
#  140 LYS  HD+         140 LYS  HE-         3.50    (#   4487:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4487, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2304,2305,
 igr2=2307,2308,
 &end
#
#  140 LYS  HG+         140 LYS  HE-         2.60    (#   4488:20  Unique         1.95, 3.27 A)
 &rst
  ixpk= 4488, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2301,2302,
 igr2=2307,2308,
 &end
#
#    0 AMB  20-2:4489   140 LYS  HE-         5.50    (#   4489:20  Single Ambig)
 &rst
  ixpk= 4489, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=2301,2302,2253,2254,2255,2257,2258,2259,
 igr2=2307,2308,
 &end
#
#  141 ARG  HN          140 LYS  HE-         4.40    (#   4490:20  Unique         4.91, 5.92 A)
 &rst
  ixpk= 4490, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2307,2308,
 &end
#
#  140 LYS  HD-         140 LYS  HE-         4.40    (#   4491:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4491, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2304,2305,
 igr2=2307,2308,
 &end
#
#   41 ASN  HD2-         52 ARG  HD+         5.50    (#   4493:20  Unique         2.13, 4.69 A)
 &rst
  ixpk= 4493, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 796, 797,
 &end
#
#   28 PHE  HA          122 ASP  HB+         5.50    (#   4497:20  Unique         7.01, 9.30 A)
 &rst
  ixpk= 4497, nxpk= 20, iat= 440,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1980,1981,
 &end
#
#   52 ARG  HE           52 ARG  HD-         3.50    (#   4499:20  Unique         2.28, 2.66 A)
 &rst
  ixpk= 4499, nxpk= 20, iat= 799,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 796, 797,
 &end
#
#   52 ARG  HG-          52 ARG  HD-         3.50    (#   4501:20  Unique         2.22, 2.60 A)
 &rst
  ixpk= 4501, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 793, 794,
 igr2= 796, 797,
 &end
#
#   98 LYS  HE-          96 LYS  HE+         4.40    (#   4504:20  Unique         2.20, 8.20 A)
 &rst
  ixpk= 4504, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1612,1613,
 igr2=1573,1574,
 &end
#
#    0 AMB  20-2:4505     0 AMB  20-1:4505   3.50    (#   4505:20  Double Ambig)
 &rst
  ixpk= 4505, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1570,1571,1206,1207,
 igr2=1573,1574,1573,1574,
 &end
#
#   23 MET  HB+          15 ILE  HB          5.50    (#   4508:20  Unique         1.96, 3.01 A)
 &rst
  ixpk= 4508, nxpk= 20, iat=  -1, 218, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 343, 344,
 &end
#
#   48 GLN  HA           51 TYR  HB-         5.50    (#   4512:20  Unique         2.74, 3.70 A)
 &rst
  ixpk= 4512, nxpk= 20, iat= 723,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 769, 770,
 &end
#
#   51 TYR  HD           51 TYR  HB-         5.50    (#   4513:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 4513, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782,
 igr2= 769, 770,
 &end
#
#    0 AMB  20-2:4514     0 AMB  20-1:4514   5.50    (#   4514:20  Double Ambig)
 &rst
  ixpk= 4514, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1160,1161,  87,  88,
 igr2=1564,1565,1564,1565,
 &end
#
#   98 LYS  HN           11 VAL  HB          5.50    (#   4515:20  Unique         4.89, 5.21 A)
 &rst
  ixpk= 4515, nxpk= 20, iat=1599, 160, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  107 GLY  HN          110 GLU  HG-         5.50    (#   4517:20  Unique         2.58, 3.81 A)
 &rst
  ixpk= 4517, nxpk= 20, iat=1766,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1802,1803,
 &end
#
#  110 GLU  HA          110 GLU  HG-         2.60    (#   4518:20  Unique         2.58, 3.27 A)
 &rst
  ixpk= 4518, nxpk= 20, iat=1797,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1802,1803,
 &end
#
#  106 SER  HB-         110 GLU  HG-         5.50    (#   4519:20  Unique         2.00, 2.99 A)
 &rst
  ixpk= 4519, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1759,1760,
 igr2=1802,1803,
 &end
#
#    0 AMB  20-2:4520   110 GLU  HG-         4.40    (#   4520:20  Single Ambig)
 &rst
  ixpk= 4520, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1802,1803,
 &end
#
#  109 ALA  MB          110 GLU  HG-         5.50    (#   4521:20  Unique         3.43, 5.54 A)
 &rst
  ixpk= 4521, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1789,1790,1791,
 igr2=1802,1803,
 &end
#
#  110 GLU  HB-         110 GLU  HG-         2.60    (#   4522:20  Unique         2.25, 2.58 A)
 &rst
  ixpk= 4522, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1799,1800,
 igr2=1802,1803,
 &end
#
#  110 GLU  HB+         110 GLU  HG-         2.60    (#   4523:20  Unique         2.25, 2.58 A)
 &rst
  ixpk= 4523, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1799,1800,
 igr2=1802,1803,
 &end
#
#   57 GLU  HB-          57 GLU  HG-         4.40    (#   4528:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 4528, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 883, 884,
 igr2= 886, 887,
 &end
#
#   57 GLU  HN           57 GLU  HG-         4.40    (#   4530:20  Unique         1.72, 3.01 A)
 &rst
  ixpk= 4530, nxpk= 20, iat= 879,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 886, 887,
 &end
#
#   40 ILE  QD1           9 PRO  HB-         3.50    (#   4531:20  Unique         2.00, 3.74 A)
 &rst
  ixpk= 4531, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 629, 630, 631,
 igr2= 135, 136,
 &end
#
#  133 VAL  MGY         148 MET  HG+         4.40    (#   4532:20  Unique         1.99, 4.42 A)
 &rst
  ixpk= 4532, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2180,2181,2182,2184,2185,2186,
 igr2=2460,2461,
 &end
#
#  148 MET  ME          148 MET  HG+         5.50    (#   4533:20  Unique         2.38, 3.71 A)
 &rst
  ixpk= 4533, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2464,2465,2466,
 igr2=2460,2461,
 &end
#
#  144 TYR  HB-         148 MET  HG+         4.40    (#   4535:20  Unique         3.08, 4.93 A)
 &rst
  ixpk= 4535, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2372,2373,
 igr2=2460,2461,
 &end
#
#   11 VAL  MGY           9 PRO  HB-         5.50    (#   4536:20  Unique         4.41, 6.99 A)
 &rst
  ixpk= 4536, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 135, 136,
 &end
#
#    0 AMB  20-2:4537     9 PRO  HB-         3.50    (#   4537:20  Single Ambig)
 &rst
  ixpk= 4537, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 626, 627,1567,1568,
 igr2= 135, 136,
 &end
#
#    9 PRO  HD+           9 PRO  HB-         5.50    (#   4538:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4538, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 129, 130,
 igr2= 135, 136,
 &end
#
#   62 ARG  HN           62 ARG  HB-         3.50    (#   4546:20  Unique         2.53, 3.15 A)
 &rst
  ixpk= 4546, nxpk= 20, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#   11 VAL  MGY          50 MET  HB+         3.50    (#   4574:20  Unique         1.99, 4.71 A)
 &rst
  ixpk= 4574, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 752, 753,
 &end
#
#   13 ILE  HG1-         50 MET  HB+         4.40    (#   4575:20  Unique         3.64, 6.14 A)
 &rst
  ixpk= 4575, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 189, 190,
 igr2= 752, 753,
 &end
#
#    0 AMB  20-2:4586     0 AMB  20-1:4586   3.50    (#   4586:20  Double Ambig)
 &rst
  ixpk= 4586, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2694,2695,2691,2692,
 igr2=2708,2709,2708,2709,
 &end
#
#    0 AMB  20-2:4587     0 AMB  20-1:4587   5.50    (#   4587:20  Double Ambig)
 &rst
  ixpk= 4587, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2697,1442,
 igr2=2708,2709,1461,1462,
 &end
#
#  101 LEU  MDY         155 VAL  MGY         2.60    (#   4589:20  Unique         3.02, 6.76 A)
 &rst
  ixpk= 4589, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#   91 VAL  MGY          89 LYS  HG-         5.50    (#   4590:20  Unique         5.25, 6.41 A)
 &rst
  ixpk= 4590, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1496,1497,1498,1500,1501,1502,
 igr2=1461,1462,
 &end
#
#    0 AMB  20-2:4591    89 LYS  HG-         5.50    (#   4591:20  Single Ambig)
 &rst
  ixpk= 4591, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1442,1406,
 igr2=1461,1462,
 &end
#
#  145 ARG  HN            0 AMB  20-1:4592   5.50    (#   4592:20  Single Ambig)
 &rst
  ixpk= 4592, nxpk= 20, iat=2389,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr2=2180,2181,2182,2184,2185,2186,2358,2359,2360,2362,
      2363,2364,
 &end
#
#  145 ARG  HN          143 VAL  MGY         5.50    (#   4593:20  Unique         4.13, 5.54 A)
 &rst
  ixpk= 4593, nxpk= 20, iat=2389,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  145 ARG  HA          133 VAL  MGY         3.50    (#   4594:20  Unique         1.99, 3.72 A)
 &rst
  ixpk= 4594, nxpk= 20, iat=2391,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#  148 MET  HG+         133 VAL  MGY         4.40    (#   4595:20  Unique         1.99, 4.42 A)
 &rst
  ixpk= 4595, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2460,2461,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:4597    60 LEU  MDY         5.50    (#   4597:20  Single Ambig)
 &rst
  ixpk= 4597, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1775, 846,
 igr2= 926, 927, 928, 930, 931, 932,
 &end
#
#  111 ILE  QG2          58 VAL  MGX         4.40    (#   4600:20  Unique         1.99, 5.01 A)
 &rst
  ixpk= 4600, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1816,1817,1818,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:4602   155 VAL  MGX         4.40    (#   4602:20  Single Ambig)
 &rst
  ixpk= 4602, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=2587,2588, 237, 238,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:4603   136 VAL  MGY         2.60    (#   4603:20  Single Ambig)
 &rst
  ixpk= 4603, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=2378,2383,2174,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  135 GLN  HN          136 VAL  MGY         4.40    (#   4604:20  Unique         3.31, 5.30 A)
 &rst
  ixpk= 4604, nxpk= 20, iat=2214,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#  144 TYR  HD          136 VAL  MGY         3.50    (#   4605:20  Unique         1.98, 4.84 A)
 &rst
  ixpk= 4605, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2376,2385,
 igr2=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  20-2:4609    88 THR  MG2         5.50    (#   4609:20  Single Ambig)
 &rst
  ixpk= 4609, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.64, r4= 9.39,
 igr1=1477,1478,1408,1409,1366,
 igr2=1446,1447,1448,
 &end
#
#   85 ARG  HB+          88 THR  MG2         2.60    (#   4611:20  Unique         1.96, 3.19 A)
 &rst
  ixpk= 4611, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1384,1385,
 igr2=1446,1447,1448,
 &end
#
#   85 ARG  HB-          88 THR  MG2         2.60    (#   4612:20  Unique         1.96, 3.19 A)
 &rst
  ixpk= 4612, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1384,1385,
 igr2=1446,1447,1448,
 &end
#
#  111 ILE  QD1         113 MET  ME          5.50    (#   4616:20  Unique         2.82, 5.20 A)
 &rst
  ixpk= 4616, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=1823,1824,1825,
 igr2=1854,1855,1856,
 &end
#
#  111 ILE  QG2         113 MET  ME          2.60    (#   4617:20  Unique         2.00, 3.44 A)
 &rst
  ixpk= 4617, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1=1816,1817,1818,
 igr2=1854,1855,1856,
 &end
#
#   25 ALA  MB          113 MET  ME          3.50    (#   4618:20  Unique         2.00, 3.72 A)
 &rst
  ixpk= 4618, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 384, 385, 386,
 igr2=1854,1855,1856,
 &end
#
#    0 AMB  20-2:4619   113 MET  ME          3.50    (#   4619:20  Single Ambig)
 &rst
  ixpk= 4619, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,
 igr2=1854,1855,1856,
 &end
#
#   23 MET  ME          113 MET  ME          5.50    (#   4620:20  Unique         3.63, 5.86 A)
 &rst
  ixpk= 4620, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1= 350, 351, 352,
 igr2=1854,1855,1856,
 &end
#
#    0 AMB  20-2:4621   113 MET  ME          4.40    (#   4621:20  Single Ambig)
 &rst
  ixpk= 4621, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1814, 418, 419,
 igr2=1854,1855,1856,
 &end
#
#  113 MET  HG+         113 MET  ME          2.60    (#   4622:20  Unique         2.06, 3.29 A)
 &rst
  ixpk= 4622, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=1850,1851,
 igr2=1854,1855,1856,
 &end
#
#    0 AMB  20-2:4623   113 MET  ME          5.50    (#   4623:20  Single Ambig)
 &rst
  ixpk= 4623, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1= 898, 883, 884,
 igr2=1854,1855,1856,
 &end
#
#    0 AMB  20-2:4624   113 MET  ME          3.50    (#   4624:20  Single Ambig)
 &rst
  ixpk= 4624, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1960,1961,1999,2000,
 igr2=1854,1855,1856,
 &end
#
#  124 TRP  HB-         113 MET  ME          3.50    (#   4625:20  Unique         2.83, 4.60 A)
 &rst
  ixpk= 4625, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1999,2000,
 igr2=1854,1855,1856,
 &end
#
#  121 PHE  HB+         113 MET  ME          3.50    (#   4626:20  Unique         2.14, 4.41 A)
 &rst
  ixpk= 4626, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1960,1961,
 igr2=1854,1855,1856,
 &end
#
#   58 VAL  HA          113 MET  ME          3.50    (#   4627:20  Unique         2.05, 3.38 A)
 &rst
  ixpk= 4627, nxpk= 20, iat= 896,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1854,1855,1856,
 &end
#
#   25 ALA  HA          113 MET  ME          5.50    (#   4628:20  Unique         4.16, 5.68 A)
 &rst
  ixpk= 4628, nxpk= 20, iat= 382,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1854,1855,1856,
 &end
#
#  124 TRP  HA          113 MET  ME          5.50    (#   4630:20  Unique         3.01, 5.31 A)
 &rst
  ixpk= 4630, nxpk= 20, iat=1997,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1854,1855,1856,
 &end
#
#  121 PHE  HE          113 MET  ME          3.50    (#   4632:20  Unique         2.40, 5.25 A)
 &rst
  ixpk= 4632, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1966,1970,
 igr2=1854,1855,1856,
 &end
#
#    0 AMB  20-2:4634   113 MET  ME          5.50    (#   4634:20  Single Ambig)
 &rst
  ixpk= 4634, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=1988, 910,2056,
 igr2=1854,1855,1856,
 &end
#
#    0 AMB  20-2:4635   113 MET  ME          5.50    (#   4635:20  Single Ambig)
 &rst
  ixpk= 4635, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 390, 380,
 igr2=1854,1855,1856,
 &end
#
#    0 AMB  20-2:4637   113 MET  ME          4.40    (#   4637:20  Single Ambig)
 &rst
  ixpk= 4637, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1843,1976,
 igr2=1854,1855,1856,
 &end
#
#  151 PHE  HD          148 MET  ME          5.50    (#   4640:20  Unique         2.42, 5.68 A)
 &rst
  ixpk= 4640, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2515,2523,
 igr2=2464,2465,2466,
 &end
#
#   35 PHE  HD          148 MET  ME          5.50    (#   4641:20  Unique         5.33, 7.52 A)
 &rst
  ixpk= 4641, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 559, 567,
 igr2=2464,2465,2466,
 &end
#
#  148 MET  HN          148 MET  ME          4.40    (#   4643:20  Unique         4.46, 5.46 A)
 &rst
  ixpk= 4643, nxpk= 20, iat=2453,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=2464,2465,2466,
 &end
#
#  129 TYR  HD          148 MET  ME          5.50    (#   4644:20  Unique         2.02, 5.28 A)
 &rst
  ixpk= 4644, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2102,2111,
 igr2=2464,2465,2466,
 &end
#
#  148 MET  HA          148 MET  ME          3.50    (#   4645:20  Unique         2.00, 3.39 A)
 &rst
  ixpk= 4645, nxpk= 20, iat=2455,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2464,2465,2466,
 &end
#
#  129 TYR  HA          148 MET  ME          4.40    (#   4646:20  Unique         1.98, 3.18 A)
 &rst
  ixpk= 4646, nxpk= 20, iat=2096,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=2464,2465,2466,
 &end
#
#  129 TYR  HB+         148 MET  ME          5.50    (#   4647:20  Unique         2.00, 3.67 A)
 &rst
  ixpk= 4647, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2098,2099,
 igr2=2464,2465,2466,
 &end
#
#  151 PHE  HB+         148 MET  ME          5.50    (#   4648:20  Unique         2.73, 4.47 A)
 &rst
  ixpk= 4648, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2511,2512,
 igr2=2464,2465,2466,
 &end
#
#    0 AMB  20-2:4649   148 MET  ME          3.50    (#   4649:20  Single Ambig)
 &rst
  ixpk= 4649, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2098,2099,2460,2461,
 igr2=2464,2465,2466,
 &end
#
#  148 MET  HG-         148 MET  ME          3.50    (#   4650:20  Unique         2.38, 3.71 A)
 &rst
  ixpk= 4650, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2460,2461,
 igr2=2464,2465,2466,
 &end
#
#   22 VAL  MGX         148 MET  ME          2.60    (#   4652:20  Unique         1.99, 4.56 A)
 &rst
  ixpk= 4652, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2464,2465,2466,
 &end
#
#   14 VAL  MGY         148 MET  ME          2.60    (#   4653:20  Unique         2.91, 5.57 A)
 &rst
  ixpk= 4653, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=2464,2465,2466,
 &end
#
#   14 VAL  MGX         148 MET  ME          3.50    (#   4654:20  Unique         2.91, 5.57 A)
 &rst
  ixpk= 4654, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=2464,2465,2466,
 &end
#
#    0 AMB  20-2:4655   148 MET  ME          5.50    (#   4655:20  Single Ambig)
 &rst
  ixpk= 4655, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.53, r4=10.28,
 igr1=2180,2181,2182,2184,2185,2186,1672,2167,2168,
 igr2=2464,2465,2466,
 &end
#
#  147 VAL  MGX         148 MET  ME          5.50    (#   4656:20  Unique         4.03, 7.03 A)
 &rst
  ixpk= 4656, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=2464,2465,2466,
 &end
#
#   16 CYS  HN           15 ILE  QG2         3.50    (#   4657:20  Unique         2.01, 3.22 A)
 &rst
  ixpk= 4657, nxpk= 20, iat= 233,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HN           15 ILE  QG2         5.50    (#   4658:20  Unique         4.41, 4.60 A)
 &rst
  ixpk= 4658, nxpk= 20, iat= 214,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 220, 221, 222,
 &end
#
#  104 LEU  HN           15 ILE  QG2         3.50    (#   4659:20  Unique         2.39, 3.13 A)
 &rst
  ixpk= 4659, nxpk= 20, iat=1720,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 220, 221, 222,
 &end
#
#  103 GLN  HN           15 ILE  QG2         5.50    (#   4660:20  Unique         4.21, 5.59 A)
 &rst
  ixpk= 4660, nxpk= 20, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 220, 221, 222,
 &end
#
#  126 TRP  HZ2          15 ILE  QG2         5.50    (#   4661:20  Unique         4.25, 6.38 A)
 &rst
  ixpk= 4661, nxpk= 20, iat=2056,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 220, 221, 222,
 &end
#
#  103 GLN  HE2+         15 ILE  QG2         4.40    (#   4662:20  Unique         5.23, 7.62 A)
 &rst
  ixpk= 4662, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1715,1716,
 igr2= 220, 221, 222,
 &end
#
#  103 GLN  HA           15 ILE  QG2         4.40    (#   4664:20  Unique         2.38, 3.71 A)
 &rst
  ixpk= 4664, nxpk= 20, iat=1705,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HA           15 ILE  QG2         2.60    (#   4665:20  Unique         2.28, 3.02 A)
 &rst
  ixpk= 4665, nxpk= 20, iat= 216,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 220, 221, 222,
 &end
#
#  104 LEU  HB+          15 ILE  QG2         3.50    (#   4666:20  Unique         1.98, 3.52 A)
 &rst
  ixpk= 4666, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1724,1725,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HB           15 ILE  QG2         2.60    (#   4667:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4667, nxpk= 20, iat= 218,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HG1+         15 ILE  QG2         2.60    (#   4668:20  Unique         2.24, 3.45 A)
 &rst
  ixpk= 4668, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 224, 225,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HG1+         15 ILE  QG2         2.60    (#   4669:20  Unique         2.24, 3.45 A)
 &rst
  ixpk= 4669, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 224, 225,
 igr2= 220, 221, 222,
 &end
#
#    0 AMB  20-2:4670    15 ILE  QG2         2.60    (#   4670:20  Single Ambig)
 &rst
  ixpk= 4670, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.08, r4= 4.83,
 igr1=1724,1725, 350, 351, 352,
 igr2= 220, 221, 222,
 &end
#
#    0 AMB  20-2:4671    15 ILE  QG2         3.50    (#   4671:20  Single Ambig)
 &rst
  ixpk= 4671, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,1674,1675,1676,1678,1679,1680,
 igr2= 220, 221, 222,
 &end
#
#    0 AMB  20-2:4672    15 ILE  QG2         2.60    (#   4672:20  Single Ambig)
 &rst
  ixpk= 4672, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.08, r4= 4.83,
 igr1= 227, 228, 229, 224, 225,
 igr2= 220, 221, 222,
 &end
#
#  110 GLU  HG-         109 ALA  MB          5.50    (#   4673:20  Unique         3.43, 5.54 A)
 &rst
  ixpk= 4673, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1802,1803,
 igr2=1789,1790,1791,
 &end
#
#  110 GLU  HB+         109 ALA  MB          5.50    (#   4675:20  Unique         4.51, 6.23 A)
 &rst
  ixpk= 4675, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1799,1800,
 igr2=1789,1790,1791,
 &end
#
#  111 ILE  QD1          23 MET  ME          3.50    (#   4676:20  Unique         1.99, 4.66 A)
 &rst
  ixpk= 4676, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1823,1824,1825,
 igr2= 350, 351, 352,
 &end
#
#  111 ILE  QG2          23 MET  ME          3.50    (#   4677:20  Unique         2.80, 6.00 A)
 &rst
  ixpk= 4677, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1816,1817,1818,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:4678    23 MET  ME          3.50    (#   4678:20  Single Ambig)
 &rst
  ixpk= 4678, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1820,1821, 384, 385, 386,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:4679    23 MET  ME          4.40    (#   4679:20  Single Ambig)
 &rst
  ixpk= 4679, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:4680    23 MET  ME          2.60    (#   4680:20  Single Ambig)
 &rst
  ixpk= 4680, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,
 igr2= 350, 351, 352,
 &end
#
#  104 LEU  MDX          23 MET  ME          3.50    (#   4681:20  Unique         2.50, 5.60 A)
 &rst
  ixpk= 4681, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2= 350, 351, 352,
 &end
#
#  104 LEU  MDY          23 MET  ME          3.50    (#   4682:20  Unique         2.50, 5.60 A)
 &rst
  ixpk= 4682, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2= 350, 351, 352,
 &end
#
#   15 ILE  HG1+         23 MET  ME          3.50    (#   4683:20  Unique         2.22, 3.61 A)
 &rst
  ixpk= 4683, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 224, 225,
 igr2= 350, 351, 352,
 &end
#
#   15 ILE  HB           23 MET  ME          4.40    (#   4684:20  Unique         2.18, 3.50 A)
 &rst
  ixpk= 4684, nxpk= 20, iat= 218,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 350, 351, 352,
 &end
#
#  124 TRP  HB-          23 MET  ME          5.50    (#   4685:20  Unique         4.26, 6.29 A)
 &rst
  ixpk= 4685, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1999,2000,
 igr2= 350, 351, 352,
 &end
#
#  126 TRP  HZ2          23 MET  ME          5.50    (#   4689:20  Unique         2.09, 5.11 A)
 &rst
  ixpk= 4689, nxpk= 20, iat=2056,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 350, 351, 352,
 &end
#
#  126 TRP  HD1          23 MET  ME          5.50    (#   4690:20  Unique         4.46, 6.06 A)
 &rst
  ixpk= 4690, nxpk= 20, iat=2051,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 350, 351, 352,
 &end
#
#  155 VAL  MGX         156 MET  ME          3.50    (#   4694:20  Unique         2.00, 5.15 A)
 &rst
  ixpk= 4694, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2570,2571,2572,2574,2575,2576,
 igr2=2591,2592,2593,
 &end
#
#  155 VAL  MGY         156 MET  ME          3.50    (#   4695:20  Unique         2.00, 5.15 A)
 &rst
  ixpk= 4695, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2570,2571,2572,2574,2575,2576,
 igr2=2591,2592,2593,
 &end
#
#  152 ALA  HA          156 MET  ME          5.50    (#   4696:20  Unique         3.35, 4.45 A)
 &rst
  ixpk= 4696, nxpk= 20, iat=2529,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=2591,2592,2593,
 &end
#
#    0 AMB  20-2:4697   156 MET  ME          4.40    (#   4697:20  Single Ambig)
 &rst
  ixpk= 4697, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1= 301, 302,2541,2542,2601,2602,
 igr2=2591,2592,2593,
 &end
#
#  153 SER  HA          156 MET  ME          4.40    (#   4698:20  Unique         3.44, 4.89 A)
 &rst
  ixpk= 4698, nxpk= 20, iat=2539,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=2591,2592,2593,
 &end
#
#  156 MET  HA          156 MET  ME          4.40    (#   4699:20  Unique         2.72, 4.22 A)
 &rst
  ixpk= 4699, nxpk= 20, iat=2582,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=2591,2592,2593,
 &end
#
#  129 TYR  HD          156 MET  ME          4.40    (#   4700:20  Unique         4.17, 5.67 A)
 &rst
  ixpk= 4700, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2102,2111,
 igr2=2591,2592,2593,
 &end
#
#    0 AMB  20-2:4702   156 MET  ME          5.50    (#   4702:20  Single Ambig)
 &rst
  ixpk= 4702, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2597,2527,2627,2115,
 igr2=2591,2592,2593,
 &end
#
#  156 MET  HN          156 MET  ME          3.50    (#   4703:20  Unique         2.39, 4.02 A)
 &rst
  ixpk= 4703, nxpk= 20, iat=2580,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2591,2592,2593,
 &end
#
#  130 TRP  HE1         156 MET  ME          5.50    (#   4704:20  Unique         3.02, 6.17 A)
 &rst
  ixpk= 4704, nxpk= 20, iat=2125,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=2591,2592,2593,
 &end
#
#   43 GLY  HN            1 MET  ME          5.50    (#   4705:20  Unique         3.28, 5.31 A)
 &rst
  ixpk= 4705, nxpk= 20, iat= 663,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=  15,  16,  17,
 &end
#
#    3 ASP  HN            1 MET  ME          3.50    (#   4706:20  Unique         2.23, 3.55 A)
 &rst
  ixpk= 4706, nxpk= 20, iat=  40,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=  15,  16,  17,
 &end
#
#    3 ASP  HA            1 MET  ME          3.50    (#   4708:20  Unique         2.07, 3.24 A)
 &rst
  ixpk= 4708, nxpk= 20, iat=  42,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=  15,  16,  17,
 &end
#
#   42 PRO  HA            1 MET  ME          3.50    (#   4709:20  Unique         2.00, 3.35 A)
 &rst
  ixpk= 4709, nxpk= 20, iat= 659,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=  15,  16,  17,
 &end
#
#    0 AMB  20-2:4710     1 MET  ME          4.40    (#   4710:20  Single Ambig)
 &rst
  ixpk= 4710, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=   6,  23,
 igr2=  15,  16,  17,
 &end
#
#    9 PRO  HD+           1 MET  ME          4.40    (#   4711:20  Unique         1.99, 4.21 A)
 &rst
  ixpk= 4711, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 129, 130,
 igr2=  15,  16,  17,
 &end
#
#   40 ILE  QG2           1 MET  ME          5.50    (#   4712:20  Unique         4.56, 7.46 A)
 &rst
  ixpk= 4712, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1= 622, 623, 624,
 igr2=  15,  16,  17,
 &end
#
#    0 AMB  20-2:4715   156 MET  ME          5.50    (#   4715:20  Single Ambig)
 &rst
  ixpk= 4715, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2098,2099,2119,2120,
 igr2=2591,2592,2593,
 &end
#
#   50 MET  HB-          50 MET  ME          2.60    (#   4716:20  Unique         1.99, 3.49 A)
 &rst
  ixpk= 4716, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 752, 753,
 igr2= 759, 760, 761,
 &end
#
#   67 ILE  QG2          50 MET  ME          4.40    (#   4717:20  Unique         3.91, 5.69 A)
 &rst
  ixpk= 4717, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1051,1052,1053,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:4718    50 MET  ME          2.60    (#   4718:20  Single Ambig)
 &rst
  ixpk= 4718, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,
 igr1=1058,1059,1060,1693,1694,1695,1697,1698,1699,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:4719    50 MET  ME          3.50    (#   4719:20  Single Ambig)
 &rst
  ixpk= 4719, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1693,1694,1695,1697,1698,1699,1055,1056,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:4720    50 MET  ME          2.60    (#   4720:20  Single Ambig)
 &rst
  ixpk= 4720, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 752, 753, 755, 756,1055,1056,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:4721    50 MET  ME          4.40    (#   4721:20  Single Ambig)
 &rst
  ixpk= 4721, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 710, 711,1049, 160,
 igr2= 759, 760, 761,
 &end
#
#   47 GLU  HG-          50 MET  ME          2.60    (#   4722:20  Unique         2.39, 4.09 A)
 &rst
  ixpk= 4722, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 713, 714,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:4723    50 MET  ME          3.50    (#   4723:20  Single Ambig)
 &rst
  ixpk= 4723, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 713, 714, 710, 711,
 igr2= 759, 760, 761,
 &end
#
#  100 PHE  HB+          50 MET  ME          4.40    (#   4724:20  Unique         2.12, 3.74 A)
 &rst
  ixpk= 4724, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1649,1650,
 igr2= 759, 760, 761,
 &end
#
#   47 GLU  HA           50 MET  ME          3.50    (#   4725:20  Unique         2.01, 3.13 A)
 &rst
  ixpk= 4725, nxpk= 20, iat= 708,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 759, 760, 761,
 &end
#
#   50 MET  HA           50 MET  ME          5.50    (#   4726:20  Unique         4.77, 5.63 A)
 &rst
  ixpk= 4726, nxpk= 20, iat= 750,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 759, 760, 761,
 &end
#
#   51 TYR  HB+          50 MET  ME          5.50    (#   4727:20  Unique         4.75, 6.74 A)
 &rst
  ixpk= 4727, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 769, 770,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:4728    50 MET  ME          4.40    (#   4728:20  Single Ambig)
 &rst
  ixpk= 4728, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 767,1047,
 igr2= 759, 760, 761,
 &end
#
#   51 TYR  HE           50 MET  ME          3.50    (#   4729:20  Unique         2.03, 5.11 A)
 &rst
  ixpk= 4729, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 775, 780,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:4730    50 MET  ME          3.50    (#   4730:20  Single Ambig)
 &rst
  ixpk= 4730, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 773, 782,1653,1661,
 igr2= 759, 760, 761,
 &end
#
#   51 TYR  HN           50 MET  ME          3.50    (#   4731:20  Unique         3.48, 4.98 A)
 &rst
  ixpk= 4731, nxpk= 20, iat= 765,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:4732    50 MET  ME          4.40    (#   4732:20  Single Ambig)
 &rst
  ixpk= 4732, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1= 748, 786,
 igr2= 759, 760, 761,
 &end
#
#   68 LEU  HN           67 ILE  QD1         5.50    (#   4736:20  Unique         5.49, 6.20 A)
 &rst
  ixpk= 4736, nxpk= 20, iat=1064,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2=1058,1059,1060,
 &end
#
#   16 CYS  HN           15 ILE  QD1         4.40    (#   4737:20  Unique         3.75, 4.78 A)
 &rst
  ixpk= 4737, nxpk= 20, iat= 233,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 227, 228, 229,
 &end
#
#   15 ILE  HN           15 ILE  QD1         5.50    (#   4738:20  Unique         2.85, 3.92 A)
 &rst
  ixpk= 4738, nxpk= 20, iat= 214,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:4739    15 ILE  QD1         5.50    (#   4739:20  Single Ambig)
 &rst
  ixpk= 4739, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 339, 825,
 igr2= 227, 228, 229,
 &end
#
#   15 ILE  HA           15 ILE  QD1         3.50    (#   4740:20  Unique         2.01, 2.90 A)
 &rst
  ixpk= 4740, nxpk= 20, iat= 216,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 227, 228, 229,
 &end
#
#   15 ILE  HB           15 ILE  QD1         3.50    (#   4741:20  Unique         3.58, 3.92 A)
 &rst
  ixpk= 4741, nxpk= 20, iat= 218,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 227, 228, 229,
 &end
#
#  102 LEU  HG           15 ILE  QD1         4.40    (#   4742:20  Unique         1.97, 2.86 A)
 &rst
  ixpk= 4742, nxpk= 20, iat=1691,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:4743    15 ILE  QD1         5.50    (#   4743:20  Single Ambig)
 &rst
  ixpk= 4743, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1724,1725, 575, 576,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:4744    15 ILE  QD1         4.40    (#   4744:20  Single Ambig)
 &rst
  ixpk= 4744, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1009, 202, 829, 830,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:4745    15 ILE  QD1         5.50    (#   4745:20  Single Ambig)
 &rst
  ixpk= 4745, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 898, 886, 887, 327,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:4746    15 ILE  QD1         3.50    (#   4746:20  Single Ambig)
 &rst
  ixpk= 4746, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1= 350, 351, 352,1724,1725, 189, 190,
 igr2= 227, 228, 229,
 &end
#
#  104 LEU  MDY          15 ILE  QD1         3.50    (#   4747:20  Unique         3.41, 6.62 A)
 &rst
  ixpk= 4747, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:4748    15 ILE  QD1         2.60    (#   4748:20  Single Ambig)
 &rst
  ixpk= 4748, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1688,1689, 224, 225,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:4749    15 ILE  QD1         5.50    (#   4749:20  Single Ambig)
 &rst
  ixpk= 4749, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 204, 205, 206, 208, 209, 210,1820,1821,
 igr2= 227, 228, 229,
 &end
#
#  147 VAL  MGX          14 VAL  MGY         5.50    (#   4750:20  Unique         3.99, 7.22 A)
 &rst
  ixpk= 4750, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   99 TRP  HE1         147 VAL  MGY         5.50    (#   4751:20  Unique         2.45, 4.51 A)
 &rst
  ixpk= 4751, nxpk= 20, iat=1631,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  20-2:4752     0 AMB  20-1:4752   3.50    (#   4752:20  Double Ambig)
 &rst
  ixpk= 4752, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.32, r4= 8.07,
 igr1=2304,2305,2464,2465,2466,2167,2168,
 igr2=2358,2359,2360,2362,2363,2364,2180,2181,2182,2184,
      2185,2186,
 &end
#
#  133 VAL  HA          133 VAL  MGY         3.50    (#   4753:20  Unique         1.99, 3.13 A)
 &rst
  ixpk= 4753, nxpk= 20, iat=2176,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:4754     0 AMB  20-1:4754   4.40    (#   4754:20  Double Ambig)
 &rst
  ixpk= 4754, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.97, r4= 9.72,
 igr1=2372,2373,2372,2373,2326,2327,
 igr2=2180,2181,2182,2184,2185,2186,2358,2359,2360,2362,
      2363,2364,
 &end
#
#    0 AMB  20-2:4755     0 AMB  20-1:4755   5.50    (#   4755:20  Double Ambig)
 &rst
  ixpk= 4755, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.37, r4=11.12,
 igr1=2340,2453,1093,
 igr2=2358,2359,2360,2362,2363,2364,2180,2181,2182,2184,
      2185,2186,1110,1111,1112,
 &end
#
#  144 TYR  HB-           0 AMB  20-1:4756   5.50    (#   4756:20  Single Ambig)
 &rst
  ixpk= 4756, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=2372,2373,
 igr2=2180,2181,2182,2184,2185,2186,2358,2359,2360,2362,
      2363,2364,
 &end
#
#    0 AMB  20-2:4757   158 LEU  MDY         3.50    (#   4757:20  Single Ambig)
 &rst
  ixpk= 4757, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1068,1069,1724,1725,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4758   158 LEU  MDY         4.40    (#   4758:20  Single Ambig)
 &rst
  ixpk= 4758, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1028,1029,1727,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#  101 LEU  MDY         158 LEU  MDY         3.50    (#   4761:20  Unique         4.37, 7.50 A)
 &rst
  ixpk= 4761, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:4763     0 AMB  20-1:4763   5.50    (#   4763:20  Double Ambig)
 &rst
  ixpk= 4763, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2130, 852, 860,
 igr2=2477,2478, 793, 794,
 &end
#
#   54 LEU  HN           54 LEU  MDX         4.40    (#   4764:20  Unique         3.98, 5.13 A)
 &rst
  ixpk= 4764, nxpk= 20, iat= 825,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2= 834, 835, 836, 838, 839, 840,
 &end
#
#   50 MET  HG+          13 ILE  HG1+        4.40    (#   4767:20  Unique         1.96, 4.37 A)
 &rst
  ixpk= 4767, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 755, 756,
 igr2= 189, 190,
 &end
#
#   27 ARG  HN           27 ARG  HG+         5.50    (#   4768:20  Unique         2.20, 3.01 A)
 &rst
  ixpk= 4768, nxpk= 20, iat= 414,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 421, 422,
 &end
#
#    0 AMB  20-2:4770     0 AMB  20-1:4770   3.50    (#   4770:20  Double Ambig)
 &rst
  ixpk= 4770, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 424, 425,1160,1161,
 igr2= 421, 422,1206,1207,
 &end
#
#   27 ARG  HN           27 ARG  HG-         5.50    (#   4772:20  Unique         2.20, 3.01 A)
 &rst
  ixpk= 4772, nxpk= 20, iat= 414,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 421, 422,
 &end
#
#    0 AMB  20-2:4774    27 ARG  HG-         5.50    (#   4774:20  Single Ambig)
 &rst
  ixpk= 4774, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 446, 454, 559, 567,
 igr2= 421, 422,
 &end
#
#    0 AMB  20-2:4775    27 ARG  HG-         5.50    (#   4775:20  Single Ambig)
 &rst
  ixpk= 4775, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 458, 609,
 igr2= 421, 422,
 &end
#
#    0 AMB  20-2:4776     0 AMB  20-1:4776   4.40    (#   4776:20  Double Ambig)
 &rst
  ixpk= 4776, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1199,1223,
 igr2=1206,1207,1206,1207,
 &end
#
#   76 ARG  HD+          76 ARG  HG+         5.50    (#   4777:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 4777, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1209,1210,
 igr2=1206,1207,
 &end
#
#    0 AMB  20-2:4778     0 AMB  20-1:4778   5.50    (#   4778:20  Double Ambig)
 &rst
  ixpk= 4778, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=1209,1210,1550,1551,1586,1587,
 igr2=1206,1207,1206,1207,1206,1207,
 &end
#
#    0 AMB  20-2:4779     0 AMB  20-1:4779   5.50    (#   4779:20  Double Ambig)
 &rst
  ixpk= 4779, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.00, r4=11.75,
 igr1= 472, 473,1209,1210,1550,1551,1586,1587,
 igr2= 421, 422,1206,1207,1206,1207,1206,1207,
 &end
#
#   77 TYR  HN           76 ARG  HG-         5.50    (#   4781:20  Unique         2.36, 4.60 A)
 &rst
  ixpk= 4781, nxpk= 20, iat=1223,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1206,1207,
 &end
#
#  103 GLN  HN          103 GLN  HB-         5.50    (#   4796:20  Unique         2.09, 2.73 A)
 &rst
  ixpk= 4796, nxpk= 20, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1707,1708,
 &end
#
#    0 AMB  20-2:4797     0 AMB  20-1:4797   5.50    (#   4797:20  Double Ambig)
 &rst
  ixpk= 4797, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1= 900, 901, 902, 904, 905, 906, 185, 186, 187,
 igr2= 578, 579, 578, 579,
 &end
#
#   83 LEU  HN           80 PRO  HB-         5.50    (#   4800:20  Unique         3.37, 4.45 A)
 &rst
  ixpk= 4800, nxpk= 20, iat=1345,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1292,1293,
 &end
#
#    9 PRO  HG+           9 PRO  HB-         2.60    (#   4801:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 4801, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 132, 133,
 igr2= 135, 136,
 &end
#
#  147 VAL  MGX          99 TRP  HB+         5.50    (#   4802:20  Unique         1.99, 4.09 A)
 &rst
  ixpk= 4802, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=1625,1626,
 &end
#
#   99 TRP  HE3          99 TRP  HB+         5.50    (#   4803:20  Unique         2.59, 3.51 A)
 &rst
  ixpk= 4803, nxpk= 20, iat=1640,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1625,1626,
 &end
#
#    9 PRO  HA            9 PRO  HB-         5.50    (#   4804:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4804, nxpk= 20, iat= 138,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 135, 136,
 &end
#
#  148 MET  HN          148 MET  HG-         4.40    (#   4806:20  Unique         2.20, 3.04 A)
 &rst
  ixpk= 4806, nxpk= 20, iat=2453,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2460,2461,
 &end
#
#  148 MET  HN          148 MET  HG+         2.60    (#   4807:20  Unique         2.20, 3.04 A)
 &rst
  ixpk= 4807, nxpk= 20, iat=2453,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2460,2461,
 &end
#
#   10 ASN  HN            9 PRO  HB-         5.50    (#   4811:20  Unique         3.05, 3.58 A)
 &rst
  ixpk= 4811, nxpk= 20, iat= 142,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 135, 136,
 &end
#
#    0 AMB  20-2:4812     0 AMB  20-1:4812   4.40    (#   4812:20  Double Ambig)
 &rst
  ixpk= 4812, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.80, r4= 9.55,
 igr1=2417,2418,2496,2497,2420,2421,1586,1587,
 igr2=2460,2461,2460,2461,2460,2461,2460,2461,
 &end
#
#    0 AMB  20-2:4814    97 GLN  HB-         5.50    (#   4814:20  Single Ambig)
 &rst
  ixpk= 4814, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1631,1582,
 igr2=1586,1587,
 &end
#
#   17 ASN  HD2+         21 GLN  HG-         3.50    (#   4815:20  Unique         1.95, 3.97 A)
 &rst
  ixpk= 4815, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 253, 254,
 igr2= 313, 314,
 &end
#
#   21 GLN  HN           21 GLN  HG-         4.40    (#   4816:20  Unique         1.94, 3.20 A)
 &rst
  ixpk= 4816, nxpk= 20, iat= 306,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 313, 314,
 &end
#
#   22 VAL  HN           21 GLN  HG-         5.50    (#   4817:20  Unique         3.90, 4.76 A)
 &rst
  ixpk= 4817, nxpk= 20, iat= 323,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 313, 314,
 &end
#
#    0 AMB  20-2:4818     0 AMB  20-1:4818   4.40    (#   4818:20  Double Ambig)
 &rst
  ixpk= 4818, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.45, r4=10.20,
 igr1=1937,1406,2697,1442,2085,1915, 846,
 igr2=1867,1868,1483,1484,2634,2635,1483,1484,2634,2635,
      1867,1868,1867,1868,
 &end
#
#    0 AMB  20-2:4819     0 AMB  20-1:4819   2.60    (#   4819:20  Double Ambig)
 &rst
  ixpk= 4819, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 689, 690, 723,
 igr2= 728, 729, 728, 729,
 &end
#
#   48 GLN  HE2-         48 GLN  HG+         2.60    (#   4820:20  Unique         2.12, 3.26 A)
 &rst
  ixpk= 4820, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 733, 734,
 igr2= 728, 729,
 &end
#
#   48 GLN  HE2+         48 GLN  HG+         2.60    (#   4821:20  Unique         2.12, 3.26 A)
 &rst
  ixpk= 4821, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 733, 734,
 igr2= 728, 729,
 &end
#
#   48 GLN  HN           48 GLN  HG+         3.50    (#   4822:20  Unique         1.98, 2.93 A)
 &rst
  ixpk= 4822, nxpk= 20, iat= 721,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 728, 729,
 &end
#
#   45 SER  HN           48 GLN  HG+         4.40    (#   4823:20  Unique         2.55, 3.33 A)
 &rst
  ixpk= 4823, nxpk= 20, iat= 685,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 728, 729,
 &end
#
#   48 GLN  HB+          48 GLN  HG+         2.60    (#   4824:20  Unique         2.34, 2.57 A)
 &rst
  ixpk= 4824, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 725, 726,
 igr2= 728, 729,
 &end
#
#   47 GLU  HB-          48 GLN  HG+         3.50    (#   4825:20  Unique         3.35, 5.13 A)
 &rst
  ixpk= 4825, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 710, 711,
 igr2= 728, 729,
 &end
#
#  111 ILE  HN          110 GLU  HG-         5.50    (#   4826:20  Unique         4.06, 5.02 A)
 &rst
  ixpk= 4826, nxpk= 20, iat=1810,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1802,1803,
 &end
#
#  127 VAL  MGY         127 VAL  HB          3.50    (#   4827:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4827, nxpk= 20, iat=  -1,2071, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#  127 VAL  MGX         127 VAL  HB          3.50    (#   4828:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4828, nxpk= 20, iat=  -1,2071, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#   41 ASN  HD2+         41 ASN  HB-         5.50    (#   4831:20  Unique         2.12, 3.15 A)
 &rst
  ixpk= 4831, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   65 VAL  HA           65 VAL  HB          3.50    (#   4834:20  Unique         2.48, 2.63 A)
 &rst
  ixpk= 4834, nxpk= 20, iat=1007,1009, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   96 LYS  HD+           7 TYR  HB+         5.50    (#   4836:20  Unique         2.45, 5.53 A)
 &rst
  ixpk= 4836, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1570,1571,
 igr2=  87,  88,
 &end
#
#   84 VAL  MGX          93 ILE  HB          5.50    (#   4838:20  Unique         4.87, 6.13 A)
 &rst
  ixpk= 4838, nxpk= 20, iat=  -1,1521, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   86 TRP  HN           87 ASP  HB-         5.50    (#   4839:20  Unique         3.83, 4.63 A)
 &rst
  ixpk= 4839, nxpk= 20, iat=1404,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1432,1433,
 &end
#
#    0 AMB  20-2:4842     0 AMB  20-1:4842   5.50    (#   4842:20  Double Ambig)
 &rst
  ixpk= 4842, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=1883,1884,1885, 900, 901, 902, 904, 905, 906,
 igr2=1833,1834,1833,1834,
 &end
#
#   59 GLY  HA+         112 ASN  HB+         4.40    (#   4844:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 4844, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 912, 913,
 igr2=1833,1834,
 &end
#
#  112 ASN  HD2-        112 ASN  HB+         5.50    (#   4846:20  Unique         2.14, 3.30 A)
 &rst
  ixpk= 4846, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1838,1839,
 igr2=1833,1834,
 &end
#
#    5 ASP  HN            4 ASP  HB+         4.40    (#   4854:20  Unique         1.74, 3.78 A)
 &rst
  ixpk= 4854, nxpk= 20, iat=  64,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=  56,  57,
 &end
#
#   72 ARG  HN           73 ASN  HB-         5.50    (#   4859:20  Unique         4.22, 5.26 A)
 &rst
  ixpk= 4859, nxpk= 20, iat=1118,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1146,1147,
 &end
#
#    0 AMB  20-2:4860     0 AMB  20-1:4860   5.50    (#   4860:20  Double Ambig)
 &rst
  ixpk= 4860, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.06, r4= 9.81,
 igr1=  15,  16,  17,  87,  88,
 igr2=  44,  45,  44,  45,
 &end
#
#   96 LYS  HE+          98 LYS  HE-         4.40    (#   4862:20  Unique         2.20, 8.20 A)
 &rst
  ixpk= 4862, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1573,1574,
 igr2=1612,1613,
 &end
#
#   52 ARG  HE           52 ARG  HD+         5.50    (#   4865:20  Unique         2.28, 2.66 A)
 &rst
  ixpk= 4865, nxpk= 20, iat= 799,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 796, 797,
 &end
#
#   52 ARG  HB-          52 ARG  HD-         5.50    (#   4867:20  Unique         1.99, 3.24 A)
 &rst
  ixpk= 4867, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 790, 791,
 igr2= 796, 797,
 &end
#
#   52 ARG  HA           52 ARG  HD-         5.50    (#   4868:20  Unique         3.73, 4.71 A)
 &rst
  ixpk= 4868, nxpk= 20, iat= 788,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 796, 797,
 &end
#
#   87 ASP  HB+          85 ARG  HD+         5.50    (#   4869:20  Unique         3.45, 4.60 A)
 &rst
  ixpk= 4869, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1432,1433,
 igr2=1390,1391,
 &end
#
#   27 ARG  HG+          27 ARG  HD-         5.50    (#   4870:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 4870, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 421, 422,
 igr2= 424, 425,
 &end
#
#  104 LEU  HA          104 LEU  HB-         5.50    (#   4871:20  Unique         2.51, 2.80 A)
 &rst
  ixpk= 4871, nxpk= 20, iat=1722,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1724,1725,
 &end
#
#    7 TYR  HE           76 ARG  HD-         5.50    (#   4872:20  Unique         2.49, 6.13 A)
 &rst
  ixpk= 4872, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  93,  98,
 igr2=1209,1210,
 &end
#
#   99 TRP  HD1          75 LEU  HB-         5.50    (#   4877:20  Unique         3.58, 4.65 A)
 &rst
  ixpk= 4877, nxpk= 20, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1184,1185,
 &end
#
#    0 AMB  20-2:4880     0 AMB  20-1:4880   5.50    (#   4880:20  Double Ambig)
 &rst
  ixpk= 4880, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 589, 590, 589, 590,
 igr2= 174, 175, 174, 175,
 &end
#
#   77 TYR  HE           75 LEU  HB+         5.50    (#   4882:20  Unique         5.53, 8.85 A)
 &rst
  ixpk= 4882, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1233,1238,
 igr2=1184,1185,
 &end
#
#   60 LEU  HN           60 LEU  HB-         5.50    (#   4883:20  Unique         2.12, 2.74 A)
 &rst
  ixpk= 4883, nxpk= 20, iat= 917,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 921, 922,
 &end
#
#   33 TRP  HZ2         125 ARG  HD-         5.50    (#   4884:20  Unique         2.45, 4.72 A)
 &rst
  ixpk= 4884, nxpk= 20, iat= 523,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2029,2030,
 &end
#
#   33 TRP  HH2         125 ARG  HD+         4.40    (#   4885:20  Unique         2.03, 3.48 A)
 &rst
  ixpk= 4885, nxpk= 20, iat= 525,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2029,2030,
 &end
#
#  125 ARG  HE          125 ARG  HD+         5.50    (#   4886:20  Unique         2.27, 2.64 A)
 &rst
  ixpk= 4886, nxpk= 20, iat=2032,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2029,2030,
 &end
#
#    2 ILE  QG2           6 GLY  HA+         3.50    (#   4888:20  Unique         1.96, 3.39 A)
 &rst
  ixpk= 4888, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  27,  28,  29,
 igr2=  78,  79,
 &end
#
#    0 AMB  20-2:4890    39 GLY  HA-         5.50    (#   4890:20  Single Ambig)
 &rst
  ixpk= 4890, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 626, 627, 620, 742, 743, 744,
 igr2= 611, 612,
 &end
#
#    0 AMB  20-2:4891     0 AMB  20-1:4891   5.50    (#   4891:20  Double Ambig)
 &rst
  ixpk= 4891, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.17, r4=10.92,
 igr1= 626, 627, 742, 743, 744,
 igr2= 611, 612, 611, 612, 604, 605, 604, 605,
 &end
#
#   30 GLN  HB-          29 GLY  HA-         5.50    (#   4892:20  Unique         4.46, 5.50 A)
 &rst
  ixpk= 4892, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 469, 470,
 igr2= 460, 461,
 &end
#
#   78 LYS  HA           94 GLY  HA-         3.50    (#   4896:20  Unique         2.99, 3.53 A)
 &rst
  ixpk= 4896, nxpk= 20, iat=1246,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1538,1539,
 &end
#
#   79 LEU  HG           94 GLY  HA-         5.50    (#   4897:20  Unique         3.84, 4.74 A)
 &rst
  ixpk= 4897, nxpk= 20, iat=1273,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1538,1539,
 &end
#
#    0 AMB  20-2:4898    20 GLY  HA-         3.50    (#   4898:20  Single Ambig)
 &rst
  ixpk= 4898, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2570,2571,2572,2574,2575,2576,2617,2618,2619,2621,
      2622,2623,
 igr2= 301, 302,
 &end
#
#    0 AMB  20-2:4899     0 AMB  20-1:4899   2.60    (#   4899:20  Double Ambig)
 &rst
  ixpk= 4899, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=2570,2571,2572,2574,2575,2576,2617,2618,2619,2621,
      2622,2623,
 igr2= 301, 302, 301, 302,
 &end
#
#   42 PRO  HD+          41 ASN  HA          2.60    (#   4905:20  Unique         2.35, 2.45 A)
 &rst
  ixpk= 4905, nxpk= 20, iat=  -1, 637, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 650, 651,
 &end
#
#   42 PRO  HD-          41 ASN  HA          3.50    (#   4906:20  Unique         2.35, 2.45 A)
 &rst
  ixpk= 4906, nxpk= 20, iat=  -1, 637, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 650, 651,
 &end
#
#   41 ASN  HB+          41 ASN  HA          3.50    (#   4907:20  Unique         2.25, 2.82 A)
 &rst
  ixpk= 4907, nxpk= 20, iat=  -1, 637, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 639, 640,
 &end
#
#   41 ASN  HB-          41 ASN  HA          3.50    (#   4908:20  Unique         2.25, 2.82 A)
 &rst
  ixpk= 4908, nxpk= 20, iat=  -1, 637, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 639, 640,
 &end
#
#    0 AMB  20-2:4909    41 ASN  HA          3.50    (#   4909:20  Single Ambig)
 &rst
  ixpk= 4909, nxpk= 20, iat=  -1, 637, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=   8,   9, 674, 675, 653, 654, 677, 678,
 &end
#
#    0 AMB  20-2:4910    41 ASN  HA          5.50    (#   4910:20  Single Ambig)
 &rst
  ixpk= 4910, nxpk= 20, iat=  -1, 637, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 656, 657, 135, 136,
 &end
#
#   98 LYS  HD+          98 LYS  HA          5.50    (#   4918:20  Unique         2.58, 4.05 A)
 &rst
  ixpk= 4918, nxpk= 20, iat=  -1,1601, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1609,1610,
 &end
#
#   99 TRP  HD1          98 LYS  HA          5.50    (#   4919:20  Unique         3.84, 4.41 A)
 &rst
  ixpk= 4919, nxpk= 20, iat=1629,1601, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    1 MET  ME            1 MET  HA          5.50    (#   4921:20  Unique         2.24, 4.50 A)
 &rst
  ixpk= 4921, nxpk= 20, iat=  -1,   6, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=  15,  16,  17,
 &end
#
#   97 GLN  HN           76 ARG  HA          5.50    (#   4922:20  Unique         2.47, 3.92 A)
 &rst
  ixpk= 4922, nxpk= 20, iat=1582,1201, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:4923    76 ARG  HA          2.60    (#   4923:20  Single Ambig)
 &rst
  ixpk= 4923, nxpk= 20, iat=  -1,1201, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1223,1199,
 &end
#
#   96 LYS  HA           76 ARG  HA          5.50    (#   4924:20  Unique         1.98, 4.12 A)
 &rst
  ixpk= 4924, nxpk= 20, iat=1562,1201, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   76 ARG  HB-          76 ARG  HA          5.50    (#   4925:20  Unique         2.31, 2.49 A)
 &rst
  ixpk= 4925, nxpk= 20, iat=  -1,1201, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1203,1204,
 &end
#
#   76 ARG  HG-          76 ARG  HA          5.50    (#   4926:20  Unique         2.35, 3.74 A)
 &rst
  ixpk= 4926, nxpk= 20, iat=  -1,1201, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1206,1207,
 &end
#
#    0 AMB  20-2:4927   142 ASP  HA          5.50    (#   4927:20  Single Ambig)
 &rst
  ixpk= 4927, nxpk= 20, iat=  -1,2342, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2323,2324,2320,2321,2396,2397,
 &end
#
#  131 TYR  HN          131 TYR  HA          5.50    (#   4928:20  Unique         2.73, 2.83 A)
 &rst
  ixpk= 4928, nxpk= 20, iat=2139,2141, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  138 SER  HA          138 SER  HB-         2.60    (#   4929:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 4929, nxpk= 20, iat=2265,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2267,2268,
 &end
#
#  120 GLU  HN          119 PRO  HA          2.60    (#   4930:20  Unique         2.15, 2.22 A)
 &rst
  ixpk= 4930, nxpk= 20, iat=1941,1937, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  116 SER  HB-         119 PRO  HA          5.50    (#   4931:20  Unique         3.62, 4.34 A)
 &rst
  ixpk= 4931, nxpk= 20, iat=  -1,1937, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1895,1896,
 &end
#
#  119 PRO  HB-         119 PRO  HA          2.60    (#   4932:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4932, nxpk= 20, iat=  -1,1937, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1934,1935,
 &end
#
#  119 PRO  HB+         119 PRO  HA          2.60    (#   4933:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4933, nxpk= 20, iat=  -1,1937, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1934,1935,
 &end
#
#    0 AMB  20-2:4934   119 PRO  HA          5.50    (#   4934:20  Single Ambig)
 &rst
  ixpk= 4934, nxpk= 20, iat=  -1,1937, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1931,1932,1948,1949,
 &end
#
#  119 PRO  HG+         119 PRO  HA          3.50    (#   4935:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 4935, nxpk= 20, iat=  -1,1937, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1931,1932,
 &end
#
#  129 TYR  HB+         128 SER  HB+         5.50    (#   4938:20  Unique         4.20, 6.17 A)
 &rst
  ixpk= 4938, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2098,2099,
 igr2=2087,2088,
 &end
#
#    0 AMB  20-2:4941   116 SER  HB-         5.50    (#   4941:20  Single Ambig)
 &rst
  ixpk= 4941, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1934,1935, 868, 869,1864,1865,
 igr2=1895,1896,
 &end
#
#    0 AMB  20-2:4945    88 THR  HB          5.50    (#   4945:20  Single Ambig)
 &rst
  ixpk= 4945, nxpk= 20, iat=  -1,1444, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1456,1382,
 &end
#
#   23 MET  HN           23 MET  HA          5.50    (#   4946:20  Unique         2.80, 2.91 A)
 &rst
  ixpk= 4946, nxpk= 20, iat= 339, 341, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   34 GLN  HB+          34 GLN  HA          5.50    (#   4948:20  Unique         2.37, 2.79 A)
 &rst
  ixpk= 4948, nxpk= 20, iat=  -1, 536, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 538, 539,
 &end
#
#  126 TRP  HD1           0 AMB  20-1:4949   5.50    (#   4949:20  Single Ambig)
 &rst
  ixpk= 4949, nxpk= 20, iat=2051,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr2=1999,2000,2047,2048,
 &end
#
#  124 TRP  HA          124 TRP  HB+         5.50    (#   4950:20  Unique         2.37, 2.54 A)
 &rst
  ixpk= 4950, nxpk= 20, iat=1997,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1999,2000,
 &end
#
#  113 MET  ME          124 TRP  HB+         5.50    (#   4952:20  Unique         2.83, 4.60 A)
 &rst
  ixpk= 4952, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1854,1855,1856,
 igr2=1999,2000,
 &end
#
#  124 TRP  HN          124 TRP  HB+         5.50    (#   4953:20  Unique         2.26, 3.25 A)
 &rst
  ixpk= 4953, nxpk= 20, iat=1995,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1999,2000,
 &end
#
#    1 MET  ME            1 MET  HB+         2.60    (#   4954:20  Unique         2.07, 4.69 A)
 &rst
  ixpk= 4954, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=  15,  16,  17,
 igr2=   8,   9,
 &end
#
#    0 AMB  20-2:4955     0 AMB  20-1:4955   4.40    (#   4955:20  Double Ambig)
 &rst
  ixpk= 4955, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1=2358,2359,2360,2362,2363,2364, 629, 630, 631, 622,
       623, 624,
 igr2=1589,1590,   8,   9,
 &end
#
#    0 AMB  20-2:4956     0 AMB  20-1:4956   4.40    (#   4956:20  Double Ambig)
 &rst
  ixpk= 4956, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.28, r4=10.03,
 igr1=  34,  35,  36,1567,1568, 626, 627, 626, 627, 626,
       627,
 igr2=   8,   9,1589,1590, 592, 593,   8,   9,
 &end
#
#    2 ILE  HN            1 MET  HB+         5.50    (#   4957:20  Unique         2.16, 4.03 A)
 &rst
  ixpk= 4957, nxpk= 20, iat=  21,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=   8,   9,
 &end
#
#    1 MET  HG+           1 MET  ME          4.40    (#   4958:20  Unique         2.08, 3.43 A)
 &rst
  ixpk= 4958, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  11,  12,
 igr2=  15,  16,  17,
 &end
#
#    1 MET  HG-           1 MET  ME          3.50    (#   4959:20  Unique         2.08, 3.43 A)
 &rst
  ixpk= 4959, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  11,  12,
 igr2=  15,  16,  17,
 &end
#
#    3 ASP  HB+           1 MET  ME          4.40    (#   4960:20  Unique         2.35, 4.63 A)
 &rst
  ixpk= 4960, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  44,  45,
 igr2=  15,  16,  17,
 &end
#
#    0 AMB  20-2:4962     2 ILE  HB          3.50    (#   4962:20  Single Ambig)
 &rst
  ixpk= 4962, nxpk= 20, iat=  -1,  25, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1483,1484,1480,1481,
 &end
#
#    2 ILE  QD1           2 ILE  HB          3.50    (#   4963:20  Unique         2.04, 2.86 A)
 &rst
  ixpk= 4963, nxpk= 20, iat=  -1,  25, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=  34,  35,  36,
 &end
#
#    3 ASP  HA            4 ASP  HA          5.50    (#   4964:20  Unique         4.30, 4.42 A)
 &rst
  ixpk= 4964, nxpk= 20, iat=  42,  54, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    5 ASP  HN            5 ASP  HB-         3.50    (#   4965:20  Unique         2.11, 2.79 A)
 &rst
  ixpk= 4965, nxpk= 20, iat=  64,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  68,  69,
 &end
#
#    5 ASP  HN            5 ASP  HB-         3.50    (#   4966:20  Unique         2.11, 2.79 A)
 &rst
  ixpk= 4966, nxpk= 20, iat=  64,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  68,  69,
 &end
#
#  108 ASP  HA          108 ASP  HB+         3.50    (#   4967:20  Unique         2.30, 2.47 A)
 &rst
  ixpk= 4967, nxpk= 20, iat=1775,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1777,1778,
 &end
#
#   93 ILE  QD1           6 GLY  HA+         4.40    (#   4968:20  Unique         1.98, 3.26 A)
 &rst
  ixpk= 4968, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1530,1531,1532,
 igr2=  78,  79,
 &end
#
#    7 TYR  HN            6 GLY  HA-         5.50    (#   4969:20  Unique         2.95, 3.25 A)
 &rst
  ixpk= 4969, nxpk= 20, iat=  83,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=  78,  79,
 &end
#
#    7 TYR  HN            6 GLY  HA+         5.50    (#   4970:20  Unique         2.95, 3.25 A)
 &rst
  ixpk= 4970, nxpk= 20, iat=  83,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=  78,  79,
 &end
#
#    0 AMB  20-2:4971     0 AMB  20-1:4971   5.50    (#   4971:20  Double Ambig)
 &rst
  ixpk= 4971, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.54, r4= 9.29,
 igr1=1527,1528,1530,1531,1532,1606,1607,
 igr2=  85,1158,
 &end
#
#    7 TYR  HN            7 TYR  HA          5.50    (#   4973:20  Unique         2.84, 2.93 A)
 &rst
  ixpk= 4973, nxpk= 20, iat=  83,  85, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  163 PRO  HD+         163 PRO  HB-         4.40    (#   4974:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4974, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2688,2689,
 igr2=2694,2695,
 &end
#
#    0 AMB  20-2:4975     0 AMB  20-1:4975   4.40    (#   4975:20  Double Ambig)
 &rst
  ixpk= 4975, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=2703, 665, 666,2610,
 igr2=2691,2692, 132, 133,
 &end
#
#    9 PRO  HA            9 PRO  HB-         5.50    (#   4976:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4976, nxpk= 20, iat= 138,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 135, 136,
 &end
#
#   11 VAL  MGX           9 PRO  HB-         4.40    (#   4977:20  Unique         4.41, 6.99 A)
 &rst
  ixpk= 4977, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 135, 136,
 &end
#
#    9 PRO  HB+           9 PRO  HG-         2.60    (#   4979:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 4979, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 135, 136,
 igr2= 132, 133,
 &end
#
#   10 ASN  HN           10 ASN  HA          5.50    (#   4980:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 4980, nxpk= 20, iat= 142, 144, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:4981    11 VAL  HA          4.40    (#   4981:20  Single Ambig)
 &rst
  ixpk= 4981, nxpk= 20, iat=  -1, 158, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1623, 138,
 &end
#
#   11 VAL  HB           11 VAL  MGX         2.60    (#   4983:20  Unique         2.26, 2.63 A)
 &rst
  ixpk= 4983, nxpk= 20, iat= 160,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:4984    12 GLY  HA-         5.50    (#   4984:20  Single Ambig)
 &rst
  ixpk= 4984, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.58, r4=10.33,
 igr1= 185, 186, 187, 227, 228, 229, 834, 835, 836, 838,
       839, 840,1609,1610,
 igr2= 174, 175,
 &end
#
#   13 ILE  HN            0 AMB  20-1:4985   4.40    (#   4985:20  Single Ambig)
 &rst
  ixpk= 4985, nxpk= 20, iat= 179,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr2= 174, 175, 174, 175,
 &end
#
#   13 ILE  HN            0 AMB  20-1:4986   3.50    (#   4986:20  Single Ambig)
 &rst
  ixpk= 4986, nxpk= 20, iat= 179,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 174, 175, 174, 175,
 &end
#
#   36 PRO  HB-          13 ILE  HB          3.50    (#   4987:20  Unique         2.67, 3.89 A)
 &rst
  ixpk= 4987, nxpk= 20, iat=  -1, 183, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 578, 579,
 &end
#
#    0 AMB  20-2:4988    13 ILE  HB          5.50    (#   4988:20  Single Ambig)
 &rst
  ixpk= 4988, nxpk= 20, iat=  -1, 183, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 189, 190, 350, 351, 352,
 &end
#
#   17 ASN  HN           17 ASN  HA          3.50    (#   4990:20  Unique         2.90, 2.94 A)
 &rst
  ixpk= 4990, nxpk= 20, iat= 244, 246, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:4991     0 AMB  20-1:4991   4.40    (#   4991:20  Double Ambig)
 &rst
  ixpk= 4991, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1028,1029, 265, 266,
 igr2=1066, 284,
 &end
#
#    0 AMB  20-2:4992     0 AMB  20-1:4992   2.60    (#   4992:20  Double Ambig)
 &rst
  ixpk= 4992, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1= 677, 678, 289, 290, 674, 675,
 igr2= 725, 726, 286, 287,
 &end
#
#   19 GLN  HG+          19 GLN  HB-         2.60    (#   4993:20  Unique         2.26, 2.58 A)
 &rst
  ixpk= 4993, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 289, 290,
 igr2= 286, 287,
 &end
#
#   95 GLN  HN           94 GLY  HA+         3.50    (#   4994:20  Unique         2.19, 2.61 A)
 &rst
  ixpk= 4994, nxpk= 20, iat=1543,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1538,1539,
 &end
#
#    0 AMB  20-2:4996    25 ALA  HA          5.50    (#   4996:20  Single Ambig)
 &rst
  ixpk= 4996, nxpk= 20, iat=  -1, 382, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1999,2000,1980,1981,
 &end
#
#    0 AMB  20-2:4997    25 ALA  HA          5.50    (#   4997:20  Single Ambig)
 &rst
  ixpk= 4997, nxpk= 20, iat=  -1, 382, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1960,1961, 514, 515, 392,
 &end
#
#    0 AMB  20-2:4998     0 AMB  20-1:4998   3.50    (#   4998:20  Double Ambig)
 &rst
  ixpk= 4998, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 871, 872, 442, 443,
 igr2= 866, 440,
 &end
#
#   28 PHE  HB+          28 PHE  HA          5.50    (#   4999:20  Unique         2.58, 2.82 A)
 &rst
  ixpk= 4999, nxpk= 20, iat=  -1, 440, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 442, 443,
 &end
#
#   28 PHE  HD           28 PHE  HA          5.50    (#   5000:20  Unique         2.14, 3.33 A)
 &rst
  ixpk= 5000, nxpk= 20, iat=  -1, 440, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 446, 454,
 &end
#
#   35 PHE  HN           35 PHE  HB-         5.50    (#   5001:20  Unique         2.16, 3.07 A)
 &rst
  ixpk= 5001, nxpk= 20, iat= 551,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 555, 556,
 &end
#
#   35 PHE  HN           35 PHE  HB+         5.50    (#   5002:20  Unique         2.16, 3.07 A)
 &rst
  ixpk= 5002, nxpk= 20, iat= 551,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 555, 556,
 &end
#
#   42 PRO  HB-          42 PRO  HD+         5.50    (#   5003:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 5003, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#    0 AMB  20-2:5004     0 AMB  20-1:5004   3.50    (#   5004:20  Double Ambig)
 &rst
  ixpk= 5004, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 653, 654,  15,  16,  17,
 igr2= 650, 651, 650, 651,
 &end
#
#    0 AMB  20-2:5005     0 AMB  20-1:5005   3.50    (#   5005:20  Double Ambig)
 &rst
  ixpk= 5005, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 653, 654,   8,   9,
 igr2= 650, 651, 650, 651,
 &end
#
#   42 PRO  HA           42 PRO  HG-         3.50    (#   5009:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 5009, nxpk= 20, iat= 659,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 653, 654,
 &end
#
#   41 ASN  HB-          42 PRO  HD+         5.50    (#   5013:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 5013, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   41 ASN  HD2+         42 PRO  HD+         5.50    (#   5017:20  Unique         1.97, 3.69 A)
 &rst
  ixpk= 5017, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 644, 645,
 igr2= 650, 651,
 &end
#
#    0 AMB  20-2:5018    37 GLN  HA          5.50    (#   5018:20  Single Ambig)
 &rst
  ixpk= 5018, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 185, 186, 187, 834, 835, 836, 838, 839, 840, 227,
       228, 229,
 &end
#
#   37 GLN  HB-          37 GLN  HA          4.40    (#   5019:20  Unique         2.32, 2.73 A)
 &rst
  ixpk= 5019, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1= 589, 590,
 &end
#
#   57 GLU  HG+          37 GLN  HA          5.50    (#   5020:20  Unique         3.13, 5.44 A)
 &rst
  ixpk= 5020, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 886, 887,
 &end
#
#   13 ILE  HN           37 GLN  HA          4.40    (#   5022:20  Unique         3.28, 3.79 A)
 &rst
  ixpk= 5022, nxpk= 20, iat= 179, 587, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  104 LEU  HN          103 GLN  HG+         3.50    (#   5023:20  Unique         2.16, 3.18 A)
 &rst
  ixpk= 5023, nxpk= 20, iat=1720,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1710,1711,
 &end
#
#    0 AMB  20-2:5024     0 AMB  20-1:5024   3.50    (#   5024:20  Double Ambig)
 &rst
  ixpk= 5024, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 604, 605, 604, 605, 611, 612, 611, 612,
 igr2= 589, 590, 589, 590, 589, 590,
 &end
#
#    0 AMB  20-2:5025     0 AMB  20-1:5025   5.50    (#   5025:20  Double Ambig)
 &rst
  ixpk= 5025, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 587,1201,
 igr2= 592, 593,1586,1587,1550,1551,
 &end
#
#    0 AMB  20-2:5026     0 AMB  20-1:5026   3.50    (#   5026:20  Double Ambig)
 &rst
  ixpk= 5026, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 499,1233,1238,
 igr2= 472, 473,1586,1587,1550,1551,1589,1590,
 &end
#
#    0 AMB  20-2:5027     0 AMB  20-1:5027   5.50    (#   5027:20  Double Ambig)
 &rst
  ixpk= 5027, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 559, 567, 446, 454,
 igr2= 592, 593, 472, 473,
 &end
#
#   13 ILE  HN            0 AMB  20-1:5028   5.50    (#   5028:20  Single Ambig)
 &rst
  ixpk= 5028, nxpk= 20, iat= 179,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr2= 592, 593, 886, 887,
 &end
#
#   38 GLY  HN            0 AMB  20-1:5029   3.50    (#   5029:20  Single Ambig)
 &rst
  ixpk= 5029, nxpk= 20, iat= 602,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 604, 605, 611, 612,
 &end
#
#   39 GLY  HN            0 AMB  20-1:5030   2.60    (#   5030:20  Single Ambig)
 &rst
  ixpk= 5030, nxpk= 20, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr2= 611, 612, 604, 605,
 &end
#
#   39 GLY  HN           38 GLY  HA-         3.50    (#   5031:20  Unique         2.74, 3.25 A)
 &rst
  ixpk= 5031, nxpk= 20, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 604, 605,
 &end
#
#   40 ILE  HA           40 ILE  HG1-        5.50    (#   5032:20  Unique         2.45, 2.76 A)
 &rst
  ixpk= 5032, nxpk= 20, iat= 618,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 626, 627,
 &end
#
#   46 ALA  HA           40 ILE  HG1-        5.50    (#   5033:20  Unique         3.02, 4.14 A)
 &rst
  ixpk= 5033, nxpk= 20, iat= 698,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 626, 627,
 &end
#
#   40 ILE  QD1          40 ILE  QG2         2.60    (#   5034:20  Unique         1.99, 3.62 A)
 &rst
  ixpk= 5034, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.75, r4= 4.50,
 igr1= 629, 630, 631,
 igr2= 622, 623, 624,
 &end
#
#   42 PRO  HD+          41 ASN  HB-         5.50    (#   5035:20  Unique         1.83, 3.47 A)
 &rst
  ixpk= 5035, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 650, 651,
 igr2= 639, 640,
 &end
#
#    0 AMB  20-2:5036     0 AMB  20-1:5036   3.50    (#   5036:20  Double Ambig)
 &rst
  ixpk= 5036, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 192, 193, 194,1071,
 igr2= 578, 579,1707,1708,
 &end
#
#   51 TYR  HD           51 TYR  HB+         4.40    (#   5037:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 5037, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 773, 782,
 igr2= 769, 770,
 &end
#
#   51 TYR  HN           51 TYR  HB+         4.40    (#   5038:20  Unique         2.17, 2.86 A)
 &rst
  ixpk= 5038, nxpk= 20, iat= 765,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 769, 770,
 &end
#
#   53 GLU  HN           53 GLU  HB+         5.50    (#   5039:20  Unique         2.14, 2.86 A)
 &rst
  ixpk= 5039, nxpk= 20, iat= 810,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 814, 815,
 &end
#
#   60 LEU  HN           60 LEU  HA          4.40    (#   5040:20  Unique         2.90, 2.91 A)
 &rst
  ixpk= 5040, nxpk= 20, iat= 917, 919, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:5041     0 AMB  20-1:5041   5.50    (#   5041:20  Double Ambig)
 &rst
  ixpk= 5041, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1= 834, 835, 836, 838, 839, 840,1745,1746,1747,1749,
      1750,1751,
 igr2= 954, 955, 954, 955,
 &end
#
#   63 LYS  HD+          63 LYS  HB-         3.50    (#   5042:20  Unique         2.00, 3.23 A)
 &rst
  ixpk= 5042, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 981, 982,
 igr2= 975, 976,
 &end
#
#   63 LYS  HD+          63 LYS  HB+         3.50    (#   5043:20  Unique         2.00, 3.23 A)
 &rst
  ixpk= 5043, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 981, 982,
 igr2= 975, 976,
 &end
#
#   66 ARG  HB+          66 ARG  HA          2.60    (#   5044:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 5044, nxpk= 20, iat=  -1,1023, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1025,1026,
 &end
#
#    0 AMB  20-2:5045     0 AMB  20-1:5045   2.60    (#   5045:20  Double Ambig)
 &rst
  ixpk= 5045, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1028,1029,1461,1462,
 igr2=1025,1026,1458,1459,
 &end
#
#   68 LEU  HG           68 LEU  MDY         2.60    (#   5047:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 5047, nxpk= 20, iat=1071,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#  103 GLN  HB-          68 LEU  MDY         2.60    (#   5048:20  Unique         2.00, 3.40 A)
 &rst
  ixpk= 5048, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1707,1708,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#   73 ASN  HN           71 THR  HA          4.40    (#   5049:20  Unique         3.48, 3.57 A)
 &rst
  ixpk= 5049, nxpk= 20, iat=1142,1106, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  136 VAL  HB          136 VAL  HA          2.60    (#   5050:20  Unique         2.39, 2.54 A)
 &rst
  ixpk= 5050, nxpk= 20, iat=2235,2233, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#    0 AMB  20-2:5051    71 THR  HA          4.40    (#   5051:20  Single Ambig)
 &rst
  ixpk= 5051, nxpk= 20, iat=  -1,1106, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1122,1123,2480,2481,
 &end
#
#   75 LEU  MDY          71 THR  HB          5.50    (#   5052:20  Unique         3.70, 5.18 A)
 &rst
  ixpk= 5052, nxpk= 20, iat=  -1,1108, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1189,1190,1191,1193,1194,1195,
 &end
#
#   71 THR  HN           71 THR  HB          5.50    (#   5053:20  Unique         3.65, 3.67 A)
 &rst
  ixpk= 5053, nxpk= 20, iat=1104,1108, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:5055     0 AMB  20-1:5055   2.60    (#   5055:20  Double Ambig)
 &rst
  ixpk= 5055, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,
 igr1=1110,1111,1112,2358,2359,2360,2362,2363,2364,
 igr2=2496,2497,1187,
 &end
#
#   75 LEU  HB+          75 LEU  MDX         2.60    (#   5057:20  Unique         1.99, 3.28 A)
 &rst
  ixpk= 5057, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1184,1185,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#    7 TYR  HE           76 ARG  HD+         5.50    (#   5058:20  Unique         2.49, 6.13 A)
 &rst
  ixpk= 5058, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  93,  98,
 igr2=1209,1210,
 &end
#
#   77 TYR  HE           77 TYR  HB+         5.50    (#   5059:20  Unique         4.62, 5.05 A)
 &rst
  ixpk= 5059, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1233,1238,
 igr2=1227,1228,
 &end
#
#   78 LYS  HE+          78 LYS  HB+         5.50    (#   5060:20  Unique         2.29, 3.75 A)
 &rst
  ixpk= 5060, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1257,1258,
 igr2=1248,1249,
 &end
#
#   79 LEU  HB-          79 LEU  HA          5.50    (#   5061:20  Unique         2.23, 2.46 A)
 &rst
  ixpk= 5061, nxpk= 20, iat=  -1,1268, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1270,1271,
 &end
#
#   79 LEU  HA           79 LEU  HB-         5.50    (#   5062:20  Unique         2.23, 2.46 A)
 &rst
  ixpk= 5062, nxpk= 20, iat=1268,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1270,1271,
 &end
#
#   79 LEU  HB+          79 LEU  HG          4.40    (#   5063:20  Unique         2.41, 2.76 A)
 &rst
  ixpk= 5063, nxpk= 20, iat=  -1,1273, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1270,1271,
 &end
#
#    0 AMB  20-2:5064    80 PRO  HA          3.50    (#   5064:20  Single Ambig)
 &rst
  ixpk= 5064, nxpk= 20, iat=  -1,1295, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1289,1290,1248,1249,
 &end
#
#   82 ARG  HG-          82 ARG  HD+         3.50    (#   5066:20  Unique         2.22, 2.62 A)
 &rst
  ixpk= 5066, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1328,1329,
 igr2=1331,1332,
 &end
#
#   83 LEU  HG           83 LEU  HB+         3.50    (#   5067:20  Unique         2.36, 2.76 A)
 &rst
  ixpk= 5067, nxpk= 20, iat=1352,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1349,1350,
 &end
#
#   83 LEU  HG           83 LEU  HB-         3.50    (#   5068:20  Unique         2.36, 2.76 A)
 &rst
  ixpk= 5068, nxpk= 20, iat=1352,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1349,1350,
 &end
#
#    0 AMB  20-2:5069    83 LEU  MDX         2.60    (#   5069:20  Single Ambig)
 &rst
  ixpk= 5069, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=1328,1329,1349,1350,
 igr2=1354,1355,1356,1358,1359,1360,
 &end
#
#    0 AMB  20-2:5070    84 VAL  MGY         3.50    (#   5070:20  Single Ambig)
 &rst
  ixpk= 5070, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1364,1419,
 igr2=1370,1371,1372,1374,1375,1376,
 &end
#
#   86 TRP  HA           85 ARG  HA          4.40    (#   5071:20  Unique         4.39, 4.41 A)
 &rst
  ixpk= 5071, nxpk= 20, iat=1406,1382, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#   85 ARG  HG-          85 ARG  HB+         2.60    (#   5072:20  Unique         2.35, 2.59 A)
 &rst
  ixpk= 5072, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1387,1388,
 igr2=1384,1385,
 &end
#
#    0 AMB  20-2:5074     0 AMB  20-1:5074   2.60    (#   5074:20  Double Ambig)
 &rst
  ixpk= 5074, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 268, 269,1390,1391,
 igr2= 262, 263,1384,1385,
 &end
#
#   85 ARG  HN           85 ARG  HB+         4.40    (#   5075:20  Unique         2.24, 2.94 A)
 &rst
  ixpk= 5075, nxpk= 20, iat=1380,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1384,1385,
 &end
#
#   87 ASP  HN           86 TRP  HB-         5.50    (#   5077:20  Unique         3.14, 3.87 A)
 &rst
  ixpk= 5077, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1408,1409,
 &end
#
#   87 ASP  HN           86 TRP  HB+         5.50    (#   5078:20  Unique         3.14, 3.87 A)
 &rst
  ixpk= 5078, nxpk= 20, iat=1428,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1408,1409,
 &end
#
#    0 AMB  20-2:5079     0 AMB  20-1:5079   2.60    (#   5079:20  Double Ambig)
 &rst
  ixpk= 5079, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.68, r4= 4.43,
 igr1=1432,1433,  68,  69,
 igr2=1430,  66,
 &end
#
#   89 LYS  HN           89 LYS  HB-         3.50    (#   5080:20  Unique         2.13, 2.79 A)
 &rst
  ixpk= 5080, nxpk= 20, iat=1454,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1458,1459,
 &end
#
#   89 LYS  HN           89 LYS  HB+         3.50    (#   5081:20  Unique         2.13, 2.79 A)
 &rst
  ixpk= 5081, nxpk= 20, iat=1454,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1458,1459,
 &end
#
#   78 LYS  HA           78 LYS  HB-         3.50    (#   5082:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 5082, nxpk= 20, iat=1246,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1248,1249,
 &end
#
#    0 AMB  20-2:5083     0 AMB  20-1:5083   2.60    (#   5083:20  Double Ambig)
 &rst
  ixpk= 5083, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2705,2706,1458,1459,
 igr2=2708,2709,1461,1462,
 &end
#
#   89 LYS  HB+          89 LYS  HG-         2.60    (#   5084:20  Unique         2.32, 2.71 A)
 &rst
  ixpk= 5084, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1458,1459,
 igr2=1461,1462,
 &end
#
#    0 AMB  20-2:5086     0 AMB  20-1:5086   2.60    (#   5086:20  Double Ambig)
 &rst
  ixpk= 5086, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2298,2299, 978, 979,
 igr2=2307,2308, 984, 985,
 &end
#
#    0 AMB  20-2:5087     0 AMB  20-1:5087   2.60    (#   5087:20  Double Ambig)
 &rst
  ixpk= 5087, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2420,2421,1306,1307,2705,2706,
 igr2=2483,2484,1312,1313,2714,2715,
 &end
#
#    0 AMB  20-2:5088     0 AMB  20-1:5088   5.50    (#   5088:20  Double Ambig)
 &rst
  ixpk= 5088, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.22, r4=11.97,
 igr1=1456,1382,1108,  85,2675,2117,
 igr2=1467,1468,1467,1468,2483,2484,1257,1258,2714,2715,
      2483,2484,
 &end
#
#   91 VAL  MGY          90 PRO  HA          5.50    (#   5089:20  Unique         3.88, 5.77 A)
 &rst
  ixpk= 5089, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   89 LYS  HG-          90 PRO  HA          5.50    (#   5090:20  Unique         3.87, 4.65 A)
 &rst
  ixpk= 5090, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1461,1462,
 &end
#
#   90 PRO  HB+          90 PRO  HA          5.50    (#   5092:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 5092, nxpk= 20, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1483,1484,
 &end
#
#   89 LYS  HA           90 PRO  HA          4.40    (#   5093:20  Unique         4.39, 4.39 A)
 &rst
  ixpk= 5093, nxpk= 20, iat=1456,1486, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  160 GLU  HN            0 AMB  20-1:5095   4.40    (#   5095:20  Single Ambig)
 &rst
  ixpk= 5095, nxpk= 20, iat=2644,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr2=2634,2635,2634,2635,
 &end
#
#    0 AMB  20-2:5096     0 AMB  20-1:5096   4.40    (#   5096:20  Double Ambig)
 &rst
  ixpk= 5096, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=  27,  28,  29,1883,1884,1885,
 igr2=1483,1484,1867,1868,
 &end
#
#    0 AMB  20-2:5099    91 VAL  MGY         4.40    (#   5099:20  Single Ambig)
 &rst
  ixpk= 5099, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1440,1555,1556,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    6 GLY  HA-          93 ILE  HG1-        5.50    (#   5100:20  Unique         3.87, 4.98 A)
 &rst
  ixpk= 5100, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  78,  79,
 igr2=1527,1528,
 &end
#
#    0 AMB  20-2:5101     0 AMB  20-1:5101   4.40    (#   5101:20  Double Ambig)
 &rst
  ixpk= 5101, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.76, r4= 8.51,
 igr1=  31,  32,1251,1252, 924,
 igr2=1530,1531,1532, 192, 193, 194,
 &end
#
#    6 GLY  HA+          93 ILE  QD1         4.40    (#   5102:20  Unique         1.98, 3.26 A)
 &rst
  ixpk= 5102, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  78,  79,
 igr2=1530,1531,1532,
 &end
#
#   93 ILE  HA           93 ILE  QD1         4.40    (#   5103:20  Unique         3.85, 4.61 A)
 &rst
  ixpk= 5103, nxpk= 20, iat=1519,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1530,1531,1532,
 &end
#
#    0 AMB  20-2:5104    13 ILE  QD1         5.50    (#   5104:20  Single Ambig)
 &rst
  ixpk= 5104, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 748, 786,
 igr2= 192, 193, 194,
 &end
#
#   78 LYS  HA           94 GLY  HA+         3.50    (#   5106:20  Unique         2.99, 3.53 A)
 &rst
  ixpk= 5106, nxpk= 20, iat=1246,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1538,1539,
 &end
#
#   10 ASN  HD2+         95 GLN  HB-         5.50    (#   5107:20  Unique         3.26, 4.96 A)
 &rst
  ixpk= 5107, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 151, 152,
 igr2=1547,1548,
 &end
#
#    0 AMB  20-2:5108     0 AMB  20-1:5108   4.40    (#   5108:20  Double Ambig)
 &rst
  ixpk= 5108, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.76, r4= 8.51,
 igr1=2515,2523,1233,1238,1872,1873,
 igr2= 202,1547,1548,1934,1935,
 &end
#
#   80 PRO  HD-          80 PRO  HB-         5.50    (#   5109:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 5109, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1286,1287,
 igr2=1292,1293,
 &end
#
#    0 AMB  20-2:5110    95 GLN  HB-         4.40    (#   5110:20  Single Ambig)
 &rst
  ixpk= 5110, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.83, r4= 7.58,
 igr1=1567,1568,  34,  35,  36, 626, 627,
 igr2=1547,1548,
 &end
#
#   95 GLN  HB+          95 GLN  HG+         2.60    (#   5111:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 5111, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1547,1548,
 igr2=1550,1551,
 &end
#
#    0 AMB  20-2:5112     0 AMB  20-1:5112   2.60    (#   5112:20  Double Ambig)
 &rst
  ixpk= 5112, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1547,1548, 589, 590,
 igr2=1550,1551, 592, 593,
 &end
#
#    0 AMB  20-2:5114     0 AMB  20-1:5114   4.40    (#   5114:20  Double Ambig)
 &rst
  ixpk= 5114, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.00, r4= 8.75,
 igr1= 460, 461, 503, 504, 503, 504,
 igr2= 472, 473, 472, 473, 472, 473,
 &end
#
#    0 AMB  20-2:5115     0 AMB  20-1:5115   5.50    (#   5115:20  Double Ambig)
 &rst
  ixpk= 5115, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1631,1582,
 igr2=1586,1587,1586,1587,
 &end
#
#   98 LYS  HD-          98 LYS  HA          5.50    (#   5116:20  Unique         2.58, 4.05 A)
 &rst
  ixpk= 5116, nxpk= 20, iat=  -1,1601, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1609,1610,
 &end
#
#   98 LYS  HG+          98 LYS  HD+         3.50    (#   5117:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 5117, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1606,1607,
 igr2=1609,1610,
 &end
#
#   98 LYS  HG-          98 LYS  HD-         3.50    (#   5118:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 5118, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1606,1607,
 igr2=1609,1610,
 &end
#
#   99 TRP  HB+          99 TRP  HA          5.50    (#   5119:20  Unique         2.37, 2.72 A)
 &rst
  ixpk= 5119, nxpk= 20, iat=  -1,1623, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1625,1626,
 &end
#
#   99 TRP  HB-          99 TRP  HA          5.50    (#   5120:20  Unique         2.37, 2.72 A)
 &rst
  ixpk= 5120, nxpk= 20, iat=  -1,1623, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1625,1626,
 &end
#
#  102 LEU  MDX         100 PHE  HB+         5.50    (#   5121:20  Unique         1.97, 4.34 A)
 &rst
  ixpk= 5121, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1693,1694,1695,1697,1698,1699,
 igr2=1649,1650,
 &end
#
#    0 AMB  20-2:5122     0 AMB  20-1:5122   3.50    (#   5122:20  Double Ambig)
 &rst
  ixpk= 5122, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.32, r4= 8.07,
 igr1=1729,1730,1731,1733,1734,1735,1672,
 igr2= 926, 927, 928, 930, 931, 932,1674,1675,1676,1678,
      1679,1680,
 &end
#
#   68 LEU  HB-         101 LEU  MDY         3.50    (#   5123:20  Unique         2.00, 4.99 A)
 &rst
  ixpk= 5123, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1068,1069,
 igr2=1674,1675,1676,1678,1679,1680,
 &end
#
#  102 LEU  HB-         102 LEU  HG          2.60    (#   5124:20  Unique         2.25, 2.76 A)
 &rst
  ixpk= 5124, nxpk= 20, iat=  -1,1691, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1=1688,1689,
 &end
#
#    0 AMB  20-2:5125     0 AMB  20-1:5125   4.40    (#   5125:20  Double Ambig)
 &rst
  ixpk= 5125, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=1021,1665,2368,
 igr2=1693,1694,1695,1697,1698,1699,2301,2302,
 &end
#
#  104 LEU  HB+         104 LEU  HG          4.40    (#   5126:20  Unique         2.35, 2.72 A)
 &rst
  ixpk= 5126, nxpk= 20, iat=  -1,1727, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1724,1725,
 &end
#
#  105 VAL  HN          105 VAL  HB          3.50    (#   5129:20  Unique         2.65, 2.91 A)
 &rst
  ixpk= 5129, nxpk= 20, iat=1739,1743, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5130     0 AMB  20-1:5130   4.40    (#   5130:20  Double Ambig)
 &rst
  ixpk= 5130, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.62, r4= 8.37,
 igr1=1720,1645, 864,
 igr2=1745,1746,1747,1749,1750,1751, 185, 186, 187,
 &end
#
#  104 LEU  MDX         106 SER  HB+         5.50    (#   5131:20  Unique         3.78, 5.79 A)
 &rst
  ixpk= 5131, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1729,1730,1731,1733,1734,1735,
 igr2=1759,1760,
 &end
#
#    0 AMB  20-2:5134   110 GLU  HB-         3.50    (#   5134:20  Single Ambig)
 &rst
  ixpk= 5134, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1799,1800,
 &end
#
#    0 AMB  20-2:5135     0 AMB  20-1:5135   4.40    (#   5135:20  Double Ambig)
 &rst
  ixpk= 5135, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=1789,1790,1791,1814,
 igr2=1799,1800,1799,1800,
 &end
#
#  110 GLU  HA          110 GLU  HB+         3.50    (#   5136:20  Unique         2.40, 2.79 A)
 &rst
  ixpk= 5136, nxpk= 20, iat=1797,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1799,1800,
 &end
#
#    0 AMB  20-2:5137   111 ILE  HA          3.50    (#   5137:20  Single Ambig)
 &rst
  ixpk= 5137, nxpk= 20, iat=  -1,1812, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#  111 ILE  HG1+        111 ILE  HB          5.50    (#   5138:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 5138, nxpk= 20, iat=  -1,1814, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1820,1821,
 &end
#
#    0 AMB  20-2:5139     0 AMB  20-1:5139   5.50    (#   5139:20  Double Ambig)
 &rst
  ixpk= 5139, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 igr2=1820,1821,1820,1821,
 &end
#
#  111 ILE  HN          111 ILE  HG1+        5.50    (#   5141:20  Unique         1.90, 2.63 A)
 &rst
  ixpk= 5141, nxpk= 20, iat=1810,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1820,1821,
 &end
#
#  126 TRP  HZ2         111 ILE  QD1         4.40    (#   5142:20  Unique         2.35, 4.03 A)
 &rst
  ixpk= 5142, nxpk= 20, iat=2056,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=1823,1824,1825,
 &end
#
#  113 MET  HG-         113 MET  HA          3.50    (#   5144:20  Unique         2.46, 3.06 A)
 &rst
  ixpk= 5144, nxpk= 20, iat=  -1,1845, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1850,1851,
 &end
#
#  113 MET  HG-         113 MET  ME          3.50    (#   5145:20  Unique         2.06, 3.29 A)
 &rst
  ixpk= 5145, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1850,1851,
 igr2=1854,1855,1856,
 &end
#
#    0 AMB  20-2:5146   113 MET  ME          3.50    (#   5146:20  Single Ambig)
 &rst
  ixpk= 5146, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1845, 416,
 igr2=1854,1855,1856,
 &end
#
#  115 THR  HN          114 GLN  HB-         5.50    (#   5148:20  Unique         4.41, 4.45 A)
 &rst
  ixpk= 5148, nxpk= 20, iat=1877,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1864,1865,
 &end
#
#    0 AMB  20-2:5149     0 AMB  20-1:5149   3.50    (#   5149:20  Double Ambig)
 &rst
  ixpk= 5149, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2608,2548,
 igr2=2601,2602,2601,2602,
 &end
#
#    0 AMB  20-2:5150     0 AMB  20-1:5150   2.60    (#   5150:20  Double Ambig)
 &rst
  ixpk= 5150, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2668,2669,2597,
 igr2=2601,2602,2601,2602,
 &end
#
#  115 THR  HA          115 THR  MG2         2.60    (#   5151:20  Unique         1.99, 2.81 A)
 &rst
  ixpk= 5151, nxpk= 20, iat=1879,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1883,1884,1885,
 &end
#
#    0 AMB  20-2:5152     0 AMB  20-1:5152   5.50    (#   5152:20  Double Ambig)
 &rst
  ixpk= 5152, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1= 997, 998, 997, 998,
 igr2=1011,1012,1013,1015,1016,1017,1745,1746,1747,1749,
      1750,1751,
 &end
#
#  118 THR  HN          116 SER  HB-         4.40    (#   5153:20  Unique         2.76, 3.83 A)
 &rst
  ixpk= 5153, nxpk= 20, iat=1913,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1895,1896,
 &end
#
#  118 THR  HN          116 SER  HB+         4.40    (#   5154:20  Unique         2.76, 3.83 A)
 &rst
  ixpk= 5154, nxpk= 20, iat=1913,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1895,1896,
 &end
#
#  117 SER  HA          117 SER  HB+         2.60    (#   5156:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 5156, nxpk= 20, iat=1904,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1906,1907,
 &end
#
#  117 SER  HA          117 SER  HB+         2.60    (#   5157:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 5157, nxpk= 20, iat=1904,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1906,1907,
 &end
#
#  117 SER  HA          117 SER  HB-         2.60    (#   5158:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 5158, nxpk= 20, iat=1904,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1906,1907,
 &end
#
#  118 THR  HB          118 THR  HA          2.60    (#   5159:20  Unique         2.56, 2.65 A)
 &rst
  ixpk= 5159, nxpk= 20, iat=1917,1915, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  117 SER  HB-         118 THR  MG2         4.40    (#   5164:20  Unique         2.94, 4.85 A)
 &rst
  ixpk= 5164, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1906,1907,
 igr2=1919,1920,1921,
 &end
#
#  120 GLU  HA          120 GLU  HG+         4.40    (#   5165:20  Unique         2.27, 3.17 A)
 &rst
  ixpk= 5165, nxpk= 20, iat=1943,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1948,1949,
 &end
#
#  122 ASP  HN          121 PHE  HA          5.50    (#   5166:20  Unique         2.22, 2.77 A)
 &rst
  ixpk= 5166, nxpk= 20, iat=1976,1958, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   31 HIS  HD2         122 ASP  HB+         5.50    (#   5168:20  Unique         3.32, 8.58 A)
 &rst
  ixpk= 5168, nxpk= 20, iat= 495,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1980,1981,
 &end
#
#  124 TRP  HB+         124 TRP  HA          5.50    (#   5170:20  Unique         2.37, 2.54 A)
 &rst
  ixpk= 5170, nxpk= 20, iat=  -1,1997, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1999,2000,
 &end
#
#  125 ARG  HB-         125 ARG  HA          4.40    (#   5172:20  Unique         2.36, 2.75 A)
 &rst
  ixpk= 5172, nxpk= 20, iat=  -1,2021, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2023,2024,
 &end
#
#   66 ARG  HA           66 ARG  HB+         3.50    (#   5173:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 5173, nxpk= 20, iat=1023,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1025,1026,
 &end
#
#    0 AMB  20-2:5174   125 ARG  HG-         5.50    (#   5174:20  Single Ambig)
 &rst
  ixpk= 5174, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1995,2083,
 igr2=2026,2027,
 &end
#
#    0 AMB  20-2:5176   127 VAL  MGX         5.50    (#   5176:20  Single Ambig)
 &rst
  ixpk= 5176, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1= 369,2149,2154,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  129 TYR  HB-         129 TYR  HA          4.40    (#   5177:20  Unique         2.33, 2.51 A)
 &rst
  ixpk= 5177, nxpk= 20, iat=  -1,2096, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2098,2099,
 &end
#
#  128 SER  HA          129 TYR  HA          5.50    (#   5178:20  Unique         4.29, 4.32 A)
 &rst
  ixpk= 5178, nxpk= 20, iat=2085,2096, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  129 TYR  HN          129 TYR  HA          3.50    (#   5179:20  Unique         2.80, 2.87 A)
 &rst
  ixpk= 5179, nxpk= 20, iat=2094,2096, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  129 TYR  HA          129 TYR  HB-         5.50    (#   5180:20  Unique         2.33, 2.51 A)
 &rst
  ixpk= 5180, nxpk= 20, iat=2096,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2098,2099,
 &end
#
#  129 TYR  HA          129 TYR  HB+         5.50    (#   5181:20  Unique         2.33, 2.51 A)
 &rst
  ixpk= 5181, nxpk= 20, iat=2096,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2098,2099,
 &end
#
#  131 TYR  HB+         131 TYR  HA          4.40    (#   5182:20  Unique         2.30, 2.76 A)
 &rst
  ixpk= 5182, nxpk= 20, iat=  -1,2141, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2143,2144,
 &end
#
#    0 AMB  20-2:5184    91 VAL  MGY         5.50    (#   5184:20  Single Ambig)
 &rst
  ixpk= 5184, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=1408,1409,1467,1468,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#  130 TRP  HE3         133 VAL  MGX         3.50    (#   5186:20  Unique         3.72, 6.77 A)
 &rst
  ixpk= 5186, nxpk= 20, iat=2134,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:5187    91 VAL  MGY         2.60    (#   5187:20  Single Ambig)
 &rst
  ixpk= 5187, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1=1490,1506,1380,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#  133 VAL  HN          133 VAL  MGY         2.60    (#   5188:20  Unique         1.93, 3.67 A)
 &rst
  ixpk= 5188, nxpk= 20, iat=2174,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:5189     0 AMB  20-1:5189   2.60    (#   5189:20  Double Ambig)
 &rst
  ixpk= 5189, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2178,1586,1587,
 igr2=2180,2181,2182,2184,2185,2186,2358,2359,2360,2362,
      2363,2364,
 &end
#
#  160 GLU  HN          158 LEU  HA          4.40    (#   5190:20  Unique         3.79, 4.17 A)
 &rst
  ixpk= 5190, nxpk= 20, iat=2644,2610, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:5191     0 AMB  20-1:5191   5.50    (#   5191:20  Double Ambig)
 &rst
  ixpk= 5191, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2378,2383,2174,
 igr2=2167,2168,2167,2168,
 &end
#
#  138 SER  HN          137 VAL  HB          2.60    (#   5192:20  Unique         2.38, 3.79 A)
 &rst
  ixpk= 5192, nxpk= 20, iat=2263,2251, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  137 VAL  MGX         138 SER  HB+         4.40    (#   5195:20  Unique         3.30, 6.13 A)
 &rst
  ixpk= 5195, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2253,2254,2255,2257,2258,2259,
 igr2=2267,2268,
 &end
#
#  141 ARG  HB+         141 ARG  HD+         3.50    (#   5197:20  Unique         1.96, 3.11 A)
 &rst
  ixpk= 5197, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2320,2321,
 igr2=2326,2327,
 &end
#
#  141 ARG  HN          141 ARG  HD+         4.40    (#   5198:20  Unique         3.94, 4.84 A)
 &rst
  ixpk= 5198, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2326,2327,
 &end
#
#  143 VAL  MGX         143 VAL  HA          2.60    (#   5199:20  Unique         2.38, 3.53 A)
 &rst
  ixpk= 5199, nxpk= 20, iat=  -1,2354, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#  141 ARG  HD+         138 SER  HA          3.50    (#   5202:20  Unique         2.04, 4.10 A)
 &rst
  ixpk= 5202, nxpk= 20, iat=  -1,2265, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2326,2327,
 &end
#
#  149 LYS  HB+         146 ARG  HA          3.50    (#   5203:20  Unique         1.98, 2.67 A)
 &rst
  ixpk= 5203, nxpk= 20, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2474,2475,
 &end
#
#  146 ARG  HA          146 ARG  HG+         4.40    (#   5204:20  Unique         2.09, 2.86 A)
 &rst
  ixpk= 5204, nxpk= 20, iat=2415,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2420,2421,
 &end
#
#  146 ARG  HA          146 ARG  HG-         3.50    (#   5205:20  Unique         2.09, 2.86 A)
 &rst
  ixpk= 5205, nxpk= 20, iat=2415,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2420,2421,
 &end
#
#    0 AMB  20-2:5206     0 AMB  20-1:5206   3.50    (#   5206:20  Double Ambig)
 &rst
  ixpk= 5206, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2464,2465,2466,2221,2222,
 igr2=2457,2458,2194,2195,
 &end
#
#  149 LYS  HA          149 LYS  HD+         4.40    (#   5210:20  Unique         2.19, 4.05 A)
 &rst
  ixpk= 5210, nxpk= 20, iat=2472,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2480,2481,
 &end
#
#  151 PHE  HN          150 GLU  HB-         4.40    (#   5211:20  Unique         2.63, 3.23 A)
 &rst
  ixpk= 5211, nxpk= 20, iat=2507,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2496,2497,
 &end
#
#  151 PHE  HN          150 GLU  HB+         4.40    (#   5212:20  Unique         2.63, 3.23 A)
 &rst
  ixpk= 5212, nxpk= 20, iat=2507,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2496,2497,
 &end
#
#  150 GLU  HA          150 GLU  HG+         2.60    (#   5213:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 5213, nxpk= 20, iat=2494,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=2499,2500,
 &end
#
#    0 AMB  20-2:5214   152 ALA  MB          3.50    (#   5214:20  Single Ambig)
 &rst
  ixpk= 5214, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2474,2475,2584,2585,2499,2500,
 igr2=2531,2532,2533,
 &end
#
#  154 VAL  HN          152 ALA  MB          4.40    (#   5215:20  Unique         5.24, 5.64 A)
 &rst
  ixpk= 5215, nxpk= 20, iat=2548,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=2531,2532,2533,
 &end
#
#   95 GLN  HA            0 AMB  20-1:5216   5.50    (#   5216:20  Single Ambig)
 &rst
  ixpk= 5216, nxpk= 20, iat=1545,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr2= 108, 109, 108, 109,
 &end
#
#  155 VAL  HN          154 VAL  HB          2.60    (#   5217:20  Unique         2.36, 2.73 A)
 &rst
  ixpk= 5217, nxpk= 20, iat=2564,2552, r1= 0.00, r2= 1.80, r3= 2.60, r4= 3.35,  &end
#
#  101 LEU  HB-         154 VAL  MGX         5.50    (#   5218:20  Unique         3.14, 5.83 A)
 &rst
  ixpk= 5218, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1669,1670,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#  158 LEU  HB-         154 VAL  MGY         2.60    (#   5219:20  Unique         2.71, 5.85 A)
 &rst
  ixpk= 5219, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2612,2613,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:5220   154 VAL  MGY         2.60    (#   5220:20  Single Ambig)
 &rst
  ixpk= 5220, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2612,2613,1707,1708,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:5221   154 VAL  MGY         2.60    (#   5221:20  Single Ambig)
 &rst
  ixpk= 5221, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1087,1088,1089,1068,1069,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#   68 LEU  HB-         154 VAL  MGY         2.60    (#   5222:20  Unique         2.00, 3.71 A)
 &rst
  ixpk= 5222, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1068,1069,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#  151 PHE  HA          154 VAL  MGY         5.50    (#   5223:20  Unique         2.16, 4.83 A)
 &rst
  ixpk= 5223, nxpk= 20, iat=2509,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  20-2:5224   155 VAL  HA          4.40    (#   5224:20  Single Ambig)
 &rst
  ixpk= 5224, nxpk= 20, iat=  -1,2566, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2627,2597,
 &end
#
#  101 LEU  MDX         155 VAL  MGY         2.60    (#   5225:20  Unique         3.02, 6.76 A)
 &rst
  ixpk= 5225, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#   20 GLY  HA-         155 VAL  MGY         3.50    (#   5226:20  Unique         2.00, 4.17 A)
 &rst
  ixpk= 5226, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 301, 302,
 igr2=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  20-2:5227     0 AMB  20-1:5227   3.50    (#   5227:20  Double Ambig)
 &rst
  ixpk= 5227, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 793, 794,2568,2612,2613,
 igr2= 812,2582,
 &end
#
#  156 MET  HG-         156 MET  ME          3.50    (#   5228:20  Unique         2.15, 3.33 A)
 &rst
  ixpk= 5228, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2587,2588,
 igr2=2591,2592,2593,
 &end
#
#  156 MET  HG+         156 MET  ME          3.50    (#   5229:20  Unique         2.15, 3.33 A)
 &rst
  ixpk= 5229, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2587,2588,
 igr2=2591,2592,2593,
 &end
#
#    0 AMB  20-2:5230   156 MET  ME          4.40    (#   5230:20  Single Ambig)
 &rst
  ixpk= 5230, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=2128,2564,
 igr2=2591,2592,2593,
 &end
#
#    0 AMB  20-2:5231   157 SER  HA          3.50    (#   5231:20  Single Ambig)
 &rst
  ixpk= 5231, nxpk= 20, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2668,2669,2597,
 &end
#
#  158 LEU  MDX         158 LEU  HA          2.60    (#   5233:20  Unique         2.10, 3.92 A)
 &rst
  ixpk= 5233, nxpk= 20, iat=  -1,2610, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:5234   158 LEU  HB-         2.60    (#   5234:20  Single Ambig)
 &rst
  ixpk= 5234, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.42, r4= 5.17,
 igr1=2617,2618,2619,2621,2622,2623,2554,2555,2556,2558,
      2559,2560,
 igr2=2612,2613,
 &end
#
#  162 THR  MG2           0 AMB  20-1:5236   5.50    (#   5236:20  Single Ambig)
 &rst
  ixpk= 5236, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2679,2680,2681,
 igr2=2629,2646,
 &end
#
#  161 ASN  HN          159 GLN  HA          4.40    (#   5237:20  Unique         4.13, 4.35 A)
 &rst
  ixpk= 5237, nxpk= 20, iat=2659,2629, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  130 TRP  HH2         148 MET  HA          5.50    (#   5238:20  Unique         8.51,11.87 A)
 &rst
  ixpk= 5238, nxpk= 20, iat=2130,2455, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:5239     0 AMB  20-1:5239   2.60    (#   5239:20  Double Ambig)
 &rst
  ixpk= 5239, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2631,2632,2631,2632,
 igr2=2634,2635,2634,2635,
 &end
#
#    0 AMB  20-2:5240     0 AMB  20-1:5240   2.60    (#   5240:20  Double Ambig)
 &rst
  ixpk= 5240, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=2631,2632,2631,2632,
 igr2=2634,2635,2634,2635,
 &end
#
#  155 VAL  HA          159 GLN  HG+         5.50    (#   5241:20  Unique         4.53, 5.97 A)
 &rst
  ixpk= 5241, nxpk= 20, iat=2566,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2634,2635,
 &end
#
#  110 GLU  HN          110 GLU  HG-         3.50    (#   5242:20  Unique         1.97, 3.36 A)
 &rst
  ixpk= 5242, nxpk= 20, iat=1795,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1802,1803,
 &end
#
#    0 AMB  20-2:5243     0 AMB  20-1:5243   5.50    (#   5243:20  Double Ambig)
 &rst
  ixpk= 5243, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2705,2706, 262, 263, 286, 287,
 igr2=2651,2652,2651,2652,2651,2652,
 &end
#
#    0 AMB  20-2:5244   162 THR  MG2         5.50    (#   5244:20  Single Ambig)
 &rst
  ixpk= 5244, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2644, 258,
 igr2=2679,2680,2681,
 &end
#
#    8 ARG  HA            0 AMB  20-1:5248   4.40    (#   5248:20  Single Ambig)
 &rst
  ixpk= 5248, nxpk= 20, iat= 106,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr2= 108, 109, 108, 109,
 &end
#
#  163 PRO  HG+         163 PRO  HB+         2.60    (#   5249:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 5249, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2691,2692,
 igr2=2694,2695,
 &end
#
#  163 PRO  HG+         163 PRO  HB-         2.60    (#   5250:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 5250, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2691,2692,
 igr2=2694,2695,
 &end
#
#  164 LYS  HN          163 PRO  HB-         4.40    (#   5251:20  Unique         2.11, 3.42 A)
 &rst
  ixpk= 5251, nxpk= 20, iat=2701,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=2694,2695,
 &end
#
#   78 LYS  HN            0 AMB  20-1:5253   5.50    (#   5253:20  Single Ambig)
 &rst
  ixpk= 5253, nxpk= 20, iat=1244,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr2=1257,1258,2307,2308,
 &end
#
#  144 TYR  HD          140 LYS  HE+         5.50    (#   5254:20  Unique         4.83, 8.09 A)
 &rst
  ixpk= 5254, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2376,2385,
 igr2=2307,2308,
 &end
#
#  118 THR  HN          119 PRO  HA          5.50    (#   5255:20  Unique         4.92, 4.95 A)
 &rst
  ixpk= 5255, nxpk= 20, iat=1913,1937, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  MDY         101 LEU  HB-         5.50    (#   5256:20  Unique         1.98, 3.36 A)
 &rst
  ixpk= 5256, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=1669,1670,
 &end
#
#    0 AMB  20-2:5257   101 LEU  HB-         5.50    (#   5257:20  Single Ambig)
 &rst
  ixpk= 5257, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 329, 330, 331, 333, 334, 335,1011,1012,1013,1015,
      1016,1017,
 igr2=1669,1670,
 &end
#
#   69 ALA  MB          101 LEU  HB-         5.50    (#   5258:20  Unique         1.98, 4.28 A)
 &rst
  ixpk= 5258, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1087,1088,1089,
 igr2=1669,1670,
 &end
#
#  101 LEU  MDX         101 LEU  HB-         4.40    (#   5259:20  Unique         1.98, 3.36 A)
 &rst
  ixpk= 5259, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1674,1675,1676,1678,1679,1680,
 igr2=1669,1670,
 &end
#
#    0 AMB  20-2:5261     0 AMB  20-1:5261   2.60    (#   5261:20  Double Ambig)
 &rst
  ixpk= 5261, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1306,1307,1931,1932,1368,
 igr2=1303,1304,1934,1935,1303,1304,
 &end
#
#    0 AMB  20-2:5262     0 AMB  20-1:5262   2.60    (#   5262:20  Double Ambig)
 &rst
  ixpk= 5262, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1309,1310,2477,2478, 814, 815,1931,1932, 793, 794,
      
 igr2=1303,1304,2474,2475, 817, 818,1934,1935,
 &end
#
#  120 GLU  HN          119 PRO  HB-         3.50    (#   5263:20  Unique         2.72, 3.55 A)
 &rst
  ixpk= 5263, nxpk= 20, iat=1941,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1934,1935,
 &end
#
#   38 GLY  HA+          53 GLU  HB+         3.50    (#   5264:20  Unique         1.99, 4.33 A)
 &rst
  ixpk= 5264, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 604, 605,
 igr2= 814, 815,
 &end
#
#  119 PRO  HD+         119 PRO  HG+         2.60    (#   5265:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5265, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1928,1929,
 igr2=1931,1932,
 &end
#
#   82 ARG  HD+          82 ARG  HG+         2.60    (#   5266:20  Unique         2.22, 2.62 A)
 &rst
  ixpk= 5266, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1331,1332,
 igr2=1328,1329,
 &end
#
#  119 PRO  HB-         119 PRO  HG+         3.50    (#   5267:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 5267, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1934,1935,
 igr2=1931,1932,
 &end
#
#    0 AMB  20-2:5268     0 AMB  20-1:5268   3.50    (#   5268:20  Double Ambig)
 &rst
  ixpk= 5268, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1934,1935,2393,2394,
 igr2=1931,1932,2323,2324,
 &end
#
#    0 AMB  20-2:5269     0 AMB  20-1:5269   2.60    (#   5269:20  Double Ambig)
 &rst
  ixpk= 5269, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 817, 818,1934,1935, 868, 869,
 igr2= 814, 815,1931,1932, 814, 815,
 &end
#
#   80 PRO  HD-          80 PRO  HG-         2.60    (#   5270:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5270, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1286,1287,
 igr2=1289,1290,
 &end
#
#   80 PRO  HD-          80 PRO  HG+         3.50    (#   5271:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5271, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1286,1287,
 igr2=1289,1290,
 &end
#
#   80 PRO  HD+          80 PRO  HG+         4.40    (#   5272:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5272, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1286,1287,
 igr2=1289,1290,
 &end
#
#   80 PRO  HD+          80 PRO  HG-         3.50    (#   5273:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5273, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1286,1287,
 igr2=1289,1290,
 &end
#
#    0 AMB  20-2:5274    80 PRO  HD-         5.50    (#   5274:20  Single Ambig)
 &rst
  ixpk= 5274, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1295,1347,
 igr2=1286,1287,
 &end
#
#   80 PRO  HB+          80 PRO  HD-         5.50    (#   5275:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 5275, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1292,1293,
 igr2=1286,1287,
 &end
#
#   80 PRO  HB+          80 PRO  HD+         5.50    (#   5276:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 5276, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1292,1293,
 igr2=1286,1287,
 &end
#
#    0 AMB  20-2:5277    80 PRO  HD-         3.50    (#   5277:20  Single Ambig)
 &rst
  ixpk= 5277, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1349,1350,1292,1293,
 igr2=1286,1287,
 &end
#
#   80 PRO  HG+          80 PRO  HD-         4.40    (#   5278:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5278, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1289,1290,
 igr2=1286,1287,
 &end
#
#   80 PRO  HG+          80 PRO  HD+         3.50    (#   5279:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5279, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1289,1290,
 igr2=1286,1287,
 &end
#
#  139 PHE  HB+         138 SER  HB-         5.50    (#   5280:20  Unique         4.14, 6.25 A)
 &rst
  ixpk= 5280, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2278,2279,
 igr2=2267,2268,
 &end
#
#    0 AMB  20-2:5282     0 AMB  20-1:5282   5.50    (#   5282:20  Double Ambig)
 &rst
  ixpk= 5282, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.14, r4= 9.89,
 igr1=2194,2195,2071,2323,2324,2320,2321,
 igr2=2141,2267,2268,
 &end
#
#  140 LYS  HG+         140 LYS  HD-         2.60    (#   5283:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 5283, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=2301,2302,
 igr2=2304,2305,
 &end
#
#    0 AMB  20-2:5284     0 AMB  20-1:5284   3.50    (#   5284:20  Double Ambig)
 &rst
  ixpk= 5284, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.58, r4= 7.33,
 igr1=2301,2302, 220, 221, 222,2253,2254,2255,2257,2258,
      2259,
 igr2=2304,2305, 224, 225,
 &end
#
#    0 AMB  20-2:5285     0 AMB  20-1:5285   4.40    (#   5285:20  Double Ambig)
 &rst
  ixpk= 5285, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.71, r4= 9.46,
 igr1=2301,2302,2253,2254,2255,2257,2258,2259, 954, 955,
      
 igr2=2304,2305,2304,2305, 951, 952,
 &end
#
#  140 LYS  HE-         140 LYS  HD-         5.50    (#   5287:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 5287, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2307,2308,
 igr2=2304,2305,
 &end
#
#  140 LYS  HE+         140 LYS  HD-         4.40    (#   5288:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 5288, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2307,2308,
 igr2=2304,2305,
 &end
#
#    0 AMB  20-2:5289     0 AMB  20-1:5289   2.60    (#   5289:20  Double Ambig)
 &rst
  ixpk= 5289, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.20, r4= 5.95,
 igr1=2477,2478,1306,1307,2304,2305, 981, 982,
 igr2=2483,2484,1312,1313,2307,2308, 984, 985,
 &end
#
#  140 LYS  HD-         140 LYS  HG+         3.50    (#   5290:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 5290, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2304,2305,
 igr2=2301,2302,
 &end
#
#    0 AMB  20-2:5291     0 AMB  20-1:5291   5.50    (#   5291:20  Double Ambig)
 &rst
  ixpk= 5291, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.80, r4=10.55,
 igr1=2301,2302,2253,2254,2255,2257,2258,2259,
 igr2=2307,2308,2307,2308,
 &end
#
#  140 LYS  HG-         140 LYS  HA          5.50    (#   5292:20  Unique         2.03, 2.89 A)
 &rst
  ixpk= 5292, nxpk= 20, iat=  -1,2296, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2301,2302,
 &end
#
#   52 ARG  HN           52 ARG  HB-         5.50    (#   5293:20  Unique         2.07, 2.58 A)
 &rst
  ixpk= 5293, nxpk= 20, iat= 786,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 790, 791,
 &end
#
#   52 ARG  HG-          52 ARG  HB+         2.60    (#   5294:20  Unique         2.21, 2.71 A)
 &rst
  ixpk= 5294, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 793, 794,
 igr2= 790, 791,
 &end
#
#   52 ARG  HB-          52 ARG  HD+         4.40    (#   5295:20  Unique         1.99, 3.24 A)
 &rst
  ixpk= 5295, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 790, 791,
 igr2= 796, 797,
 &end
#
#  134 ARG  HE          134 ARG  HD+         3.50    (#   5297:20  Unique         2.28, 2.74 A)
 &rst
  ixpk= 5297, nxpk= 20, iat=2203,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2200,2201,
 &end
#
#   53 GLU  HA           57 GLU  HG-         5.50    (#   5298:20  Unique         3.78, 5.00 A)
 &rst
  ixpk= 5298, nxpk= 20, iat= 812,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 886, 887,
 &end
#
#    0 AMB  20-2:5299    57 GLU  HG-         5.50    (#   5299:20  Single Ambig)
 &rst
  ixpk= 5299, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 817, 818, 868, 869,
 igr2= 886, 887,
 &end
#
#   57 GLU  HG+          57 GLU  HB-         3.50    (#   5301:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 5301, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 886, 887,
 igr2= 883, 884,
 &end
#
#  121 PHE  HE           57 GLU  HB-         5.50    (#   5302:20  Unique         2.89, 5.42 A)
 &rst
  ixpk= 5302, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1966,1970,
 igr2= 883, 884,
 &end
#
#   57 GLU  HN           57 GLU  HB-         5.50    (#   5303:20  Unique         2.31, 3.11 A)
 &rst
  ixpk= 5303, nxpk= 20, iat= 879,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 883, 884,
 &end
#
#  147 VAL  MGX         148 MET  HG+         5.50    (#   5304:20  Unique         2.12, 5.16 A)
 &rst
  ixpk= 5304, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2443,2444,2445,2447,2448,2449,
 igr2=2460,2461,
 &end
#
#    0 AMB  20-2:5305   148 MET  HA          5.50    (#   5305:20  Single Ambig)
 &rst
  ixpk= 5305, nxpk= 20, iat=  -1,2455, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2460,2461,2098,2099,
 &end
#
#  148 MET  HA          148 MET  HG+         3.50    (#   5306:20  Unique         2.29, 3.36 A)
 &rst
  ixpk= 5306, nxpk= 20, iat=2455,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2460,2461,
 &end
#
#  148 MET  ME          148 MET  HG-         3.50    (#   5307:20  Unique         2.38, 3.71 A)
 &rst
  ixpk= 5307, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2464,2465,2466,
 igr2=2460,2461,
 &end
#
#  148 MET  HB-         148 MET  HG-         5.50    (#   5308:20  Unique         2.20, 2.59 A)
 &rst
  ixpk= 5308, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2457,2458,
 igr2=2460,2461,
 &end
#
#  133 VAL  MGY         148 MET  HG-         2.60    (#   5309:20  Unique         1.99, 4.42 A)
 &rst
  ixpk= 5309, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2180,2181,2182,2184,2185,2186,
 igr2=2460,2461,
 &end
#
#  148 MET  HG-         148 MET  HB-         5.50    (#   5311:20  Unique         2.20, 2.59 A)
 &rst
  ixpk= 5311, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2460,2461,
 igr2=2457,2458,
 &end
#
#    0 AMB  20-2:5312     0 AMB  20-1:5312   4.40    (#   5312:20  Double Ambig)
 &rst
  ixpk= 5312, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 129, 130,2267,2268,
 igr2= 135, 136,2251,
 &end
#
#   80 PRO  HG+          80 PRO  HB-         2.60    (#   5313:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 5313, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1289,1290,
 igr2=1292,1293,
 &end
#
#   81 LYS  HE+          81 LYS  HB-         5.50    (#   5314:20  Unique         1.92, 3.05 A)
 &rst
  ixpk= 5314, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1312,1313,
 igr2=1303,1304,
 &end
#
#   84 VAL  MGY          81 LYS  HB-         3.50    (#   5315:20  Unique         4.10, 6.32 A)
 &rst
  ixpk= 5315, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1370,1371,1372,1374,1375,1376,
 igr2=1303,1304,
 &end
#
#    0 AMB  20-2:5316     0 AMB  20-1:5316   2.60    (#   5316:20  Double Ambig)
 &rst
  ixpk= 5316, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2483,2484,1312,1313, 796, 797,
 igr2=2477,2478,1306,1307, 793, 794,
 &end
#
#   81 LYS  HB+          81 LYS  HG+         2.60    (#   5317:20  Unique         2.21, 2.67 A)
 &rst
  ixpk= 5317, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1303,1304,
 igr2=1306,1307,
 &end
#
#   81 LYS  HB-          81 LYS  HG+         2.60    (#   5318:20  Unique         2.21, 2.67 A)
 &rst
  ixpk= 5318, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1303,1304,
 igr2=1306,1307,
 &end
#
#    0 AMB  20-2:5319    81 LYS  HG-         3.50    (#   5319:20  Single Ambig)
 &rst
  ixpk= 5319, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1303,1304,1325,1326,
 igr2=1306,1307,
 &end
#
#    0 AMB  20-2:5320     0 AMB  20-1:5320   2.60    (#   5320:20  Double Ambig)
 &rst
  ixpk= 5320, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1306,1307,1328,1329,
 igr2=1309,1310,1309,1310,
 &end
#
#    0 AMB  20-2:5321     0 AMB  20-1:5321   2.60    (#   5321:20  Double Ambig)
 &rst
  ixpk= 5321, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1306,1307,1292,1293,
 igr2=1309,1310,1309,1310,
 &end
#
#   76 ARG  HD+          78 LYS  HD+         4.40    (#   5322:20  Unique         2.74, 4.80 A)
 &rst
  ixpk= 5322, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1209,1210,
 igr2=1254,1255,
 &end
#
#    7 TYR  HE           76 ARG  HG+         5.50    (#   5323:20  Unique         2.84, 7.68 A)
 &rst
  ixpk= 5323, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  93,  98,
 igr2=1206,1207,
 &end
#
#   76 ARG  HA           76 ARG  HG+         5.50    (#   5324:20  Unique         2.35, 3.74 A)
 &rst
  ixpk= 5324, nxpk= 20, iat=1201,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1206,1207,
 &end
#
#   76 ARG  HB+          76 ARG  HG+         2.60    (#   5325:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 5325, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1203,1204,
 igr2=1206,1207,
 &end
#
#   76 ARG  HG+          76 ARG  HD+         4.40    (#   5326:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 5326, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1206,1207,
 igr2=1209,1210,
 &end
#
#   27 ARG  HG+          27 ARG  HA          5.50    (#   5327:20  Unique         2.33, 3.69 A)
 &rst
  ixpk= 5327, nxpk= 20, iat=  -1, 416, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 421, 422,
 &end
#
#    0 AMB  20-2:5330     0 AMB  20-1:5330   4.40    (#   5330:20  Double Ambig)
 &rst
  ixpk= 5330, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.71, r4= 9.46,
 igr1=2358,2359,2360,2362,2363,2364,1945,1946,1603,1604,
      
 igr2=1206,1207, 421, 422,1206,1207,
 &end
#
#    0 AMB  20-2:5331     0 AMB  20-1:5331   2.60    (#   5331:20  Double Ambig)
 &rst
  ixpk= 5331, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1= 418, 419,1203,1204,
 igr2= 421, 422,1206,1207,
 &end
#
#   27 ARG  HD-          27 ARG  HG+         3.50    (#   5333:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 5333, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 424, 425,
 igr2= 421, 422,
 &end
#
#   27 ARG  HG+          27 ARG  HD+         3.50    (#   5334:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 5334, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 421, 422,
 igr2= 424, 425,
 &end
#
#   27 ARG  HG-          27 ARG  HD+         2.60    (#   5336:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 5336, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 421, 422,
 igr2= 424, 425,
 &end
#
#   27 ARG  HG-          27 ARG  HD-         3.50    (#   5337:20  Unique         2.22, 2.71 A)
 &rst
  ixpk= 5337, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 421, 422,
 igr2= 424, 425,
 &end
#
#   27 ARG  HA           27 ARG  HD-         5.50    (#   5338:20  Unique         2.22, 4.57 A)
 &rst
  ixpk= 5338, nxpk= 20, iat= 416,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 424, 425,
 &end
#
#   15 ILE  HG1+         15 ILE  QG2         2.60    (#   5340:20  Unique         2.24, 3.45 A)
 &rst
  ixpk= 5340, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr1= 224, 225,
 igr2= 220, 221, 222,
 &end
#
#    0 AMB  20-2:5341    15 ILE  QG2         4.40    (#   5341:20  Single Ambig)
 &rst
  ixpk= 5341, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=1691, 924, 248, 249,
 igr2= 220, 221, 222,
 &end
#
#    0 AMB  20-2:5343     0 AMB  20-1:5343   5.50    (#   5343:20  Double Ambig)
 &rst
  ixpk= 5343, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.06, r4= 9.81,
 igr1=1251,1252, 924, 248, 249,1727, 921, 922,  31,  32,
      
 igr2=1521, 218,
 &end
#
#    0 AMB  20-2:5345    15 ILE  HG1-        2.60    (#   5345:20  Single Ambig)
 &rst
  ixpk= 5345, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.21, r4= 4.96,
 igr1= 220, 221, 222,1011,1012,1013,1015,1016,1017,
 igr2= 224, 225,
 &end
#
#   15 ILE  HB           15 ILE  HG1-        4.40    (#   5346:20  Unique         2.37, 2.46 A)
 &rst
  ixpk= 5346, nxpk= 20, iat= 218,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 224, 225,
 &end
#
#    0 AMB  20-2:5347     0 AMB  20-1:5347   2.60    (#   5347:20  Double Ambig)
 &rst
  ixpk= 5347, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.28, r4= 5.03,
 igr1= 975, 976, 975, 976, 218,
 igr2= 981, 982, 224, 225,
 &end
#
#    0 AMB  20-2:5348    15 ILE  HA          3.50    (#   5348:20  Single Ambig)
 &rst
  ixpk= 5348, nxpk= 20, iat=  -1, 216, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 227, 228, 229, 224, 225,
 &end
#
#    0 AMB  20-2:5349    15 ILE  HA          3.50    (#   5349:20  Single Ambig)
 &rst
  ixpk= 5349, nxpk= 20, iat=  -1, 216, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 220, 221, 222,1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  20-2:5350    15 ILE  QD1         2.60    (#   5350:20  Single Ambig)
 &rst
  ixpk= 5350, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,
 igr1= 220, 221, 222,1011,1012,1013,1015,1016,1017,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:5351    15 ILE  QD1         3.50    (#   5351:20  Single Ambig)
 &rst
  ixpk= 5351, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.60, r4= 7.35,
 igr1=1674,1675,1676,1678,1679,1680, 204, 205, 206, 208,
       209, 210, 759, 760, 761,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:5352    15 ILE  QD1         2.60    (#   5352:20  Single Ambig)
 &rst
  ixpk= 5352, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.27, r4= 6.02,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932, 192, 193, 194,1674,1675,1676,1678,1679,
      1680, 189, 190,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:5353   156 MET  ME          2.60    (#   5353:20  Single Ambig)
 &rst
  ixpk= 5353, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2568,2531,2532,2533,
 igr2=2591,2592,2593,
 &end
#
#    0 AMB  20-2:5354     1 MET  ME          5.50    (#   5354:20  Single Ambig)
 &rst
  ixpk= 5354, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.64, r4= 9.39,
 igr1=  27,  28,  29,1567,1568,
 igr2=  15,  16,  17,
 &end
#
#    2 ILE  HG1-          1 MET  ME          5.50    (#   5355:20  Unique         4.51, 6.31 A)
 &rst
  ixpk= 5355, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=  31,  32,
 igr2=  15,  16,  17,
 &end
#
#    0 AMB  20-2:5356   148 MET  ME          5.50    (#   5356:20  Single Ambig)
 &rst
  ixpk= 5356, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1= 202,2474,2475,
 igr2=2464,2465,2466,
 &end
#
#  147 VAL  HB          148 MET  ME          4.40    (#   5357:20  Unique         5.77, 7.38 A)
 &rst
  ixpk= 5357, nxpk= 20, iat=2441,  -1, r1= 0.00, r2= 1.80, r3= 5.28, r4= 6.03,
 igr2=2464,2465,2466,
 &end
#
#   58 VAL  HB           23 MET  ME          5.50    (#   5359:20  Unique         2.01, 4.52 A)
 &rst
  ixpk= 5359, nxpk= 20, iat= 898,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:5360    23 MET  ME          5.50    (#   5360:20  Single Ambig)
 &rst
  ixpk= 5360, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1724,1725,1799,1800,
 igr2= 350, 351, 352,
 &end
#
#   23 MET  HB+          23 MET  ME          3.50    (#   5361:20  Unique         2.15, 3.91 A)
 &rst
  ixpk= 5361, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 343, 344,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:5363    23 MET  ME          5.50    (#   5363:20  Single Ambig)
 &rst
  ixpk= 5363, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 341, 358,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:5366    50 MET  ME          3.50    (#   5366:20  Single Ambig)
 &rst
  ixpk= 5366, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 755, 756, 700, 701, 702,
 igr2= 759, 760, 761,
 &end
#
#  151 PHE  HD          101 LEU  HB-         5.50    (#   5367:20  Unique         2.55, 3.73 A)
 &rst
  ixpk= 5367, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2515,2523,
 igr2=1669,1670,
 &end
#
#  140 LYS  HD-         140 LYS  HG-         3.50    (#   5370:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 5370, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2304,2305,
 igr2=2301,2302,
 &end
#
#  113 MET  ME          124 TRP  HB-         5.50    (#   5372:20  Unique         2.83, 4.60 A)
 &rst
  ixpk= 5372, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1854,1855,1856,
 igr2=1999,2000,
 &end
#
#  124 TRP  HN          124 TRP  HB-         5.50    (#   5373:20  Unique         2.26, 3.25 A)
 &rst
  ixpk= 5373, nxpk= 20, iat=1995,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1999,2000,
 &end
#
#    0 AMB  20-2:5375     0 AMB  20-1:5375   4.40    (#   5375:20  Double Ambig)
 &rst
  ixpk= 5375, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.42, r4=10.17,
 igr1=1693,1694,1695,1697,1698,1699,  34,  35,  36,1058,
      1059,1060,
 igr2=1025,1026,1458,1459,1458,1459,1025,1026,
 &end
#
#   66 ARG  HG+          66 ARG  HB+         2.60    (#   5376:20  Unique         2.26, 2.61 A)
 &rst
  ixpk= 5376, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1028,1029,
 igr2=1025,1026,
 &end
#
#   66 ARG  HN           66 ARG  HB+         4.40    (#   5377:20  Unique         2.98, 3.49 A)
 &rst
  ixpk= 5377, nxpk= 20, iat=1021,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1025,1026,
 &end
#
#   21 GLN  HN           21 GLN  HG+         3.50    (#   5378:20  Unique         1.94, 3.20 A)
 &rst
  ixpk= 5378, nxpk= 20, iat= 306,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 313, 314,
 &end
#
#   21 GLN  HA           21 GLN  HG+         3.50    (#   5379:20  Unique         2.30, 3.18 A)
 &rst
  ixpk= 5379, nxpk= 20, iat= 308,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 313, 314,
 &end
#
#   17 ASN  HD2-         21 GLN  HG+         5.50    (#   5380:20  Unique         1.95, 3.97 A)
 &rst
  ixpk= 5380, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 253, 254,
 igr2= 313, 314,
 &end
#
#   17 ASN  HD2-         21 GLN  HG-         5.50    (#   5381:20  Unique         1.95, 3.97 A)
 &rst
  ixpk= 5381, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 253, 254,
 igr2= 313, 314,
 &end
#
#   17 ASN  HD2+         21 GLN  HG-         5.50    (#   5382:20  Unique         1.95, 3.97 A)
 &rst
  ixpk= 5382, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 253, 254,
 igr2= 313, 314,
 &end
#
#   27 ARG  HN           27 ARG  HB+         5.50    (#   5384:20  Unique         2.13, 3.03 A)
 &rst
  ixpk= 5384, nxpk= 20, iat= 414,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 418, 419,
 &end
#
#   27 ARG  HA           27 ARG  HB+         5.50    (#   5385:20  Unique         2.29, 2.49 A)
 &rst
  ixpk= 5385, nxpk= 20, iat= 416,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 418, 419,
 &end
#
#    0 AMB  20-2:5386     0 AMB  20-1:5386   5.50    (#   5386:20  Double Ambig)
 &rst
  ixpk= 5386, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 472, 473, 883, 884,
 igr2= 418, 419, 418, 419,
 &end
#
#   64 ASP  HN           63 LYS  HG+         4.40    (#   5388:20  Unique         2.25, 3.54 A)
 &rst
  ixpk= 5388, nxpk= 20, iat= 993,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 978, 979,
 &end
#
#   64 ASP  HN           63 LYS  HG-         4.40    (#   5389:20  Unique         2.25, 3.54 A)
 &rst
  ixpk= 5389, nxpk= 20, iat= 993,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 978, 979,
 &end
#
#    0 AMB  20-2:5390    63 LYS  HD-         3.50    (#   5390:20  Single Ambig)
 &rst
  ixpk= 5390, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 978, 979, 978, 979,
 igr2= 981, 982,
 &end
#
#    0 AMB  20-2:5391     0 AMB  20-1:5391   2.60    (#   5391:20  Double Ambig)
 &rst
  ixpk= 5391, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 975, 976, 218,1480,1481,
 igr2= 981, 982, 224, 225,1464,1465,
 &end
#
#   63 LYS  HA           63 LYS  HD-         5.50    (#   5392:20  Unique         3.72, 4.21 A)
 &rst
  ixpk= 5392, nxpk= 20, iat= 973,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 981, 982,
 &end
#
#   97 GLN  HG+          97 GLN  HB-         2.60    (#   5393:20  Unique         2.21, 2.67 A)
 &rst
  ixpk= 5393, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1589,1590,
 igr2=1586,1587,
 &end
#
#   97 GLN  HB-          97 GLN  HG+         2.60    (#   5394:20  Unique         2.21, 2.67 A)
 &rst
  ixpk= 5394, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1586,1587,
 igr2=1589,1590,
 &end
#
#   10 ASN  HD2+         97 GLN  HG+         4.40    (#   5396:20  Unique         4.81, 6.35 A)
 &rst
  ixpk= 5396, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 151, 152,
 igr2=1589,1590,
 &end
#
#    0 AMB  20-2:5397     0 AMB  20-1:5397   3.50    (#   5397:20  Double Ambig)
 &rst
  ixpk= 5397, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1594,1595,1594,1595,1594,1595,1555,1556,
 igr2=1586,1587,1589,1590,1550,1551,
 &end
#
#   97 GLN  HB-          97 GLN  HG-         2.60    (#   5398:20  Unique         2.21, 2.67 A)
 &rst
  ixpk= 5398, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1586,1587,
 igr2=1589,1590,
 &end
#
#  114 GLN  HB-         114 GLN  HG-         3.50    (#   5402:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 5402, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1864,1865,
 igr2=1867,1868,
 &end
#
#  103 GLN  HG+         103 GLN  HB-         2.60    (#   5403:20  Unique         2.26, 2.69 A)
 &rst
  ixpk= 5403, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1710,1711,
 igr2=1707,1708,
 &end
#
#   48 GLN  HG+          48 GLN  HA          2.60    (#   5406:20  Unique         2.62, 3.42 A)
 &rst
  ixpk= 5406, nxpk= 20, iat=  -1, 723, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr1= 728, 729,
 &end
#
#   48 GLN  HB+          48 GLN  HA          3.50    (#   5407:20  Unique         2.41, 2.75 A)
 &rst
  ixpk= 5407, nxpk= 20, iat=  -1, 723, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 725, 726,
 &end
#
#   99 TRP  HZ2          97 GLN  HG+         5.50    (#   5408:20  Unique         2.30, 3.57 A)
 &rst
  ixpk= 5408, nxpk= 20, iat=1634,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1589,1590,
 &end
#
#  103 GLN  HB-         103 GLN  HG+         2.60    (#   5409:20  Unique         2.26, 2.69 A)
 &rst
  ixpk= 5409, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1707,1708,
 igr2=1710,1711,
 &end
#
#    0 AMB  20-2:5410     0 AMB  20-1:5410   4.40    (#   5410:20  Double Ambig)
 &rst
  ixpk= 5410, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1= 265, 266,1028,1029,
 igr2=1710,1711,1710,1711,
 &end
#
#    0 AMB  20-2:5411     0 AMB  20-1:5411   3.50    (#   5411:20  Double Ambig)
 &rst
  ixpk= 5411, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=1745,1746,1747,1749,1750,1751,1073,1074,1075,1077,
      1078,1079,2617,2618,2619,2621,2622,2623,
 igr2=1710,1711,1710,1711,1710,1711,
 &end
#
#    0 AMB  20-2:5412     0 AMB  20-1:5412   3.50    (#   5412:20  Double Ambig)
 &rst
  ixpk= 5412, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 919,1246,
 igr2= 924,1251,1252,
 &end
#
#  107 GLY  HN          110 GLU  HB-         4.40    (#   5413:20  Unique         2.66, 4.21 A)
 &rst
  ixpk= 5413, nxpk= 20, iat=1766,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1799,1800,
 &end
#
#  154 VAL  MGX         153 SER  HB+         4.40    (#   5414:20  Unique         3.25, 5.99 A)
 &rst
  ixpk= 5414, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2554,2555,2556,2558,2559,2560,
 igr2=2541,2542,
 &end
#
#  137 VAL  MGY         138 SER  HB-         3.50    (#   5415:20  Unique         3.30, 6.13 A)
 &rst
  ixpk= 5415, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2253,2254,2255,2257,2258,2259,
 igr2=2267,2268,
 &end
#
#  115 THR  HN          114 GLN  HG+         5.50    (#   5417:20  Unique         3.28, 3.90 A)
 &rst
  ixpk= 5417, nxpk= 20, iat=1877,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1867,1868,
 &end
#
#    0 AMB  20-2:5418     0 AMB  20-1:5418   3.50    (#   5418:20  Double Ambig)
 &rst
  ixpk= 5418, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 879,1560,
 igr2= 886, 887,1550,1551,
 &end
#
#  141 ARG  HE          141 ARG  HB-         5.50    (#   5419:20  Unique         2.04, 3.71 A)
 &rst
  ixpk= 5419, nxpk= 20, iat=2329,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2320,2321,
 &end
#
#    0 AMB  20-2:5420    13 ILE  HG1-        2.60    (#   5420:20  Single Ambig)
 &rst
  ixpk= 5420, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1= 755, 756, 829, 830, 183,
 igr2= 189, 190,
 &end
#
#    0 AMB  20-2:5421     0 AMB  20-1:5421   5.50    (#   5421:20  Double Ambig)
 &rst
  ixpk= 5421, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.70, r4=10.45,
 igr1= 755, 756, 829, 830, 183,
 igr2= 189, 190, 189, 190, 189, 190,
 &end
#
#   11 VAL  MGY          13 ILE  QD1         3.50    (#   5422:20  Unique         1.99, 5.70 A)
 &rst
  ixpk= 5422, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:5423     0 AMB  20-1:5423   3.50    (#   5423:20  Double Ambig)
 &rst
  ixpk= 5423, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1= 755, 756,1025,1026, 832,1688,1689,
 igr2= 185, 186, 187,1745,1746,1747,1749,1750,1751,
 &end
#
#    8 ARG  HA            8 ARG  HG+         5.50    (#   5424:20  Unique         2.64, 3.01 A)
 &rst
  ixpk= 5424, nxpk= 20, iat= 106,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 111, 112,
 &end
#
#  118 THR  MG2         119 PRO  HG+         4.40    (#   5425:20  Unique         5.10, 6.48 A)
 &rst
  ixpk= 5425, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=1919,1920,1921,
 igr2=1931,1932,
 &end
#
#   67 ILE  HB           67 ILE  QG2         3.50    (#   5426:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 5426, nxpk= 20, iat=1049,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1051,1052,1053,
 &end
#
#   56 GLU  HB+          56 GLU  HA          3.50    (#   5427:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 5427, nxpk= 20, iat=  -1, 866, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 868, 869,
 &end
#
#  146 ARG  HA          146 ARG  HG+         3.50    (#   5428:20  Unique         2.09, 2.86 A)
 &rst
  ixpk= 5428, nxpk= 20, iat=2415,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2420,2421,
 &end
#
#  104 LEU  HN          104 LEU  HA          3.50    (#   5429:20  Unique         2.80, 2.85 A)
 &rst
  ixpk= 5429, nxpk= 20, iat=1720,1722, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   79 LEU  HN           78 LYS  HA          3.50    (#   5430:20  Unique         2.14, 2.22 A)
 &rst
  ixpk= 5430, nxpk= 20, iat=1266,1246, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   94 GLY  HA-          78 LYS  HA          3.50    (#   5432:20  Unique         2.99, 3.53 A)
 &rst
  ixpk= 5432, nxpk= 20, iat=  -1,1246, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1538,1539,
 &end
#
#   38 GLY  HN           37 GLN  HB-         5.50    (#   5433:20  Unique         2.37, 3.35 A)
 &rst
  ixpk= 5433, nxpk= 20, iat= 602,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 589, 590,
 &end
#
#  115 THR  HB          115 THR  MG2         2.60    (#   5434:20  Unique         2.25, 2.64 A)
 &rst
  ixpk= 5434, nxpk= 20, iat=1881,  -1, r1= 0.00, r2= 1.80, r3= 3.12, r4= 3.87,
 igr2=1883,1884,1885,
 &end
#
#  134 ARG  HN          133 VAL  MGY         4.40    (#   5435:20  Unique         2.35, 4.76 A)
 &rst
  ixpk= 5435, nxpk= 20, iat=2190,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#  130 TRP  HA          133 VAL  MGY         3.50    (#   5436:20  Unique         1.99, 3.76 A)
 &rst
  ixpk= 5436, nxpk= 20, iat=2117,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:5437   133 VAL  MGY         4.40    (#   5437:20  Single Ambig)
 &rst
  ixpk= 5437, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2123,2231,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:5438   133 VAL  MGY         4.40    (#   5438:20  Single Ambig)
 &rst
  ixpk= 5438, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=2115,2413,2527,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#  130 TRP  HE3         133 VAL  MGY         2.60    (#   5439:20  Unique         3.72, 6.77 A)
 &rst
  ixpk= 5439, nxpk= 20, iat=2134,  -1, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,
 igr2=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  20-2:5440     0 AMB  20-1:5440   4.40    (#   5440:20  Double Ambig)
 &rst
  ixpk= 5440, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 912, 913,1768,1769,1759,1760,
 igr2=1845,1775,
 &end
#
#   93 ILE  HA           91 VAL  MGX         4.40    (#   5441:20  Unique         4.12, 5.55 A)
 &rst
  ixpk= 5441, nxpk= 20, iat=1519,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  20-2:5442    91 VAL  MGX         4.40    (#   5442:20  Single Ambig)
 &rst
  ixpk= 5442, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1440,1555,1556,
 igr2=1496,1497,1498,1500,1501,1502,
 &end
#
#   24 TRP  HB+         125 ARG  HD-         4.40    (#   5443:20  Unique         3.52, 7.51 A)
 &rst
  ixpk= 5443, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 360, 361,
 igr2=2029,2030,
 &end
#
#    0 AMB  20-2:5444    60 LEU  HB-         5.50    (#   5444:20  Single Ambig)
 &rst
  ixpk= 5444, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,
 igr2= 921, 922,
 &end
#
#   58 VAL  MGX          60 LEU  HB+         4.40    (#   5445:20  Unique         1.93, 4.79 A)
 &rst
  ixpk= 5445, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 900, 901, 902, 904, 905, 906,
 igr2= 921, 922,
 &end
#
#    0 AMB  20-2:5446   115 THR  HB          4.40    (#   5446:20  Single Ambig)
 &rst
  ixpk= 5446, nxpk= 20, iat=  -1,1881, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1893,1862,
 &end
#
#    0 AMB  20-2:5447   127 VAL  MGY         3.50    (#   5447:20  Single Ambig)
 &rst
  ixpk= 5447, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2023,2024, 310, 311,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#  124 TRP  HB+          23 MET  ME          5.50    (#   5448:20  Unique         4.26, 6.29 A)
 &rst
  ixpk= 5448, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1999,2000,
 igr2= 350, 351, 352,
 &end
#
#   74 TRP  HA           74 TRP  HB-         5.50    (#   5449:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 5449, nxpk= 20, iat=1158,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1160,1161,
 &end
#
#   74 TRP  HD1          74 TRP  HB-         5.50    (#   5450:20  Unique         2.56, 3.34 A)
 &rst
  ixpk= 5450, nxpk= 20, iat=1164,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1160,1161,
 &end
#
#   74 TRP  HN           74 TRP  HB-         5.50    (#   5451:20  Unique         2.45, 3.07 A)
 &rst
  ixpk= 5451, nxpk= 20, iat=1156,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1160,1161,
 &end
#
#    0 AMB  20-2:5452     0 AMB  20-1:5452   3.50    (#   5452:20  Double Ambig)
 &rst
  ixpk= 5452, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.01, r4= 8.76,
 igr1=1510,1511,2587,2588,2587,2588,1850,1851, 237, 238,
        11,  12,
 igr2=1483,1484,2634,2635,2634,2635,1867,1868,2634,2635,
      1483,1484,
 &end
#
#  114 GLN  HE2+        114 GLN  HG-         5.50    (#   5453:20  Unique         2.22, 3.41 A)
 &rst
  ixpk= 5453, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1872,1873,
 igr2=1867,1868,
 &end
#
#  114 GLN  HA          114 GLN  HG-         5.50    (#   5454:20  Unique         3.56, 3.79 A)
 &rst
  ixpk= 5454, nxpk= 20, iat=1862,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1867,1868,
 &end
#
#  103 GLN  HB+         103 GLN  HA          3.50    (#   5455:20  Unique         2.24, 2.62 A)
 &rst
  ixpk= 5455, nxpk= 20, iat=  -1,1705, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1707,1708,
 &end
#
#  103 GLN  HG+         103 GLN  HB+         2.60    (#   5456:20  Unique         2.26, 2.69 A)
 &rst
  ixpk= 5456, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1=1710,1711,
 igr2=1707,1708,
 &end
#
#    0 AMB  20-2:5457     0 AMB  20-1:5457   2.60    (#   5457:20  Double Ambig)
 &rst
  ixpk= 5457, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.96, r4= 5.71,
 igr1=1073,1074,1075,1077,1078,1079,2617,2618,2619,2621,
      2622,2623,
 igr2=1707,1708,1707,1708,
 &end
#
#    0 AMB  20-2:5458     0 AMB  20-1:5458   2.60    (#   5458:20  Double Ambig)
 &rst
  ixpk= 5458, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.13, r4= 4.88,
 igr1=1028,1029, 418, 419,
 igr2=1707,1708, 578, 579,
 &end
#
#    0 AMB  20-2:5459     0 AMB  20-1:5459   5.50    (#   5459:20  Double Ambig)
 &rst
  ixpk= 5459, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 183, 418, 419,
 igr2= 578, 579, 578, 579,
 &end
#
#    0 AMB  20-2:5460     0 AMB  20-1:5460   5.50    (#   5460:20  Double Ambig)
 &rst
  ixpk= 5460, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=14.32, r4=15.07,
 igr1= 185, 186, 187, 834, 835, 836, 838, 839, 840, 834,
       835, 836, 838, 839, 840, 224, 225, 162, 163, 164,
       166, 167, 168, 227, 228, 229,
 igr2= 578, 579, 578, 579, 578, 579, 578, 579, 578, 579,
       578, 579,
 &end
#
#   41 ASN  HB-          42 PRO  HG-         4.40    (#   5461:20  Unique         3.65, 5.03 A)
 &rst
  ixpk= 5461, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 639, 640,
 igr2= 653, 654,
 &end
#
#    0 AMB  20-2:5462    37 GLN  HA          5.50    (#   5462:20  Single Ambig)
 &rst
  ixpk= 5462, nxpk= 20, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 578, 579, 160,
 &end
#
#    0 AMB  20-2:5466     0 AMB  20-1:5466   5.50    (#   5466:20  Double Ambig)
 &rst
  ixpk= 5466, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.06, r4= 9.81,
 igr1= 742, 743, 744, 626, 627,
 igr2= 650, 651, 650, 651,
 &end
#
#   68 LEU  HG           68 LEU  HA          3.50    (#   5467:20  Unique         3.13, 3.25 A)
 &rst
  ixpk= 5467, nxpk= 20, iat=1071,1066, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   66 ARG  HG+          68 LEU  HB-         5.50    (#   5468:20  Unique         4.97, 5.86 A)
 &rst
  ixpk= 5468, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1028,1029,
 igr2=1068,1069,
 &end
#
#   27 ARG  HB+          30 GLN  HG+         4.40    (#   5469:20  Unique         2.14, 9.67 A)
 &rst
  ixpk= 5469, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 418, 419,
 igr2= 472, 473,
 &end
#
#  103 GLN  HE2-        103 GLN  HG+         3.50    (#   5470:20  Unique         2.12, 3.35 A)
 &rst
  ixpk= 5470, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1715,1716,
 igr2=1710,1711,
 &end
#
#  103 GLN  HE2+        103 GLN  HG+         3.50    (#   5471:20  Unique         2.12, 3.35 A)
 &rst
  ixpk= 5471, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1715,1716,
 igr2=1710,1711,
 &end
#
#    2 ILE  HG1+          1 MET  ME          5.50    (#   5472:20  Unique         4.51, 6.31 A)
 &rst
  ixpk= 5472, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=  31,  32,
 igr2=  15,  16,  17,
 &end
#
#  144 TYR  HN          143 VAL  HB          3.55    (#   5473:20  Unique         3.87, 3.93 A)
 &rst
  ixpk= 5473, nxpk= 20, iat=2368,2356, r1= 0.00, r2= 1.80, r3= 3.55, r4= 4.30,  &end
#
#   83 LEU  HN           84 VAL  HA          5.50    (#   5474:20  Unique         4.59, 4.68 A)
 &rst
  ixpk= 5474, nxpk= 20, iat=1345,1366, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   91 VAL  MGY          90 PRO  HB-         5.50    (#   5475:20  Unique         5.80, 7.40 A)
 &rst
  ixpk= 5475, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1496,1497,1498,1500,1501,1502,
 igr2=1483,1484,
 &end
#
#    0 AMB  20-2:5476    90 PRO  HB-         4.40    (#   5476:20  Single Ambig)
 &rst
  ixpk= 5476, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=1490,1506,
 igr2=1483,1484,
 &end
#
#    0 AMB  20-2:5477    90 PRO  HB-         5.50    (#   5477:20  Single Ambig)
 &rst
  ixpk= 5477, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1461,1462,  31,  32,
 igr2=1483,1484,
 &end
#
#    2 ILE  QG2          90 PRO  HB-         4.40    (#   5478:20  Unique         3.51, 5.35 A)
 &rst
  ixpk= 5478, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr1=  27,  28,  29,
 igr2=1483,1484,
 &end
#
#    0 AMB  20-2:5479    13 ILE  QD1         3.50    (#   5479:20  Single Ambig)
 &rst
  ixpk= 5479, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 578, 579, 160,
 igr2= 192, 193, 194,
 &end
#
#  139 PHE  HN          138 SER  HB+         3.50    (#   5481:20  Unique         2.75, 3.67 A)
 &rst
  ixpk= 5481, nxpk= 20, iat=2274,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2267,2268,
 &end
#
#   23 MET  HN           22 VAL  HB          5.50    (#   5482:20  Unique         2.37, 3.45 A)
 &rst
  ixpk= 5482, nxpk= 20, iat= 339, 327, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   34 GLN  HN           33 TRP  HA          3.50    (#   5483:20  Unique         2.14, 2.18 A)
 &rst
  ixpk= 5483, nxpk= 20, iat= 534, 512, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  126 TRP  HZ2         108 ASP  HB+         5.50    (#   5486:20  Unique         2.33, 3.10 A)
 &rst
  ixpk= 5486, nxpk= 20, iat=2056,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1777,1778,
 &end
#
#  132 PRO  HB-         125 ARG  HD-         5.50    (#   5487:20  Unique         7.51,10.69 A)
 &rst
  ixpk= 5487, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2167,2168,
 igr2=2029,2030,
 &end
#
#  132 PRO  HD+         127 VAL  MGX         5.50    (#   5489:20  Unique         1.99, 5.10 A)
 &rst
  ixpk= 5489, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2161,2162,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#   82 ARG  HN           81 LYS  HA          4.40    (#   5490:20  Unique         3.41, 3.47 A)
 &rst
  ixpk= 5490, nxpk= 20, iat=1321,1301, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:5491     0 AMB  20-1:5491   2.80    (#   5491:20  Double Ambig)
 &rst
  ixpk= 5491, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1913,1345,
 igr2=1915,1323,
 &end
#
#    0 AMB  20-2:5493    84 VAL  HB          5.50    (#   5493:20  Single Ambig)
 &rst
  ixpk= 5493, nxpk= 20, iat=  -1,1368, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1380,1506,
 &end
#
#   86 TRP  HN           85 ARG  HB+         4.40    (#   5494:20  Unique         3.59, 4.12 A)
 &rst
  ixpk= 5494, nxpk= 20, iat=1404,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2=1384,1385,
 &end
#
#   18 ARG  HN           18 ARG  HB-         3.50    (#   5495:20  Unique         2.13, 2.95 A)
 &rst
  ixpk= 5495, nxpk= 20, iat= 258,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 262, 263,
 &end
#
#    0 AMB  20-2:5497   123 GLY  HA-         5.50    (#   5497:20  Single Ambig)
 &rst
  ixpk= 5497, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1812, 392,
 igr2=1990,1991,
 &end
#
#   23 MET  HN          126 TRP  HA          5.50    (#   5498:20  Unique         4.89, 5.13 A)
 &rst
  ixpk= 5498, nxpk= 20, iat= 339,2045, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HA           12 GLY  HA+         5.50    (#   5499:20  Unique         2.93, 4.24 A)
 &rst
  ixpk= 5499, nxpk= 20, iat=1623,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 174, 175,
 &end
#
#   65 VAL  HA          104 LEU  HA          4.40    (#   5500:20  Unique         2.66, 2.97 A)
 &rst
  ixpk= 5500, nxpk= 20, iat=1007,1722, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:5502   120 GLU  HA          5.50    (#   5502:20  Single Ambig)
 &rst
  ixpk= 5502, nxpk= 20, iat=  -1,1943, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 416,1915,1845,
 &end
#
#   29 GLY  HA-          28 PHE  HA          5.50    (#   5503:20  Unique         4.35, 4.41 A)
 &rst
  ixpk= 5503, nxpk= 20, iat=  -1, 440, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 460, 461,
 &end
#
#   74 TRP  HA           98 LYS  HA          5.50    (#   5505:20  Unique         3.88, 4.53 A)
 &rst
  ixpk= 5505, nxpk= 20, iat=1158,1601, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   37 GLN  HA           12 GLY  HA-         5.50    (#   5508:20  Unique         2.32, 3.76 A)
 &rst
  ixpk= 5508, nxpk= 20, iat= 587,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 174, 175,
 &end
#
#   49 ALA  HN           46 ALA  HA          5.50    (#   5509:20  Unique         3.88, 3.97 A)
 &rst
  ixpk= 5509, nxpk= 20, iat= 738, 698, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   49 ALA  HN           48 GLN  HB+         4.40    (#   5510:20  Unique         2.47, 3.05 A)
 &rst
  ixpk= 5510, nxpk= 20, iat= 738,  -1, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr2= 725, 726,
 &end
#
#   52 ARG  HB-          49 ALA  HA          5.50    (#   5511:20  Unique         2.39, 3.49 A)
 &rst
  ixpk= 5511, nxpk= 20, iat=  -1, 740, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 790, 791,
 &end
#
#    0 AMB  20-2:5512     0 AMB  20-1:5512   5.50    (#   5512:20  Double Ambig)
 &rst
  ixpk= 5512, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 748,1995,
 igr2= 740,2021,
 &end
#
#   53 GLU  HN           49 ALA  HA          5.50    (#   5513:20  Unique         3.49, 3.80 A)
 &rst
  ixpk= 5513, nxpk= 20, iat= 810, 740, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   52 ARG  HN           51 TYR  HB+         5.50    (#   5514:20  Unique         2.65, 2.99 A)
 &rst
  ixpk= 5514, nxpk= 20, iat= 786,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 769, 770,
 &end
#
#   55 PHE  HN           51 TYR  HA          5.50    (#   5515:20  Unique         4.23, 4.67 A)
 &rst
  ixpk= 5515, nxpk= 20, iat= 844, 767, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:5517    52 ARG  HA          5.50    (#   5517:20  Single Ambig)
 &rst
  ixpk= 5517, nxpk= 20, iat=  -1, 788, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 864, 879,
 &end
#
#    0 AMB  20-2:5518    53 GLU  HA          3.50    (#   5518:20  Single Ambig)
 &rst
  ixpk= 5518, nxpk= 20, iat=  -1, 812, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 864, 879,
 &end
#
#    0 AMB  20-2:5519    55 PHE  HA          5.50    (#   5519:20  Single Ambig)
 &rst
  ixpk= 5519, nxpk= 20, iat=  -1, 846, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 894, 854, 858,
 &end
#
#    0 AMB  20-2:5520   128 SER  HA          5.50    (#   5520:20  Single Ambig)
 &rst
  ixpk= 5520, nxpk= 20, iat=  -1,2085, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2115,2128,
 &end
#
#  130 TRP  HN          129 TYR  HA          5.50    (#   5521:20  Unique         3.37, 3.41 A)
 &rst
  ixpk= 5521, nxpk= 20, iat=2115,2096, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  131 TYR  HN          130 TRP  HA          5.50    (#   5522:20  Unique         3.07, 3.21 A)
 &rst
  ixpk= 5522, nxpk= 20, iat=2139,2117, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  136 VAL  MGY         133 VAL  HA          5.50    (#   5523:20  Unique         1.93, 3.75 A)
 &rst
  ixpk= 5523, nxpk= 20, iat=  -1,2176, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2237,2238,2239,2241,2242,2243,
 &end
#
#  141 ARG  HN          140 LYS  HA          5.50    (#   5524:20  Unique         2.67, 2.97 A)
 &rst
  ixpk= 5524, nxpk= 20, iat=2316,2296, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  143 VAL  HN          140 LYS  HA          5.50    (#   5525:20  Unique         3.25, 3.42 A)
 &rst
  ixpk= 5525, nxpk= 20, iat=2352,2296, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  143 VAL  MGY         140 LYS  HA          5.50    (#   5526:20  Unique         2.03, 4.40 A)
 &rst
  ixpk= 5526, nxpk= 20, iat=  -1,2296, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#  141 ARG  HN          140 LYS  HB-         5.50    (#   5527:20  Unique         3.59, 4.21 A)
 &rst
  ixpk= 5527, nxpk= 20, iat=2316,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2298,2299,
 &end
#
#  144 TYR  HN          141 ARG  HA          5.50    (#   5528:20  Unique         3.48, 3.65 A)
 &rst
  ixpk= 5528, nxpk= 20, iat=2368,2318, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:5529     0 AMB  20-1:5529   5.50    (#   5529:20  Double Ambig)
 &rst
  ixpk= 5529, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2453,2340,
 igr2=2457,2458,2320,2321,
 &end
#
#  143 VAL  MGY         142 ASP  HB+         3.50    (#   5530:20  Unique         3.82, 6.33 A)
 &rst
  ixpk= 5530, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2358,2359,2360,2362,2363,2364,
 igr2=2344,2345,
 &end
#
#  144 TYR  HN          143 VAL  HA          5.50    (#   5531:20  Unique         3.53, 3.55 A)
 &rst
  ixpk= 5531, nxpk= 20, iat=2368,2354, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  145 ARG  HN          144 TYR  HA          5.50    (#   5532:20  Unique         3.49, 3.50 A)
 &rst
  ixpk= 5532, nxpk= 20, iat=2389,2370, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  20-2:5533     0 AMB  20-1:5533   2.60    (#   5533:20  Double Ambig)
 &rst
  ixpk= 5533, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2668,2669,2413,
 igr2=2648,2649,2393,2394,
 &end
#
#  149 LYS  HB-         146 ARG  HA          3.50    (#   5534:20  Unique         1.98, 2.67 A)
 &rst
  ixpk= 5534, nxpk= 20, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2474,2475,
 &end
#
#  149 LYS  HN          148 MET  HA          4.40    (#   5535:20  Unique         3.37, 3.42 A)
 &rst
  ixpk= 5535, nxpk= 20, iat=2470,2455, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#  151 PHE  HN          148 MET  HA          5.50    (#   5536:20  Unique         3.16, 3.26 A)
 &rst
  ixpk= 5536, nxpk= 20, iat=2507,2455, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HN          150 GLU  HA          3.50    (#   5537:20  Unique         3.47, 3.50 A)
 &rst
  ixpk= 5537, nxpk= 20, iat=2507,2494, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5539     0 AMB  20-1:5539   5.50    (#   5539:20  Double Ambig)
 &rst
  ixpk= 5539, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 788,1106,
 igr2= 723,2494,
 &end
#
#  155 VAL  HN          152 ALA  HA          4.40    (#   5540:20  Unique         3.10, 3.33 A)
 &rst
  ixpk= 5540, nxpk= 20, iat=2564,2529, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:5541   152 ALA  HA          5.50    (#   5541:20  Single Ambig)
 &rst
  ixpk= 5541, nxpk= 20, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2580,2094,
 &end
#
#   21 GLN  HA           21 GLN  HG-         3.50    (#   5542:20  Unique         2.30, 3.18 A)
 &rst
  ixpk= 5542, nxpk= 20, iat= 308,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 313, 314,
 &end
#
#   17 ASN  HD2-          0 AMB  20-1:5543   4.40    (#   5543:20  Single Ambig)
 &rst
  ixpk= 5543, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 253, 254,
 igr2= 313, 314, 289, 290,
 &end
#
#   17 ASN  HD2-         21 GLN  HG-         5.50    (#   5544:20  Unique         1.95, 3.97 A)
 &rst
  ixpk= 5544, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 253, 254,
 igr2= 313, 314,
 &end
#
#   21 GLN  HN           21 GLN  HG+         3.50    (#   5547:20  Unique         1.94, 3.20 A)
 &rst
  ixpk= 5547, nxpk= 20, iat= 306,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 313, 314,
 &end
#
#  103 GLN  HN          103 GLN  HB+         5.50    (#   5549:20  Unique         2.09, 2.73 A)
 &rst
  ixpk= 5549, nxpk= 20, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1707,1708,
 &end
#
#  103 GLN  HA          103 GLN  HB-         5.50    (#   5550:20  Unique         2.24, 2.62 A)
 &rst
  ixpk= 5550, nxpk= 20, iat=1705,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1707,1708,
 &end
#
#  103 GLN  HN          103 GLN  HB+         5.50    (#   5551:20  Unique         2.09, 2.73 A)
 &rst
  ixpk= 5551, nxpk= 20, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1707,1708,
 &end
#
#   68 LEU  HG          103 GLN  HB-         3.50    (#   5552:20  Unique         2.76, 3.55 A)
 &rst
  ixpk= 5552, nxpk= 20, iat=1071,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1707,1708,
 &end
#
#  135 GLN  HN          132 PRO  HA          5.50    (#   5553:20  Unique         3.04, 3.20 A)
 &rst
  ixpk= 5553, nxpk= 20, iat=2214,2170, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  133 VAL  HN          132 PRO  HA          4.40    (#   5554:20  Unique         2.46, 3.42 A)
 &rst
  ixpk= 5554, nxpk= 20, iat=2174,2170, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,  &end
#
#    0 AMB  20-2:5555   132 PRO  HA          4.40    (#   5555:20  Single Ambig)
 &rst
  ixpk= 5555, nxpk= 20, iat=  -1,2170, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1=2221,2222,2167,2168,
 &end
#
#  132 PRO  HB-         132 PRO  HA          4.40    (#   5556:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 5556, nxpk= 20, iat=  -1,2170, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=2167,2168,
 &end
#
#  132 PRO  HA          132 PRO  HB+         5.50    (#   5557:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 5557, nxpk= 20, iat=2170,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2167,2168,
 &end
#
#  127 VAL  MGY         132 PRO  HB-         5.50    (#   5558:20  Unique         3.19, 6.44 A)
 &rst
  ixpk= 5558, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2167,2168,
 &end
#
#  127 VAL  MGY         132 PRO  HB+         5.50    (#   5559:20  Unique         3.19, 6.44 A)
 &rst
  ixpk= 5559, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2=2167,2168,
 &end
#
#    0 AMB  20-2:5560   132 PRO  HB-         5.50    (#   5560:20  Single Ambig)
 &rst
  ixpk= 5560, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2378,2383,2174,
 igr2=2167,2168,
 &end
#
#   33 TRP  HN           32 SER  HA          3.50    (#   5561:20  Unique         2.14, 2.27 A)
 &rst
  ixpk= 5561, nxpk= 20, iat= 510, 501, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   32 SER  HN           31 HIS  HA          5.50    (#   5562:20  Unique         2.59, 2.96 A)
 &rst
  ixpk= 5562, nxpk= 20, iat= 499, 484, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   33 TRP  HN           33 TRP  HA          5.50    (#   5563:20  Unique         2.90, 2.92 A)
 &rst
  ixpk= 5563, nxpk= 20, iat= 510, 512, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   34 GLN  HN           33 TRP  HA          5.50    (#   5564:20  Unique         2.14, 2.18 A)
 &rst
  ixpk= 5564, nxpk= 20, iat= 534, 512, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   81 LYS  HN           81 LYS  HB-         2.60    (#   5565:20  Unique         2.18, 3.00 A)
 &rst
  ixpk= 5565, nxpk= 20, iat=1299,  -1, r1= 0.00, r2= 1.80, r3= 2.92, r4= 3.67,
 igr2=1303,1304,
 &end
#
#    0 AMB  20-2:5566     0 AMB  20-1:5566   3.50    (#   5566:20  Double Ambig)
 &rst
  ixpk= 5566, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1321,1665,
 igr2=1303,1304, 202,
 &end
#
#   82 ARG  HN           81 LYS  HB-         3.50    (#   5567:20  Unique         2.78, 3.48 A)
 &rst
  ixpk= 5567, nxpk= 20, iat=1321,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1303,1304,
 &end
#
#   80 PRO  HG+          82 ARG  HA          5.50    (#   5569:20  Unique         5.18, 5.95 A)
 &rst
  ixpk= 5569, nxpk= 20, iat=  -1,1323, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1289,1290,
 &end
#
#    0 AMB  20-2:5570    20 GLY  HA-         5.50    (#   5570:20  Single Ambig)
 &rst
  ixpk= 5570, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 282,2608,
 igr2= 301, 302,
 &end
#
#    0 AMB  20-2:5571    18 ARG  HG-         4.40    (#   5571:20  Single Ambig)
 &rst
  ixpk= 5571, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 282,2608,
 igr2= 265, 266,
 &end
#
#    0 AMB  20-2:5572     0 AMB  20-1:5572   3.50    (#   5572:20  Double Ambig)
 &rst
  ixpk= 5572, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1881,1917,
 igr2=1895,1896,1895,1896,
 &end
#
#    0 AMB  20-2:5573   115 THR  HA          4.40    (#   5573:20  Single Ambig)
 &rst
  ixpk= 5573, nxpk= 20, iat=  -1,1879, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1893,1862,
 &end
#
#   84 VAL  MGY          85 ARG  HA          5.50    (#   5574:20  Unique         4.06, 5.96 A)
 &rst
  ixpk= 5574, nxpk= 20, iat=  -1,1382, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#  100 PHE  HD           14 VAL  MGY         5.50    (#   5575:20  Unique         5.82, 8.96 A)
 &rst
  ixpk= 5575, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1653,1661,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   32 SER  HN           30 GLN  HB-         5.50    (#   5577:20  Unique         2.34, 3.31 A)
 &rst
  ixpk= 5577, nxpk= 20, iat= 499,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 469, 470,
 &end
#
#   57 GLU  HB-          58 VAL  MGY         4.40    (#   5578:20  Unique         2.47, 5.55 A)
 &rst
  ixpk= 5578, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 883, 884,
 igr2= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  20-2:5579    15 ILE  QD1         4.40    (#   5579:20  Single Ambig)
 &rst
  ixpk= 5579, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1= 343, 344, 575, 576,
 igr2= 227, 228, 229,
 &end
#
#   97 GLN  HE2+        143 VAL  MGY         5.50    (#   5580:20  Unique         2.58, 6.24 A)
 &rst
  ixpk= 5580, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1594,1595,
 igr2=2358,2359,2360,2362,2363,2364,
 &end
#
#  119 PRO  HD-         119 PRO  HA          5.50    (#   5581:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 5581, nxpk= 20, iat=  -1,1937, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1928,1929,
 &end
#
#    0 AMB  20-2:5583     0 AMB  20-1:5583   4.40    (#   5583:20  Double Ambig)
 &rst
  ixpk= 5583, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 448, 452, 854, 858,
 igr2=1917,1881,
 &end
#
#    0 AMB  20-2:5584    42 PRO  HA          4.40    (#   5584:20  Single Ambig)
 &rst
  ixpk= 5584, nxpk= 20, iat=  -1, 659, r1= 0.00, r2= 1.80, r3= 5.54, r4= 6.29,
 igr1= 665, 666,   6,  23,
 &end
#
#    0 AMB  20-2:5585    75 LEU  MDY         3.50    (#   5585:20  Single Ambig)
 &rst
  ixpk= 5585, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2413,1634,
 igr2=1189,1190,1191,1193,1194,1195,
 &end
#
#  103 GLN  HE2-         68 LEU  MDX         5.50    (#   5586:20  Unique         1.97, 5.74 A)
 &rst
  ixpk= 5586, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1715,1716,
 igr2=1073,1074,1075,1077,1078,1079,
 &end
#
#    0 AMB  20-2:5589   116 SER  HB-         5.50    (#   5589:20  Single Ambig)
 &rst
  ixpk= 5589, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1904,1845,
 igr2=1895,1896,
 &end
#
#    0 AMB  20-2:5590     0 AMB  20-1:5590   4.40    (#   5590:20  Double Ambig)
 &rst
  ixpk= 5590, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.12, r4= 7.87,
 igr1=1904,1915,1845,
 igr2=1895,1896,1895,1896,1895,1896,
 &end
#
#    0 AMB  20-2:5591   145 ARG  HA          5.50    (#   5591:20  Single Ambig)
 &rst
  ixpk= 5591, nxpk= 20, iat=  -1,2391, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2342,2472,
 &end
#
#    0 AMB  20-2:5592    89 LYS  HA          4.40    (#   5592:20  Single Ambig)
 &rst
  ixpk= 5592, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 4.94, r4= 5.69,
 igr1=1442,1406,
 &end
#
#    0 AMB  20-2:5593   158 LEU  MDY         2.60    (#   5593:20  Single Ambig)
 &rst
  ixpk= 5593, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2570,2571,2572,2574,2575,2576,2554,2555,2556,2558,
      2559,2560,1073,1074,1075,1077,1078,1079,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:5594     0 AMB  20-1:5594   4.40    (#   5594:20  Double Ambig)
 &rst
  ixpk= 5594, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=1206,1207,1570,1571,
 igr2=1203,1204,1203,1204,
 &end
#
#    0 AMB  20-2:5595    67 ILE  QG2         5.50    (#   5595:20  Single Ambig)
 &rst
  ixpk= 5595, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=1691,1028,1029,
 igr2=1051,1052,1053,
 &end
#
#  102 LEU  HB-          67 ILE  QG2         5.50    (#   5596:20  Unique         3.46, 5.70 A)
 &rst
  ixpk= 5596, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1688,1689,
 igr2=1051,1052,1053,
 &end
#
#  132 PRO  HB-         127 VAL  MGX         4.40    (#   5597:20  Unique         3.19, 6.44 A)
 &rst
  ixpk= 5597, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.66, r4= 7.41,
 igr1=2167,2168,
 igr2=2073,2074,2075,2077,2078,2079,
 &end
#
#   65 VAL  HB          102 LEU  MDX         4.40    (#   5599:20  Unique         1.96, 5.82 A)
 &rst
  ixpk= 5599, nxpk= 20, iat=1009,  -1, r1= 0.00, r2= 1.80, r3= 5.93, r4= 6.68,
 igr2=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  20-2:5600    53 GLU  HA          2.60    (#   5600:20  Single Ambig)
 &rst
  ixpk= 5600, nxpk= 20, iat=  -1, 812, r1= 0.00, r2= 1.80, r3= 3.28, r4= 4.03,
 igr1= 814, 815, 793, 794,
 &end
#
#   88 THR  MG2          89 LYS  HA          5.50    (#   5601:20  Unique         4.25, 5.14 A)
 &rst
  ixpk= 5601, nxpk= 20, iat=  -1,1456, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1446,1447,1448,
 &end
#
#  113 MET  HG+          58 VAL  HA          5.50    (#   5603:20  Unique         2.56, 3.96 A)
 &rst
  ixpk= 5603, nxpk= 20, iat=  -1, 896, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1850,1851,
 &end
#
#   18 ARG  HE          158 LEU  MDY         5.50    (#   5604:20  Unique         1.93, 6.68 A)
 &rst
  ixpk= 5604, nxpk= 20, iat= 271,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr2=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  20-2:5605     0 AMB  20-1:5605   5.50    (#   5605:20  Double Ambig)
 &rst
  ixpk= 5605, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2316,2123,
 igr2=2320,2321,2457,2458,
 &end
#
#    0 AMB  20-2:5606    47 GLU  HA          4.40    (#   5606:20  Single Ambig)
 &rst
  ixpk= 5606, nxpk= 20, iat=  -1, 708, r1= 0.00, r2= 1.80, r3= 6.56, r4= 7.31,
 igr1=1058,1059,1060,1693,1694,1695,1697,1698,1699,1609,
      1610,
 &end
#
#    0 AMB  20-2:5607     0 AMB  20-1:5607   4.40    (#   5607:20  Double Ambig)
 &rst
  ixpk= 5607, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1442,1741,
 igr2=1458,1459,1025,1026,
 &end
#
#  111 ILE  HG1-        109 ALA  MB          5.50    (#   5608:20  Unique         6.21, 7.47 A)
 &rst
  ixpk= 5608, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1820,1821,
 igr2=1789,1790,1791,
 &end
#
#  127 VAL  MGY          22 VAL  MGX         2.60    (#   5609:20  Unique         2.06, 6.68 A)
 &rst
  ixpk= 5609, nxpk= 20, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,2074,2075,2077,2078,2079,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  10-2:0        0 AMB  10-1:0      3.50    (#      0:10  Double Ambig)
 &rst
  ixpk= 0, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=1,
 igr1=  25,2023,2024,
 igr2=  21,2043,
 &end
#
#    0 AMB  10-2:1        0 AMB  10-1:1      5.50    (#      1:10  Double Ambig)
 &rst
  ixpk= 1, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2029,2030,  44,  45,
 igr2=2043,  21,
 &end
#
#  125 ARG  HA          126 TRP  HN          2.80    (#      2:10  Unique         2.14, 2.21 A)
 &rst
  ixpk= 2, nxpk= 10, iat=2021,2043, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  126 TRP  HA          126 TRP  HN          5.50    (#      3:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 3, nxpk= 10, iat=2045,2043, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  126 TRP  HD1         126 TRP  HN          4.20    (#      4:10  Unique         2.87, 3.32 A)
 &rst
  ixpk= 4, nxpk= 10, iat=2051,2043, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  127 VAL  HN          126 TRP  HN          5.50    (#      5:10  Unique         4.30, 4.47 A)
 &rst
  ixpk= 5, nxpk= 10, iat=2067,2043, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  126 TRP  HB+         126 TRP  HN          2.80    (#      6:10  Unique         2.41, 3.12 A)
 &rst
  ixpk= 6, nxpk= 10, iat=  -1,2043, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2047,2048,
 &end
#
#    2 ILE  QG2           3 ASP  HN          2.80    (#      7:10  Unique         2.56, 3.67 A)
 &rst
  ixpk= 7, nxpk= 10, iat=  -1,  40, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=  27,  28,  29,
 &end
#
#    0 AMB  10-2:8        3 ASP  HN          3.00    (#      8:10  Single Ambig)
 &rst
  ixpk= 8, nxpk= 10, iat=  -1,  40, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1= 108, 109, 108, 109, 132, 133, 111, 112,
 &end
#
#    3 ASP  HB+           3 ASP  HN          2.80    (#      9:10  Unique         2.15, 2.87 A)
 &rst
  ixpk= 9, nxpk= 10, iat=  -1,  40, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=  44,  45,
 &end
#
#    9 PRO  HD+           3 ASP  HN          4.20    (#     10:10  Unique         3.15, 3.47 A)
 &rst
  ixpk= 10, nxpk= 10, iat=  -1,  40, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 129, 130,
 &end
#
#    2 ILE  HA            3 ASP  HN          2.80    (#     11:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 11, nxpk= 10, iat=  23,  40, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    8 ARG  HA            3 ASP  HN          5.50    (#     13:10  Unique         2.97, 3.42 A)
 &rst
  ixpk= 13, nxpk= 10, iat= 106,  40, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    5 ASP  HN            4 ASP  HN          3.50    (#     14:10  Unique         1.77, 2.47 A)
 &rst
  ixpk= 14, nxpk= 10, iat=  64,  52, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    4 ASP  HA            4 ASP  HN          2.80    (#     15:10  Unique         2.79, 2.88 A)
 &rst
  ixpk= 15, nxpk= 10, iat=  54,  52, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    3 ASP  HA            4 ASP  HN          3.50    (#     16:10  Unique         2.32, 2.88 A)
 &rst
  ixpk= 16, nxpk= 10, iat=  42,  52, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    4 ASP  HB-           4 ASP  HN          2.80    (#     17:10  Unique         2.25, 2.68 A)
 &rst
  ixpk= 17, nxpk= 10, iat=  -1,  52, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=  56,  57,
 &end
#
#    3 ASP  HB+           4 ASP  HN          3.50    (#     18:10  Unique         1.83, 2.71 A)
 &rst
  ixpk= 18, nxpk= 10, iat=  -1,  52, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  44,  45,
 &end
#
#    4 ASP  HB+           4 ASP  HN          2.80    (#     19:10  Unique         2.25, 2.68 A)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1,  52, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=  56,  57,
 &end
#
#    6 GLY  HN            5 ASP  HN          2.80    (#     20:10  Unique         2.00, 2.14 A)
 &rst
  ixpk= 20, nxpk= 10, iat=  76,  64, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    5 ASP  HA            5 ASP  HN          2.80    (#     21:10  Unique         2.88, 2.93 A)
 &rst
  ixpk= 21, nxpk= 10, iat=  66,  64, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    4 ASP  HA            5 ASP  HN          3.50    (#     22:10  Unique         3.17, 3.28 A)
 &rst
  ixpk= 22, nxpk= 10, iat=  54,  64, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    5 ASP  HB-           5 ASP  HN          2.80    (#     23:10  Unique         2.11, 2.79 A)
 &rst
  ixpk= 23, nxpk= 10, iat=  -1,  64, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=  68,  69,
 &end
#
#    5 ASP  HB+           5 ASP  HN          2.80    (#     24:10  Unique         2.11, 2.79 A)
 &rst
  ixpk= 24, nxpk= 10, iat=  -1,  64, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=  68,  69,
 &end
#
#    4 ASP  HB-           5 ASP  HN          5.50    (#     25:10  Unique         1.74, 3.78 A)
 &rst
  ixpk= 25, nxpk= 10, iat=  -1,  64, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  56,  57,
 &end
#
#    5 ASP  HN            6 GLY  HN          2.80    (#     26:10  Unique         2.00, 2.14 A)
 &rst
  ixpk= 26, nxpk= 10, iat=  64,  76, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    5 ASP  HA            6 GLY  HN          5.50    (#     27:10  Unique         3.08, 3.34 A)
 &rst
  ixpk= 27, nxpk= 10, iat=  66,  76, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    6 GLY  HA+           6 GLY  HN          3.50    (#     28:10  Unique         2.30, 2.65 A)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1,  76, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  78,  79,
 &end
#
#    6 GLY  HA-           6 GLY  HN          3.50    (#     29:10  Unique         2.30, 2.65 A)
 &rst
  ixpk= 29, nxpk= 10, iat=  -1,  76, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  78,  79,
 &end
#
#    4 ASP  HA            6 GLY  HN          5.50    (#     30:10  Unique         3.53, 3.83 A)
 &rst
  ixpk= 30, nxpk= 10, iat=  54,  76, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:32       6 GLY  HN          5.50    (#     32:10  Single Ambig)
 &rst
  ixpk= 32, nxpk= 10, iat=  -1,  76, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=  68,  69,  87,  88,
 &end
#
#    5 ASP  HB-           6 GLY  HN          4.20    (#     33:10  Unique         3.34, 3.73 A)
 &rst
  ixpk= 33, nxpk= 10, iat=  -1,  76, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=  68,  69,
 &end
#
#    2 ILE  QG2           6 GLY  HN          5.50    (#     34:10  Unique         2.37, 3.34 A)
 &rst
  ixpk= 34, nxpk= 10, iat=  -1,  76, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=  27,  28,  29,
 &end
#
#    7 TYR  HD            7 TYR  HN          3.50    (#     35:10  Unique         2.67, 4.26 A)
 &rst
  ixpk= 35, nxpk= 10, iat=  -1,  83, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  91, 100,
 &end
#
#    0 AMB  10-2:36       7 TYR  HN          3.50    (#     36:10  Single Ambig)
 &rst
  ixpk= 36, nxpk= 10, iat=  -1,  83, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  85,  66,
 &end
#
#    6 GLY  HA-           7 TYR  HN          5.50    (#     37:10  Unique         2.95, 3.25 A)
 &rst
  ixpk= 37, nxpk= 10, iat=  -1,  83, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  78,  79,
 &end
#
#    0 AMB  10-2:38       7 TYR  HN          4.20    (#     38:10  Single Ambig)
 &rst
  ixpk= 38, nxpk= 10, iat=  -1,  83, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=  87,  88,  68,  69,
 &end
#
#    7 TYR  HE            7 TYR  HN          5.50    (#     40:10  Unique         5.06, 6.32 A)
 &rst
  ixpk= 40, nxpk= 10, iat=  -1,  83, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  93,  98,
 &end
#
#    7 TYR  HB-           7 TYR  HN          4.20    (#     41:10  Unique         2.12, 2.95 A)
 &rst
  ixpk= 41, nxpk= 10, iat=  -1,  83, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=  87,  88,
 &end
#
#    2 ILE  QG2           7 TYR  HN          4.20    (#     42:10  Unique         2.50, 3.93 A)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1,  83, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=  27,  28,  29,
 &end
#
#    0 AMB  10-2:43       0 AMB  10-1:43     4.20    (#     43:10  Double Ambig)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1530,1531,1532,1527,1528, 759, 760, 761,
 igr2=  83, 748,
 &end
#
#   50 MET  HB-          50 MET  HN          5.50    (#     44:10  Unique         2.28, 2.53 A)
 &rst
  ixpk= 44, nxpk= 10, iat=  -1, 748, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 752, 753,
 &end
#
#    0 AMB  10-2:45       8 ARG  HN          2.80    (#     45:10  Single Ambig)
 &rst
  ixpk= 45, nxpk= 10, iat=  -1, 104, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1= 108, 109, 108, 109,1547,1548,
 &end
#
#    7 TYR  HA            8 ARG  HN          3.50    (#     46:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 46, nxpk= 10, iat=  85, 104, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    8 ARG  HA            8 ARG  HN          5.50    (#     47:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 47, nxpk= 10, iat= 106, 104, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   95 GLN  HA            8 ARG  HN          4.20    (#     48:10  Unique         2.41, 2.54 A)
 &rst
  ixpk= 48, nxpk= 10, iat=1545, 104, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:49      10 ASN  HN          5.50    (#     49:10  Single Ambig)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1, 142, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1594,1595,1555,1556,
 &end
#
#   10 ASN  HA           10 ASN  HN          4.20    (#     50:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 50, nxpk= 10, iat= 144, 142, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   97 GLN  HA           10 ASN  HN          5.50    (#     51:10  Unique         3.11, 3.44 A)
 &rst
  ixpk= 51, nxpk= 10, iat=1584, 142, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    9 PRO  HA           10 ASN  HN          3.50    (#     52:10  Unique         2.15, 2.19 A)
 &rst
  ixpk= 52, nxpk= 10, iat= 138, 142, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:53      10 ASN  HN          5.50    (#     53:10  Single Ambig)
 &rst
  ixpk= 53, nxpk= 10, iat=  -1, 142, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1550,1551, 132, 133,1586,1587,1209,1210,
 &end
#
#    0 AMB  10-2:54      10 ASN  HN          4.20    (#     54:10  Single Ambig)
 &rst
  ixpk= 54, nxpk= 10, iat=  -1, 142, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1589,1590,1573,1574,  15,  16,  17,  87,  88,
 &end
#
#    9 PRO  HB-          10 ASN  HN          4.20    (#     55:10  Unique         3.05, 3.58 A)
 &rst
  ixpk= 55, nxpk= 10, iat=  -1, 142, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 135, 136,
 &end
#
#   40 ILE  QD1          10 ASN  HN          5.50    (#     56:10  Unique         2.98, 4.53 A)
 &rst
  ixpk= 56, nxpk= 10, iat=  -1, 142, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 629, 630, 631,
 &end
#
#   10 ASN  HB+          10 ASN  HN          5.50    (#     57:10  Unique         2.43, 3.06 A)
 &rst
  ixpk= 57, nxpk= 10, iat=  -1, 142, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 146, 147,
 &end
#
#   11 VAL  MGY          10 ASN  HN          5.50    (#     58:10  Unique         4.19, 6.12 A)
 &rst
  ixpk= 58, nxpk= 10, iat=  -1, 142, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGX          11 VAL  HN          3.50    (#     59:10  Unique         2.21, 3.81 A)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGY          11 VAL  HN          3.50    (#     60:10  Unique         2.21, 3.81 A)
 &rst
  ixpk= 60, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   40 ILE  HG1-         11 VAL  HN          5.50    (#     61:10  Unique         2.64, 4.11 A)
 &rst
  ixpk= 61, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 626, 627,
 &end
#
#   11 VAL  HB           11 VAL  HN          5.50    (#     62:10  Unique         2.53, 3.36 A)
 &rst
  ixpk= 62, nxpk= 10, iat= 160, 156, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:63      11 VAL  HN          5.50    (#     63:10  Single Ambig)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 817, 818, 111, 112,1547,1548,
 &end
#
#   37 GLN  HG+          11 VAL  HN          5.50    (#     64:10  Unique         3.20, 5.31 A)
 &rst
  ixpk= 64, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 592, 593,
 &end
#
#   10 ASN  HB-          11 VAL  HN          3.50    (#     65:10  Unique         2.67, 3.49 A)
 &rst
  ixpk= 65, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 146, 147,
 &end
#
#   39 GLY  HA-          11 VAL  HN          5.50    (#     66:10  Unique         2.16, 3.38 A)
 &rst
  ixpk= 66, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 611, 612,
 &end
#
#   39 GLY  HA+          11 VAL  HN          5.50    (#     67:10  Unique         2.16, 3.38 A)
 &rst
  ixpk= 67, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 611, 612,
 &end
#
#   37 GLN  HA           11 VAL  HN          5.50    (#     68:10  Unique         4.19, 4.63 A)
 &rst
  ixpk= 68, nxpk= 10, iat= 587, 156, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   10 ASN  HA           11 VAL  HN          2.80    (#     69:10  Unique         2.20, 2.30 A)
 &rst
  ixpk= 69, nxpk= 10, iat= 144, 156, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   12 GLY  HN           11 VAL  HN          5.50    (#     70:10  Unique         4.34, 4.40 A)
 &rst
  ixpk= 70, nxpk= 10, iat= 172, 156, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   10 ASN  HD2+         11 VAL  HN          5.50    (#     71:10  Unique         4.32, 4.96 A)
 &rst
  ixpk= 71, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 151, 152,
 &end
#
#   40 ILE  HN           11 VAL  HN          5.50    (#     72:10  Unique         3.42, 3.91 A)
 &rst
  ixpk= 72, nxpk= 10, iat= 616, 156, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   38 GLY  HN           11 VAL  HN          4.20    (#     73:10  Unique         3.22, 3.53 A)
 &rst
  ixpk= 73, nxpk= 10, iat= 602, 156, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   11 VAL  MGX          12 GLY  HN          3.50    (#     74:10  Unique         2.38, 4.33 A)
 &rst
  ixpk= 74, nxpk= 10, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGY          12 GLY  HN          5.50    (#     75:10  Unique         2.38, 4.33 A)
 &rst
  ixpk= 75, nxpk= 10, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HB           12 GLY  HN          5.50    (#     76:10  Unique         2.63, 3.29 A)
 &rst
  ixpk= 76, nxpk= 10, iat= 160, 172, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HA           12 GLY  HN          3.50    (#     77:10  Unique         2.73, 3.23 A)
 &rst
  ixpk= 77, nxpk= 10, iat=1623, 172, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   11 VAL  HA           12 GLY  HN          2.80    (#     78:10  Unique         2.19, 2.25 A)
 &rst
  ixpk= 78, nxpk= 10, iat= 158, 172, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:79      13 ILE  HN          3.50    (#     79:10  Single Ambig)
 &rst
  ixpk= 79, nxpk= 10, iat=  -1, 179, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 174, 175, 174, 175,
 &end
#
#   37 GLN  HA           13 ILE  HN          4.20    (#     81:10  Unique         3.28, 3.79 A)
 &rst
  ixpk= 81, nxpk= 10, iat= 587, 179, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   13 ILE  HB           13 ILE  HN          3.50    (#     82:10  Unique         2.50, 2.79 A)
 &rst
  ixpk= 82, nxpk= 10, iat= 183, 179, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   13 ILE  HG1-         13 ILE  HN          5.50    (#     83:10  Unique         1.85, 3.22 A)
 &rst
  ixpk= 83, nxpk= 10, iat=  -1, 179, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 189, 190,
 &end
#
#    0 AMB  10-2:84      13 ILE  HN          3.50    (#     84:10  Single Ambig)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 179, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 185, 186, 187, 162, 163, 164, 166, 167, 168, 227,
       228, 229, 224, 225, 834, 835, 836, 838, 839, 840,
      
 &end
#
#    0 AMB  10-2:85      13 ILE  HN          2.80    (#     85:10  Single Ambig)
 &rst
  ixpk= 85, nxpk= 10, iat=  -1, 179, r1= 0.00, r2= 1.80, r3= 3.66, r4= 4.41,
 igr1= 189, 190, 192, 193, 194,
 &end
#
#   36 PRO  HG+          13 ILE  HN          5.50    (#     87:10  Unique         2.18, 3.64 A)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1, 179, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 575, 576,
 &end
#
#   14 VAL  MGX          14 VAL  HN          3.50    (#     88:10  Unique         2.39, 4.03 A)
 &rst
  ixpk= 88, nxpk= 10, iat=  -1, 198, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  MGY          14 VAL  HN          2.80    (#     89:10  Unique         2.39, 4.03 A)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1, 198, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  10-2:90      14 VAL  HN          2.80    (#     90:10  Single Ambig)
 &rst
  ixpk= 90, nxpk= 10, iat=  -1, 198, r1= 0.00, r2= 1.80, r3= 3.96, r4= 4.71,
 igr1= 185, 186, 187, 227, 228, 229, 224, 225,
 &end
#
#    0 AMB  10-2:91      14 VAL  HN          5.50    (#     91:10  Single Ambig)
 &rst
  ixpk= 91, nxpk= 10, iat=  -1, 198, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 189, 190, 350, 351, 352,
 &end
#
#    0 AMB  10-2:92      14 VAL  HN          5.50    (#     92:10  Single Ambig)
 &rst
  ixpk= 92, nxpk= 10, iat=  -1, 198, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1691, 183, 755, 756,
 &end
#
#   14 VAL  HB           14 VAL  HN          4.20    (#     93:10  Unique         2.69, 2.80 A)
 &rst
  ixpk= 93, nxpk= 10, iat= 202, 198, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   14 VAL  HA           14 VAL  HN          5.50    (#     94:10  Unique         2.95, 2.95 A)
 &rst
  ixpk= 94, nxpk= 10, iat= 200, 198, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  HA           14 VAL  HN          5.50    (#     96:10  Unique         3.45, 3.80 A)
 &rst
  ixpk= 96, nxpk= 10, iat=1667, 198, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HD           14 VAL  HN          5.50    (#     97:10  Unique         6.49, 7.47 A)
 &rst
  ixpk= 97, nxpk= 10, iat=  -1, 198, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#  102 LEU  HN           14 VAL  HN          5.50    (#     98:10  Unique         3.58, 4.07 A)
 &rst
  ixpk= 98, nxpk= 10, iat=1684, 198, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   15 ILE  HN           14 VAL  HN          5.50    (#     99:10  Unique         3.94, 4.00 A)
 &rst
  ixpk= 99, nxpk= 10, iat= 214, 198, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:100     14 VAL  HN          5.50    (#    100:10  Single Ambig)
 &rst
  ixpk= 100, nxpk= 10, iat=  -1, 198, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 559, 567,1653,1661,
 &end
#
#   99 TRP  HE3          14 VAL  HN          5.50    (#    101:10  Unique         5.00, 5.46 A)
 &rst
  ixpk= 101, nxpk= 10, iat=1640, 198, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   14 VAL  HA           15 ILE  HN          3.50    (#    103:10  Unique         2.16, 2.20 A)
 &rst
  ixpk= 103, nxpk= 10, iat= 200, 214, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   15 ILE  HB           15 ILE  HN          4.20    (#    104:10  Unique         2.56, 2.66 A)
 &rst
  ixpk= 104, nxpk= 10, iat= 218, 214, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   15 ILE  HG1+         15 ILE  HN          4.20    (#    105:10  Unique         2.01, 3.06 A)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1, 214, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 224, 225,
 &end
#
#    0 AMB  10-2:106     15 ILE  HN          4.20    (#    106:10  Single Ambig)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1, 214, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1= 329, 330, 331, 333, 334, 335, 220, 221, 222,
 &end
#
#    0 AMB  10-2:107     15 ILE  HN          2.80    (#    107:10  Single Ambig)
 &rst
  ixpk= 107, nxpk= 10, iat=  -1, 214, r1= 0.00, r2= 1.80, r3= 3.66, r4= 4.41,
 igr1= 224, 225, 227, 228, 229,
 &end
#
#    0 AMB  10-2:108     15 ILE  HN          3.50    (#    108:10  Single Ambig)
 &rst
  ixpk= 108, nxpk= 10, iat=  -1, 214, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 204, 205, 206, 208, 209, 210,1674,1675,1676,1678,
      1679,1680,
 &end
#
#  104 LEU  HN           16 CYS  HN          5.50    (#    109:10  Unique         3.19, 3.53 A)
 &rst
  ixpk= 109, nxpk= 10, iat=1720, 233, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   16 CYS  HA           16 CYS  HN          5.50    (#    110:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 110, nxpk= 10, iat= 235, 233, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   15 ILE  HA           16 CYS  HN          3.50    (#    111:10  Unique         2.14, 2.19 A)
 &rst
  ixpk= 111, nxpk= 10, iat= 216, 233, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  103 GLN  HA           16 CYS  HN          4.20    (#    112:10  Unique         2.14, 2.31 A)
 &rst
  ixpk= 112, nxpk= 10, iat=1705, 233, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   16 CYS  HB+          16 CYS  HN          5.50    (#    113:10  Unique         2.21, 3.18 A)
 &rst
  ixpk= 113, nxpk= 10, iat=  -1, 233, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 237, 238,
 &end
#
#   16 CYS  HB-          16 CYS  HN          5.50    (#    114:10  Unique         2.21, 3.18 A)
 &rst
  ixpk= 114, nxpk= 10, iat=  -1, 233, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 237, 238,
 &end
#
#  103 GLN  HB-          16 CYS  HN          4.20    (#    115:10  Unique         3.74, 4.54 A)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1, 233, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1707,1708,
 &end
#
#   15 ILE  QG2          16 CYS  HN          3.50    (#    116:10  Unique         2.01, 3.22 A)
 &rst
  ixpk= 116, nxpk= 10, iat=  -1, 233, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 220, 221, 222,
 &end
#
#    0 AMB  10-2:117     16 CYS  HN          3.50    (#    117:10  Single Ambig)
 &rst
  ixpk= 117, nxpk= 10, iat=  -1, 233, r1= 0.00, r2= 1.80, r3= 5.61, r4= 6.36,
 igr1= 227, 228, 229,1073,1074,1075,1077,1078,1079,2617,
      2618,2619,2621,2622,2623, 224, 225,
 &end
#
#    0 AMB  10-2:118     48 GLN  HN          3.50    (#    118:10  Single Ambig)
 &rst
  ixpk= 118, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 706, 685,
 &end
#
#   49 ALA  HN           48 GLN  HN          3.50    (#    119:10  Unique         2.71, 2.76 A)
 &rst
  ixpk= 119, nxpk= 10, iat= 738, 721, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:120      0 AMB  10-1:120    5.50    (#    120:10  Double Ambig)
 &rst
  ixpk= 120, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 299, 748,
 igr2= 244, 721,
 &end
#
#   21 GLN  HN           17 ASN  HN          5.50    (#    121:10  Unique         2.37, 2.74 A)
 &rst
  ixpk= 121, nxpk= 10, iat= 306, 244, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:122     48 GLN  HN          5.50    (#    122:10  Single Ambig)
 &rst
  ixpk= 122, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782,1653,1661,
 &end
#
#   16 CYS  HA           17 ASN  HN          3.50    (#    123:10  Unique         2.21, 2.34 A)
 &rst
  ixpk= 123, nxpk= 10, iat= 235, 244, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:125     48 GLN  HN          3.50    (#    125:10  Single Ambig)
 &rst
  ixpk= 125, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 689, 690, 723,
 &end
#
#   47 GLU  HA           48 GLN  HN          5.50    (#    126:10  Unique         3.53, 3.55 A)
 &rst
  ixpk= 126, nxpk= 10, iat= 708, 721, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   48 GLN  HG+          48 GLN  HN          2.80    (#    127:10  Unique         1.98, 2.93 A)
 &rst
  ixpk= 127, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 728, 729,
 &end
#
#   48 GLN  HB+          48 GLN  HN          2.80    (#    128:10  Unique         2.40, 3.05 A)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 725, 726,
 &end
#
#   48 GLN  HB-          48 GLN  HN          2.80    (#    129:10  Unique         2.40, 3.05 A)
 &rst
  ixpk= 129, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 725, 726,
 &end
#
#   47 GLU  HB-          48 GLN  HN          3.50    (#    130:10  Unique         2.45, 3.12 A)
 &rst
  ixpk= 130, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 710, 711,
 &end
#
#    0 AMB  10-2:131      0 AMB  10-1:131    4.20    (#    131:10  Double Ambig)
 &rst
  ixpk= 131, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.13, r4= 7.88,
 igr1= 742, 743, 744, 700, 701, 702, 265, 266, 626, 627,
       755, 756,
 igr2= 721, 244,
 &end
#
#    0 AMB  10-2:132      0 AMB  10-1:132    5.50    (#    132:10  Double Ambig)
 &rst
  ixpk= 132, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.49, r4=11.24,
 igr1=2570,2571,2572,2574,2575,2576, 162, 163, 164, 166,
       167, 168,1073,1074,1075,1077,1078,1079,1729,1730,
      1731,1733,1734,1735,
 igr2= 244, 721,
 &end
#
#    0 AMB  10-2:133     17 ASN  HN          5.50    (#    133:10  Single Ambig)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 244, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2617,2618,2619,2621,2622,2623,2570,2571,2572,2574,
      2575,2576,
 &end
#
#   17 ASN  HA           17 ASN  HN          5.50    (#    134:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 134, nxpk= 10, iat= 246, 244, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  117 SER  HN          116 SER  HN          5.50    (#    135:10  Unique         4.48, 4.59 A)
 &rst
  ixpk= 135, nxpk= 10, iat=1902,1891, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:136    116 SER  HN          5.50    (#    136:10  Single Ambig)
 &rst
  ixpk= 136, nxpk= 10, iat=  -1,1891, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1941, 438,
 &end
#
#  115 THR  HN          116 SER  HN          2.80    (#    137:10  Unique         2.77, 3.03 A)
 &rst
  ixpk= 137, nxpk= 10, iat=1877,1891, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   19 GLN  HN           18 ARG  HN          4.20    (#    138:10  Unique         2.62, 2.70 A)
 &rst
  ixpk= 138, nxpk= 10, iat= 282, 258, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  112 ASN  HD2-        116 SER  HN          5.50    (#    140:10  Unique         5.02, 5.99 A)
 &rst
  ixpk= 140, nxpk= 10, iat=  -1,1891, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1838,1839,
 &end
#
#   17 ASN  HA           18 ARG  HN          3.50    (#    141:10  Unique         2.46, 2.56 A)
 &rst
  ixpk= 141, nxpk= 10, iat= 246, 258, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:142    116 SER  HN          2.80    (#    142:10  Single Ambig)
 &rst
  ixpk= 142, nxpk= 10, iat=  -1,1891, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1893,1862,
 &end
#
#  115 THR  HB          116 SER  HN          4.20    (#    145:10  Unique         2.10, 2.49 A)
 &rst
  ixpk= 145, nxpk= 10, iat=1881,1891, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  116 SER  HB-         116 SER  HN          2.80    (#    146:10  Unique         2.11, 2.79 A)
 &rst
  ixpk= 146, nxpk= 10, iat=  -1,1891, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1895,1896,
 &end
#
#   18 ARG  HD+          18 ARG  HN          5.50    (#    147:10  Unique         1.95, 3.20 A)
 &rst
  ixpk= 147, nxpk= 10, iat=  -1, 258, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 268, 269,
 &end
#
#   17 ASN  HB+          18 ARG  HN          3.50    (#    148:10  Unique         2.10, 2.97 A)
 &rst
  ixpk= 148, nxpk= 10, iat=  -1, 258, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 248, 249,
 &end
#
#    0 AMB  10-2:149      0 AMB  10-1:149    4.20    (#    149:10  Double Ambig)
 &rst
  ixpk= 149, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1864,1865,1867,1868,2634,2635,
 igr2=1891, 258,
 &end
#
#   18 ARG  HB+          18 ARG  HN          3.50    (#    150:10  Unique         2.13, 2.95 A)
 &rst
  ixpk= 150, nxpk= 10, iat=  -1, 258, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 262, 263,
 &end
#
#   18 ARG  HB-          18 ARG  HN          2.80    (#    151:10  Unique         2.13, 2.95 A)
 &rst
  ixpk= 151, nxpk= 10, iat=  -1, 258, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 262, 263,
 &end
#
#   18 ARG  HG-          18 ARG  HN          3.50    (#    152:10  Unique         2.04, 3.64 A)
 &rst
  ixpk= 152, nxpk= 10, iat=  -1, 258, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 265, 266,
 &end
#
#  115 THR  MG2         116 SER  HN          4.20    (#    153:10  Unique         4.16, 4.70 A)
 &rst
  ixpk= 153, nxpk= 10, iat=  -1,1891, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1883,1884,1885,
 &end
#
#    0 AMB  10-2:154     19 GLN  HN          5.50    (#    154:10  Single Ambig)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2617,2618,2619,2621,2622,2623,2617,2618,2619,2621,
      2622,2623,2570,2571,2572,2574,2575,2576,
 &end
#
#   18 ARG  HG-          19 GLN  HN          5.50    (#    155:10  Unique         4.45, 5.37 A)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 265, 266,
 &end
#
#    0 AMB  10-2:156     19 GLN  HN          2.80    (#    156:10  Single Ambig)
 &rst
  ixpk= 156, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 286, 287, 262, 263,
 &end
#
#   18 ARG  HB+          19 GLN  HN          4.20    (#    157:10  Unique         3.45, 3.99 A)
 &rst
  ixpk= 157, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 262, 263,
 &end
#
#    0 AMB  10-2:158     19 GLN  HN          2.80    (#    158:10  Single Ambig)
 &rst
  ixpk= 158, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 289, 290, 286, 287,
 &end
#
#   17 ASN  HB+          19 GLN  HN          5.50    (#    159:10  Unique         2.23, 3.34 A)
 &rst
  ixpk= 159, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 248, 249,
 &end
#
#   20 GLY  HA-          19 GLN  HN          5.50    (#    160:10  Unique         4.28, 4.60 A)
 &rst
  ixpk= 160, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 301, 302,
 &end
#
#   18 ARG  HA           19 GLN  HN          3.50    (#    161:10  Unique         2.99, 3.17 A)
 &rst
  ixpk= 161, nxpk= 10, iat= 260, 282, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   19 GLN  HA           19 GLN  HN          2.80    (#    162:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 162, nxpk= 10, iat= 284, 282, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   17 ASN  HA           19 GLN  HN          5.50    (#    163:10  Unique         3.90, 3.99 A)
 &rst
  ixpk= 163, nxpk= 10, iat= 246, 282, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   19 GLN  HE2-         19 GLN  HN          5.50    (#    164:10  Unique         2.93, 4.10 A)
 &rst
  ixpk= 164, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 294, 295,
 &end
#
#   17 ASN  HN           19 GLN  HN          5.50    (#    165:10  Unique         3.79, 3.93 A)
 &rst
  ixpk= 165, nxpk= 10, iat= 244, 282, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   18 ARG  HN           19 GLN  HN          2.80    (#    166:10  Unique         2.62, 2.70 A)
 &rst
  ixpk= 166, nxpk= 10, iat= 258, 282, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   20 GLY  HN           19 GLN  HN          2.80    (#    167:10  Unique         1.94, 2.08 A)
 &rst
  ixpk= 167, nxpk= 10, iat= 299, 282, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:168     20 GLY  HN          3.50    (#    168:10  Single Ambig)
 &rst
  ixpk= 168, nxpk= 10, iat=  -1, 299, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2617,2618,2619,2621,2622,2623,2570,2571,2572,2574,
      2575,2576,
 &end
#
#    0 AMB  10-2:170     20 GLY  HN          3.50    (#    170:10  Single Ambig)
 &rst
  ixpk= 170, nxpk= 10, iat=  -1, 299, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 286, 287,2615,2612,2613,
 &end
#
#    0 AMB  10-2:171     20 GLY  HN          3.50    (#    171:10  Single Ambig)
 &rst
  ixpk= 171, nxpk= 10, iat=  -1, 299, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2631,2632, 286, 287, 313, 314, 289, 290,
 &end
#
#   20 GLY  HA-          20 GLY  HN          2.80    (#    172:10  Unique         2.30, 2.62 A)
 &rst
  ixpk= 172, nxpk= 10, iat=  -1, 299, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 301, 302,
 &end
#
#   20 GLY  HA+          20 GLY  HN          2.80    (#    173:10  Unique         2.30, 2.62 A)
 &rst
  ixpk= 173, nxpk= 10, iat=  -1, 299, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 301, 302,
 &end
#
#   19 GLN  HA           20 GLY  HN          4.20    (#    174:10  Unique         3.19, 3.33 A)
 &rst
  ixpk= 174, nxpk= 10, iat= 284, 299, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   19 GLN  HN           20 GLY  HN          2.80    (#    175:10  Unique         1.94, 2.08 A)
 &rst
  ixpk= 175, nxpk= 10, iat= 282, 299, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:176     21 GLN  HN          4.20    (#    176:10  Single Ambig)
 &rst
  ixpk= 176, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=2617,2618,2619,2621,2622,2623, 329, 330, 331, 333,
       334, 335,
 &end
#
#   17 ASN  HB-          21 GLN  HN          5.50    (#    177:10  Unique         2.14, 4.26 A)
 &rst
  ixpk= 177, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 248, 249,
 &end
#
#   21 GLN  HB+          21 GLN  HN          2.80    (#    178:10  Unique         2.44, 3.25 A)
 &rst
  ixpk= 178, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 310, 311,
 &end
#
#   21 GLN  HG+          21 GLN  HN          2.80    (#    179:10  Unique         1.94, 3.20 A)
 &rst
  ixpk= 179, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 313, 314,
 &end
#
#   17 ASN  HB+          21 GLN  HN          5.50    (#    180:10  Unique         2.14, 4.26 A)
 &rst
  ixpk= 180, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 248, 249,
 &end
#
#   20 GLY  HA-          21 GLN  HN          4.20    (#    181:10  Unique         2.84, 3.20 A)
 &rst
  ixpk= 181, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 301, 302,
 &end
#
#   20 GLY  HA+          21 GLN  HN          5.50    (#    182:10  Unique         2.84, 3.20 A)
 &rst
  ixpk= 182, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 301, 302,
 &end
#
#  128 SER  HA           21 GLN  HN          5.50    (#    183:10  Unique         4.79, 5.50 A)
 &rst
  ixpk= 183, nxpk= 10, iat=2085, 306, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   21 GLN  HA           21 GLN  HN          3.50    (#    184:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 184, nxpk= 10, iat= 308, 306, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   16 CYS  HA           21 GLN  HN          5.50    (#    185:10  Unique         3.93, 4.35 A)
 &rst
  ixpk= 185, nxpk= 10, iat= 235, 306, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  159 GLN  HE2-         21 GLN  HN          5.50    (#    186:10  Unique         5.37, 6.03 A)
 &rst
  ixpk= 186, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2639,2640,
 &end
#
#   17 ASN  HN           21 GLN  HN          4.20    (#    188:10  Unique         2.37, 2.74 A)
 &rst
  ixpk= 188, nxpk= 10, iat= 244, 306, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   20 GLY  HN           21 GLN  HN          2.80    (#    189:10  Unique         2.18, 2.38 A)
 &rst
  ixpk= 189, nxpk= 10, iat= 299, 306, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   22 VAL  HN           21 GLN  HN          5.50    (#    190:10  Unique         4.40, 4.47 A)
 &rst
  ixpk= 190, nxpk= 10, iat= 323, 306, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  127 VAL  MGX          22 VAL  HN          5.50    (#    191:10  Unique         3.17, 5.73 A)
 &rst
  ixpk= 191, nxpk= 10, iat=  -1, 323, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#   22 VAL  MGX          22 VAL  HN          3.50    (#    192:10  Unique         1.95, 3.73 A)
 &rst
  ixpk= 192, nxpk= 10, iat=  -1, 323, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   21 GLN  HB+          22 VAL  HN          5.50    (#    193:10  Unique         1.93, 3.05 A)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1, 323, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 310, 311,
 &end
#
#   21 GLN  HG-          22 VAL  HN          5.50    (#    194:10  Unique         3.90, 4.76 A)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1, 323, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 313, 314,
 &end
#
#   22 VAL  HB           22 VAL  HN          5.50    (#    195:10  Unique         2.36, 3.05 A)
 &rst
  ixpk= 195, nxpk= 10, iat= 327, 323, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   21 GLN  HA           22 VAL  HN          3.50    (#    196:10  Unique         2.19, 2.38 A)
 &rst
  ixpk= 196, nxpk= 10, iat= 308, 323, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   21 GLN  HN           22 VAL  HN          5.50    (#    197:10  Unique         4.40, 4.47 A)
 &rst
  ixpk= 197, nxpk= 10, iat= 306, 323, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  127 VAL  HN           22 VAL  HN          5.50    (#    198:10  Unique         2.37, 3.18 A)
 &rst
  ixpk= 198, nxpk= 10, iat=2067, 323, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   22 VAL  MGX          23 MET  HN          3.50    (#    199:10  Unique         1.97, 3.92 A)
 &rst
  ixpk= 199, nxpk= 10, iat=  -1, 339, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   15 ILE  HG1+         23 MET  HN          5.50    (#    200:10  Unique         4.67, 5.66 A)
 &rst
  ixpk= 200, nxpk= 10, iat=  -1, 339, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 224, 225,
 &end
#
#    0 AMB  10-2:201     23 MET  HN          5.50    (#    201:10  Single Ambig)
 &rst
  ixpk= 201, nxpk= 10, iat=  -1, 339, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 218, 310, 311,
 &end
#
#   22 VAL  HB           23 MET  HN          5.50    (#    202:10  Unique         2.37, 3.45 A)
 &rst
  ixpk= 202, nxpk= 10, iat= 327, 339, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:203     23 MET  HN          5.50    (#    203:10  Single Ambig)
 &rst
  ixpk= 203, nxpk= 10, iat=  -1, 339, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2047,2048, 248, 249,1999,2000,
 &end
#
#   22 VAL  HA           23 MET  HN          5.50    (#    205:10  Unique         2.22, 2.32 A)
 &rst
  ixpk= 205, nxpk= 10, iat= 325, 339, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:206     23 MET  HN          5.50    (#    206:10  Single Ambig)
 &rst
  ixpk= 206, nxpk= 10, iat=  -1, 339, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 561, 565, 559, 567,
 &end
#
#    0 AMB  10-2:207     24 TRP  HN          5.50    (#    207:10  Single Ambig)
 &rst
  ixpk= 207, nxpk= 10, iat=  -1, 356, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2023,2024, 218,1854,1855,1856, 310, 311,
 &end
#
#   23 MET  HA           24 TRP  HN          5.50    (#    209:10  Unique         2.14, 2.22 A)
 &rst
  ixpk= 209, nxpk= 10, iat= 341, 356, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:210     24 TRP  HN          5.50    (#    210:10  Single Ambig)
 &rst
  ixpk= 210, nxpk= 10, iat=  -1, 356, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 341, 358,
 &end
#
#   25 ALA  MB           25 ALA  HN          4.20    (#    212:10  Unique         2.22, 3.22 A)
 &rst
  ixpk= 212, nxpk= 10, iat=  -1, 380, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1= 384, 385, 386,
 &end
#
#  125 ARG  HG-          25 ALA  HN          5.50    (#    213:10  Unique         5.30, 9.11 A)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 380, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2026,2027,
 &end
#
#   25 ALA  MB           26 ARG  HN          4.20    (#    218:10  Unique         2.91, 3.72 A)
 &rst
  ixpk= 218, nxpk= 10, iat=  -1, 390, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1= 384, 385, 386,
 &end
#
#    0 AMB  10-2:219     26 ARG  HN          5.50    (#    219:10  Single Ambig)
 &rst
  ixpk= 219, nxpk= 10, iat=  -1, 390, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=2023,2024,1854,1855,1856,
 &end
#
#    0 AMB  10-2:220     26 ARG  HN          5.50    (#    220:10  Single Ambig)
 &rst
  ixpk= 220, nxpk= 10, iat=  -1, 390, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=2023,2024,1854,1855,1856,
 &end
#
#    0 AMB  10-2:221     26 ARG  HN          5.50    (#    221:10  Single Ambig)
 &rst
  ixpk= 221, nxpk= 10, iat=  -1, 390, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 392, 514, 515,1960,1961,
 &end
#
#   25 ALA  HA           26 ARG  HN          4.20    (#    222:10  Unique         2.14, 2.21 A)
 &rst
  ixpk= 222, nxpk= 10, iat= 382, 390, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  124 TRP  HA           26 ARG  HN          5.50    (#    223:10  Unique         3.95, 4.98 A)
 &rst
  ixpk= 223, nxpk= 10, iat=1997, 390, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:224     26 ARG  HN          5.50    (#    224:10  Single Ambig)
 &rst
  ixpk= 224, nxpk= 10, iat=  -1, 390, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1966,1970, 525,
 &end
#
#   27 ARG  HN           26 ARG  HN          5.50    (#    225:10  Unique         3.99, 4.37 A)
 &rst
  ixpk= 225, nxpk= 10, iat= 414, 390, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:227     27 ARG  HN          4.20    (#    227:10  Single Ambig)
 &rst
  ixpk= 227, nxpk= 10, iat=  -1, 414, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1= 392, 514, 515,
 &end
#
#   27 ARG  HB+          27 ARG  HN          4.20    (#    228:10  Unique         2.13, 3.03 A)
 &rst
  ixpk= 228, nxpk= 10, iat=  -1, 414, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 418, 419,
 &end
#
#   27 ARG  HG-          27 ARG  HN          4.20    (#    229:10  Unique         2.20, 3.01 A)
 &rst
  ixpk= 229, nxpk= 10, iat=  -1, 414, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 421, 422,
 &end
#
#   27 ARG  HG+          27 ARG  HN          5.50    (#    230:10  Unique         2.20, 3.01 A)
 &rst
  ixpk= 230, nxpk= 10, iat=  -1, 414, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 421, 422,
 &end
#
#   28 PHE  HD           28 PHE  HN          4.20    (#    232:10  Unique         2.57, 3.82 A)
 &rst
  ixpk= 232, nxpk= 10, iat=  -1, 438, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 446, 454,
 &end
#
#  121 PHE  HA           28 PHE  HN          4.20    (#    233:10  Unique         4.66, 6.20 A)
 &rst
  ixpk= 233, nxpk= 10, iat=1958, 438, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   27 ARG  HA           28 PHE  HN          4.20    (#    234:10  Unique         2.20, 2.62 A)
 &rst
  ixpk= 234, nxpk= 10, iat= 416, 438, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   28 PHE  HA           28 PHE  HN          5.50    (#    235:10  Unique         2.72, 2.78 A)
 &rst
  ixpk= 235, nxpk= 10, iat= 440, 438, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   28 PHE  HB+          28 PHE  HN          4.20    (#    236:10  Unique         2.09, 2.88 A)
 &rst
  ixpk= 236, nxpk= 10, iat=  -1, 438, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 442, 443,
 &end
#
#   28 PHE  HB-          28 PHE  HN          3.50    (#    237:10  Unique         2.09, 2.88 A)
 &rst
  ixpk= 237, nxpk= 10, iat=  -1, 438, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 442, 443,
 &end
#
#   30 GLN  HB-          28 PHE  HN          5.50    (#    238:10  Unique         5.14, 9.23 A)
 &rst
  ixpk= 238, nxpk= 10, iat=  -1, 438, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 469, 470,
 &end
#
#   30 GLN  HN           29 GLY  HN          4.20    (#    240:10  Unique         2.80, 3.91 A)
 &rst
  ixpk= 240, nxpk= 10, iat= 465, 458, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:241     29 GLY  HN          5.50    (#    241:10  Single Ambig)
 &rst
  ixpk= 241, nxpk= 10, iat=  -1, 458, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 448, 452, 495,
 &end
#
#   28 PHE  HD           29 GLY  HN          5.50    (#    242:10  Unique         2.75, 4.67 A)
 &rst
  ixpk= 242, nxpk= 10, iat=  -1, 458, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 446, 454,
 &end
#
#   29 GLY  HA+          29 GLY  HN          2.80    (#    244:10  Unique         2.30, 2.74 A)
 &rst
  ixpk= 244, nxpk= 10, iat=  -1, 458, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 460, 461,
 &end
#
#   28 PHE  HA           29 GLY  HN          2.80    (#    245:10  Unique         2.14, 2.19 A)
 &rst
  ixpk= 245, nxpk= 10, iat= 440, 458, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   29 GLY  HA-          29 GLY  HN          2.80    (#    247:10  Unique         2.30, 2.74 A)
 &rst
  ixpk= 247, nxpk= 10, iat=  -1, 458, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 460, 461,
 &end
#
#  122 ASP  HB+          29 GLY  HN          5.50    (#    248:10  Unique         6.74, 9.72 A)
 &rst
  ixpk= 248, nxpk= 10, iat=  -1, 458, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1980,1981,
 &end
#
#   28 PHE  HB+          29 GLY  HN          5.50    (#    249:10  Unique         2.71, 3.84 A)
 &rst
  ixpk= 249, nxpk= 10, iat=  -1, 458, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 442, 443,
 &end
#
#   28 PHE  HB-          29 GLY  HN          4.20    (#    250:10  Unique         2.71, 3.84 A)
 &rst
  ixpk= 250, nxpk= 10, iat=  -1, 458, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 442, 443,
 &end
#
#   32 SER  HN           31 HIS  HN          5.50    (#    251:10  Unique         1.90, 2.85 A)
 &rst
  ixpk= 251, nxpk= 10, iat= 499, 482, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   31 HIS  HA           31 HIS  HN          5.50    (#    253:10  Unique         2.78, 2.90 A)
 &rst
  ixpk= 253, nxpk= 10, iat= 484, 482, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   30 GLN  HA           31 HIS  HN          4.20    (#    254:10  Unique         2.15, 2.59 A)
 &rst
  ixpk= 254, nxpk= 10, iat= 467, 482, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   31 HIS  HB-          31 HIS  HN          5.50    (#    255:10  Unique         2.18, 3.10 A)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1, 482, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 486, 487,
 &end
#
#   31 HIS  HB+          31 HIS  HN          5.50    (#    256:10  Unique         2.18, 3.10 A)
 &rst
  ixpk= 256, nxpk= 10, iat=  -1, 482, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 486, 487,
 &end
#
#   30 GLN  HB+          31 HIS  HN          4.20    (#    257:10  Unique         1.92, 2.73 A)
 &rst
  ixpk= 257, nxpk= 10, iat=  -1, 482, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 469, 470,
 &end
#
#   31 HIS  HN           32 SER  HN          4.20    (#    259:10  Unique         1.90, 2.85 A)
 &rst
  ixpk= 259, nxpk= 10, iat= 482, 499, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   33 TRP  HD1          32 SER  HN          5.50    (#    261:10  Unique         4.49, 5.23 A)
 &rst
  ixpk= 261, nxpk= 10, iat= 518, 499, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   31 HIS  HA           32 SER  HN          4.20    (#    263:10  Unique         2.59, 2.96 A)
 &rst
  ixpk= 263, nxpk= 10, iat= 484, 499, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:264     32 SER  HN          3.50    (#    264:10  Single Ambig)
 &rst
  ixpk= 264, nxpk= 10, iat=  -1, 499, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 503, 504, 503, 504,
 &end
#
#   30 GLN  HB+          32 SER  HN          3.50    (#    265:10  Unique         2.34, 3.31 A)
 &rst
  ixpk= 265, nxpk= 10, iat=  -1, 499, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 469, 470,
 &end
#
#   30 GLN  HB-          32 SER  HN          3.50    (#    266:10  Unique         2.34, 3.31 A)
 &rst
  ixpk= 266, nxpk= 10, iat=  -1, 499, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 469, 470,
 &end
#
#    0 AMB  10-2:267     32 SER  HN          5.50    (#    267:10  Single Ambig)
 &rst
  ixpk= 267, nxpk= 10, iat=  -1, 499, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 418, 419,1948,1949,
 &end
#
#   48 GLN  HN           49 ALA  HN          3.50    (#    268:10  Unique         2.71, 2.76 A)
 &rst
  ixpk= 268, nxpk= 10, iat= 721, 738, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   33 TRP  HD1          33 TRP  HN          3.50    (#    269:10  Unique         1.91, 2.54 A)
 &rst
  ixpk= 269, nxpk= 10, iat= 518, 510, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   32 SER  HN           33 TRP  HN          5.50    (#    270:10  Unique         4.26, 4.48 A)
 &rst
  ixpk= 270, nxpk= 10, iat= 499, 510, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   32 SER  HA           33 TRP  HN          2.80    (#    271:10  Unique         2.14, 2.27 A)
 &rst
  ixpk= 271, nxpk= 10, iat= 501, 510, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:272     33 TRP  HN          2.80    (#    272:10  Single Ambig)
 &rst
  ixpk= 272, nxpk= 10, iat=  -1, 510, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 503, 504, 503, 504,
 &end
#
#    0 AMB  10-2:274     33 TRP  HN          4.20    (#    274:10  Single Ambig)
 &rst
  ixpk= 274, nxpk= 10, iat=  -1, 510, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 469, 470,2218,2219,
 &end
#
#  135 GLN  HB-          33 TRP  HN          4.20    (#    275:10  Unique         6.64, 9.23 A)
 &rst
  ixpk= 275, nxpk= 10, iat=  -1, 510, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2218,2219,
 &end
#
#   34 GLN  HA           34 GLN  HN          5.50    (#    276:10  Unique         2.79, 2.88 A)
 &rst
  ixpk= 276, nxpk= 10, iat= 536, 534, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   33 TRP  HA           34 GLN  HN          4.20    (#    277:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 277, nxpk= 10, iat= 512, 534, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   34 GLN  HB+          34 GLN  HN          5.50    (#    279:10  Unique         2.59, 3.30 A)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1, 534, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 538, 539,
 &end
#
#   34 GLN  HG+          34 GLN  HN          5.50    (#    280:10  Unique         2.72, 4.23 A)
 &rst
  ixpk= 280, nxpk= 10, iat=  -1, 534, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 541, 542,
 &end
#
#   34 GLN  HA           35 PHE  HN          4.20    (#    282:10  Unique         2.59, 2.98 A)
 &rst
  ixpk= 282, nxpk= 10, iat= 536, 551, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   35 PHE  HB+          35 PHE  HN          5.50    (#    283:10  Unique         2.16, 3.07 A)
 &rst
  ixpk= 283, nxpk= 10, iat=  -1, 551, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 555, 556,
 &end
#
#   34 GLN  HG+          35 PHE  HN          5.50    (#    284:10  Unique         1.96, 3.89 A)
 &rst
  ixpk= 284, nxpk= 10, iat=  -1, 551, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 541, 542,
 &end
#
#    0 AMB  10-2:286     37 GLN  HN          5.50    (#    286:10  Single Ambig)
 &rst
  ixpk= 286, nxpk= 10, iat=  -1, 585, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1= 900, 901, 902, 904, 905, 906, 185, 186, 187, 227,
       228, 229, 834, 835, 836, 838, 839, 840,
 &end
#
#   30 GLN  HB-          30 GLN  HN          2.80    (#    287:10  Unique         2.46, 3.23 A)
 &rst
  ixpk= 287, nxpk= 10, iat=  -1, 465, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 469, 470,
 &end
#
#   37 GLN  HA           37 GLN  HN          5.50    (#    289:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 289, nxpk= 10, iat= 587, 585, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   30 GLN  HA           30 GLN  HN          5.50    (#    291:10  Unique         2.28, 2.88 A)
 &rst
  ixpk= 291, nxpk= 10, iat= 467, 465, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   29 GLY  HA+          30 GLN  HN          3.50    (#    292:10  Unique         2.14, 2.76 A)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1, 465, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 460, 461,
 &end
#
#   29 GLY  HA-          30 GLN  HN          3.50    (#    293:10  Unique         2.14, 2.76 A)
 &rst
  ixpk= 293, nxpk= 10, iat=  -1, 465, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 460, 461,
 &end
#
#   37 GLN  HB-          37 GLN  HN          3.50    (#    294:10  Unique         2.30, 3.19 A)
 &rst
  ixpk= 294, nxpk= 10, iat=  -1, 585, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 589, 590,
 &end
#
#   36 PRO  HB-          37 GLN  HN          4.20    (#    295:10  Unique         3.24, 4.06 A)
 &rst
  ixpk= 295, nxpk= 10, iat=  -1, 585, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 578, 579,
 &end
#
#   36 PRO  HB+          37 GLN  HN          5.50    (#    296:10  Unique         3.24, 4.06 A)
 &rst
  ixpk= 296, nxpk= 10, iat=  -1, 585, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 578, 579,
 &end
#
#    0 AMB  10-2:298     30 GLN  HN          3.50    (#    298:10  Single Ambig)
 &rst
  ixpk= 298, nxpk= 10, iat=  -1, 465, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 458, 482,
 &end
#
#   30 GLN  HG+          30 GLN  HN          2.80    (#    299:10  Unique         2.02, 3.35 A)
 &rst
  ixpk= 299, nxpk= 10, iat=  -1, 465, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 472, 473,
 &end
#
#   30 GLN  HA           30 GLN  HN          3.50    (#    300:10  Unique         2.28, 2.88 A)
 &rst
  ixpk= 300, nxpk= 10, iat= 467, 465, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:301      0 AMB  10-1:301    5.50    (#    301:10  Double Ambig)
 &rst
  ixpk= 301, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 421, 422, 421, 422,
 igr2= 585, 465,
 &end
#
#    0 AMB  10-2:302      0 AMB  10-1:302    5.50    (#    302:10  Double Ambig)
 &rst
  ixpk= 302, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 418, 419, 418, 419,
 igr2= 585, 465,
 &end
#
#   11 VAL  MGX          38 GLY  HN          3.50    (#    303:10  Unique         1.98, 5.33 A)
 &rst
  ixpk= 303, nxpk= 10, iat=  -1, 602, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  10-2:304     38 GLY  HN          4.20    (#    304:10  Single Ambig)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1, 602, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 589, 590, 589, 590,
 &end
#
#   37 GLN  HG+          38 GLY  HN          4.20    (#    305:10  Unique         3.03, 4.46 A)
 &rst
  ixpk= 305, nxpk= 10, iat=  -1, 602, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 592, 593,
 &end
#
#   10 ASN  HB-          38 GLY  HN          5.50    (#    306:10  Unique         5.52, 6.33 A)
 &rst
  ixpk= 306, nxpk= 10, iat=  -1, 602, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 146, 147,
 &end
#
#   38 GLY  HA-          38 GLY  HN          4.20    (#    307:10  Unique         2.51, 2.77 A)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1, 602, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 604, 605,
 &end
#
#    0 AMB  10-2:308     38 GLY  HN          3.50    (#    308:10  Single Ambig)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1, 602, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 604, 605, 611, 612,
 &end
#
#   37 GLN  HA           38 GLY  HN          3.50    (#    310:10  Unique         2.20, 2.29 A)
 &rst
  ixpk= 310, nxpk= 10, iat= 587, 602, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   10 ASN  HA           38 GLY  HN          5.50    (#    311:10  Unique         4.93, 5.20 A)
 &rst
  ixpk= 311, nxpk= 10, iat= 144, 602, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   13 ILE  HN           38 GLY  HN          5.50    (#    312:10  Unique         5.36, 5.52 A)
 &rst
  ixpk= 312, nxpk= 10, iat= 179, 602, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   13 ILE  HN           38 GLY  HN          5.50    (#    313:10  Unique         5.36, 5.52 A)
 &rst
  ixpk= 313, nxpk= 10, iat= 179, 602, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   37 GLN  HN           38 GLY  HN          5.50    (#    314:10  Unique         4.36, 4.47 A)
 &rst
  ixpk= 314, nxpk= 10, iat= 585, 602, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   39 GLY  HN           38 GLY  HN          5.50    (#    315:10  Unique         1.82, 1.89 A)
 &rst
  ixpk= 315, nxpk= 10, iat= 609, 602, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   11 VAL  HN           38 GLY  HN          4.20    (#    316:10  Unique         3.22, 3.53 A)
 &rst
  ixpk= 316, nxpk= 10, iat= 156, 602, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   38 GLY  HA-          39 GLY  HN          2.80    (#    319:10  Unique         2.74, 3.25 A)
 &rst
  ixpk= 319, nxpk= 10, iat=  -1, 609, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 604, 605,
 &end
#
#   39 GLY  HA-          39 GLY  HN          2.80    (#    320:10  Unique         2.29, 2.58 A)
 &rst
  ixpk= 320, nxpk= 10, iat=  -1, 609, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 611, 612,
 &end
#
#    0 AMB  10-2:322     39 GLY  HN          2.80    (#    322:10  Single Ambig)
 &rst
  ixpk= 322, nxpk= 10, iat=  -1, 609, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 611, 612, 604, 605,
 &end
#
#    0 AMB  10-2:324     39 GLY  HN          5.50    (#    324:10  Single Ambig)
 &rst
  ixpk= 324, nxpk= 10, iat=  -1, 609, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 144, 158,
 &end
#
#   40 ILE  HN           39 GLY  HN          4.20    (#    326:10  Unique         3.85, 4.28 A)
 &rst
  ixpk= 326, nxpk= 10, iat= 616, 609, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   38 GLY  HN           39 GLY  HN          5.50    (#    329:10  Unique         1.82, 1.89 A)
 &rst
  ixpk= 329, nxpk= 10, iat= 602, 609, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   11 VAL  HN           39 GLY  HN          5.50    (#    330:10  Unique         2.26, 2.72 A)
 &rst
  ixpk= 330, nxpk= 10, iat= 156, 609, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   40 ILE  HG1+         40 ILE  HN          4.20    (#    331:10  Unique         2.07, 3.08 A)
 &rst
  ixpk= 331, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 626, 627,
 &end
#
#   40 ILE  QG2          40 ILE  HN          4.20    (#    332:10  Unique         4.28, 4.56 A)
 &rst
  ixpk= 332, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  10-2:333     40 ILE  HN          2.80    (#    333:10  Single Ambig)
 &rst
  ixpk= 333, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1= 626, 627, 620,
 &end
#
#    9 PRO  HB+          40 ILE  HN          5.50    (#    334:10  Unique         3.01, 4.27 A)
 &rst
  ixpk= 334, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 135, 136,
 &end
#
#   39 GLY  HA-          40 ILE  HN          3.50    (#    336:10  Unique         2.14, 2.60 A)
 &rst
  ixpk= 336, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 611, 612,
 &end
#
#   40 ILE  HA           40 ILE  HN          4.20    (#    337:10  Unique         2.86, 2.91 A)
 &rst
  ixpk= 337, nxpk= 10, iat= 618, 616, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   39 GLY  HA+          40 ILE  HN          3.50    (#    338:10  Unique         2.14, 2.60 A)
 &rst
  ixpk= 338, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 611, 612,
 &end
#
#   10 ASN  HA           40 ILE  HN          3.50    (#    340:10  Unique         1.97, 2.66 A)
 &rst
  ixpk= 340, nxpk= 10, iat= 144, 616, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   10 ASN  HD2-         40 ILE  HN          5.50    (#    341:10  Unique         3.72, 4.55 A)
 &rst
  ixpk= 341, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 151, 152,
 &end
#
#   10 ASN  HD2+         40 ILE  HN          5.50    (#    342:10  Unique         3.72, 4.55 A)
 &rst
  ixpk= 342, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 151, 152,
 &end
#
#    0 AMB  10-2:343     40 ILE  HN          5.50    (#    343:10  Single Ambig)
 &rst
  ixpk= 343, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 644, 645,1634,
 &end
#
#   39 GLY  HN           40 ILE  HN          5.50    (#    344:10  Unique         3.85, 4.28 A)
 &rst
  ixpk= 344, nxpk= 10, iat= 609, 616, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   11 VAL  HN           40 ILE  HN          5.50    (#    345:10  Unique         3.42, 3.91 A)
 &rst
  ixpk= 345, nxpk= 10, iat= 156, 616, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:348     15 ILE  HN          3.50    (#    348:10  Single Ambig)
 &rst
  ixpk= 348, nxpk= 10, iat=  -1, 214, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 224, 225, 227, 228, 229,
 &end
#
#   40 ILE  QG2          41 ASN  HN          3.50    (#    349:10  Unique         2.06, 3.28 A)
 &rst
  ixpk= 349, nxpk= 10, iat=  -1, 635, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 622, 623, 624,
 &end
#
#   49 ALA  MB           41 ASN  HN          3.50    (#    350:10  Unique         1.94, 3.28 A)
 &rst
  ixpk= 350, nxpk= 10, iat=  -1, 635, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 742, 743, 744,
 &end
#
#   44 GLU  HB+          41 ASN  HN          3.50    (#    351:10  Unique         2.30, 3.11 A)
 &rst
  ixpk= 351, nxpk= 10, iat=  -1, 635, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 674, 675,
 &end
#
#   41 ASN  HB-          41 ASN  HN          4.20    (#    352:10  Unique         2.11, 2.81 A)
 &rst
  ixpk= 352, nxpk= 10, iat=  -1, 635, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 639, 640,
 &end
#
#   41 ASN  HB+          41 ASN  HN          4.20    (#    353:10  Unique         2.11, 2.81 A)
 &rst
  ixpk= 353, nxpk= 10, iat=  -1, 635, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 639, 640,
 &end
#
#   40 ILE  HA           41 ASN  HN          2.80    (#    354:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 354, nxpk= 10, iat= 618, 635, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   41 ASN  HA           41 ASN  HN          5.50    (#    356:10  Unique         2.75, 2.79 A)
 &rst
  ixpk= 356, nxpk= 10, iat= 637, 635, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   52 ARG  HE           41 ASN  HN          5.50    (#    358:10  Unique         4.11, 5.02 A)
 &rst
  ixpk= 358, nxpk= 10, iat= 799, 635, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   41 ASN  HD2+         41 ASN  HN          5.50    (#    359:10  Unique         4.87, 5.11 A)
 &rst
  ixpk= 359, nxpk= 10, iat=  -1, 635, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 644, 645,
 &end
#
#   40 ILE  QG2          43 GLY  HN          5.50    (#    360:10  Unique         3.60, 4.60 A)
 &rst
  ixpk= 360, nxpk= 10, iat=  -1, 663, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  10-2:361     43 GLY  HN          4.20    (#    361:10  Single Ambig)
 &rst
  ixpk= 361, nxpk= 10, iat=  -1, 663, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 656, 657, 135, 136,
 &end
#
#    0 AMB  10-2:362     43 GLY  HN          5.50    (#    362:10  Single Ambig)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1, 663, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=  15,  16,  17, 653, 654,
 &end
#
#    0 AMB  10-2:363     43 GLY  HN          4.20    (#    363:10  Single Ambig)
 &rst
  ixpk= 363, nxpk= 10, iat=  -1, 663, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1= 674, 675, 653, 654, 677, 678,
 &end
#
#   42 PRO  HB+          43 GLY  HN          4.20    (#    364:10  Unique         4.13, 4.39 A)
 &rst
  ixpk= 364, nxpk= 10, iat=  -1, 663, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 656, 657,
 &end
#
#   43 GLY  HA-          43 GLY  HN          2.80    (#    365:10  Unique         2.37, 2.71 A)
 &rst
  ixpk= 365, nxpk= 10, iat=  -1, 663, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 665, 666,
 &end
#
#   43 GLY  HA+          43 GLY  HN          2.80    (#    367:10  Unique         2.37, 2.71 A)
 &rst
  ixpk= 367, nxpk= 10, iat=  -1, 663, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 665, 666,
 &end
#
#   42 PRO  HA           43 GLY  HN          2.80    (#    368:10  Unique         2.29, 2.40 A)
 &rst
  ixpk= 368, nxpk= 10, iat= 659, 663, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   44 GLU  HN           43 GLY  HN          2.80    (#    371:10  Unique         1.86, 1.99 A)
 &rst
  ixpk= 371, nxpk= 10, iat= 670, 663, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   40 ILE  QG2          44 GLU  HN          3.50    (#    373:10  Unique         2.76, 3.60 A)
 &rst
  ixpk= 373, nxpk= 10, iat=  -1, 670, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  10-2:374     44 GLU  HN          5.50    (#    374:10  Single Ambig)
 &rst
  ixpk= 374, nxpk= 10, iat=  -1, 670, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 742, 743, 744, 626, 627,
 &end
#
#    0 AMB  10-2:375     44 GLU  HN          5.50    (#    375:10  Single Ambig)
 &rst
  ixpk= 375, nxpk= 10, iat=  -1, 670, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 135, 136, 656, 657,
 &end
#
#   44 GLU  HB+          44 GLU  HN          2.80    (#    376:10  Unique         2.30, 2.83 A)
 &rst
  ixpk= 376, nxpk= 10, iat=  -1, 670, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 674, 675,
 &end
#
#   43 GLY  HA-          44 GLU  HN          3.50    (#    377:10  Unique         2.90, 3.25 A)
 &rst
  ixpk= 377, nxpk= 10, iat=  -1, 670, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 665, 666,
 &end
#
#   43 GLY  HA+          44 GLU  HN          3.50    (#    378:10  Unique         2.90, 3.25 A)
 &rst
  ixpk= 378, nxpk= 10, iat=  -1, 670, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 665, 666,
 &end
#
#   42 PRO  HA           44 GLU  HN          4.20    (#    379:10  Unique         3.88, 4.10 A)
 &rst
  ixpk= 379, nxpk= 10, iat= 659, 670, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   44 GLU  HA           44 GLU  HN          2.80    (#    381:10  Unique         2.85, 2.93 A)
 &rst
  ixpk= 381, nxpk= 10, iat= 672, 670, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   45 SER  HN           44 GLU  HN          5.50    (#    383:10  Unique         4.48, 4.53 A)
 &rst
  ixpk= 383, nxpk= 10, iat= 685, 670, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   43 GLY  HN           44 GLU  HN          3.50    (#    384:10  Unique         1.86, 1.99 A)
 &rst
  ixpk= 384, nxpk= 10, iat= 663, 670, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:385     45 SER  HN          5.50    (#    385:10  Single Ambig)
 &rst
  ixpk= 385, nxpk= 10, iat=  -1, 685, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 622, 623, 624, 629, 630, 631,
 &end
#
#    0 AMB  10-2:386     45 SER  HN          5.50    (#    386:10  Single Ambig)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1, 685, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 742, 743, 744, 626, 627,
 &end
#
#   44 GLU  HB+          45 SER  HN          2.80    (#    387:10  Unique         2.58, 3.60 A)
 &rst
  ixpk= 387, nxpk= 10, iat=  -1, 685, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 674, 675,
 &end
#
#   48 GLN  HG+          45 SER  HN          3.50    (#    388:10  Unique         2.55, 3.33 A)
 &rst
  ixpk= 388, nxpk= 10, iat=  -1, 685, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 728, 729,
 &end
#
#   45 SER  HB-          45 SER  HN          3.50    (#    389:10  Unique         2.15, 3.00 A)
 &rst
  ixpk= 389, nxpk= 10, iat=  -1, 685, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 689, 690,
 &end
#
#   45 SER  HB+          45 SER  HN          4.20    (#    390:10  Unique         2.15, 3.00 A)
 &rst
  ixpk= 390, nxpk= 10, iat=  -1, 685, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 689, 690,
 &end
#
#   44 GLU  HA           45 SER  HN          2.80    (#    391:10  Unique         2.22, 2.29 A)
 &rst
  ixpk= 391, nxpk= 10, iat= 672, 685, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   44 GLU  HN           45 SER  HN          5.50    (#    392:10  Unique         4.48, 4.53 A)
 &rst
  ixpk= 392, nxpk= 10, iat= 670, 685, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   48 GLN  HE2+         45 SER  HN          5.50    (#    393:10  Unique         3.24, 5.94 A)
 &rst
  ixpk= 393, nxpk= 10, iat=  -1, 685, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 733, 734,
 &end
#
#   49 ALA  HN           45 SER  HN          5.50    (#    394:10  Unique         3.44, 3.66 A)
 &rst
  ixpk= 394, nxpk= 10, iat= 738, 685, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   46 ALA  HN           45 SER  HN          5.50    (#    395:10  Unique         4.46, 4.54 A)
 &rst
  ixpk= 395, nxpk= 10, iat= 696, 685, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   47 GLU  HN           46 ALA  HN          3.50    (#    396:10  Unique         2.62, 2.68 A)
 &rst
  ixpk= 396, nxpk= 10, iat= 706, 696, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   49 ALA  HN           46 ALA  HN          5.50    (#    397:10  Unique         4.60, 4.67 A)
 &rst
  ixpk= 397, nxpk= 10, iat= 738, 696, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   48 GLN  HN           46 ALA  HN          5.50    (#    398:10  Unique         4.03, 4.12 A)
 &rst
  ixpk= 398, nxpk= 10, iat= 721, 696, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   74 TRP  HH2          46 ALA  HN          5.50    (#    399:10  Unique         4.17, 5.00 A)
 &rst
  ixpk= 399, nxpk= 10, iat=1171, 696, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   45 SER  HB+          46 ALA  HN          3.50    (#    401:10  Unique         2.04, 2.86 A)
 &rst
  ixpk= 401, nxpk= 10, iat=  -1, 696, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 689, 690,
 &end
#
#   46 ALA  HA           46 ALA  HN          2.80    (#    402:10  Unique         2.78, 2.82 A)
 &rst
  ixpk= 402, nxpk= 10, iat= 698, 696, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:403     46 ALA  HN          5.50    (#    403:10  Single Ambig)
 &rst
  ixpk= 403, nxpk= 10, iat=  -1, 696, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 710, 711, 677, 678, 713, 714,
 &end
#
#    0 AMB  10-2:404     46 ALA  HN          5.50    (#    404:10  Single Ambig)
 &rst
  ixpk= 404, nxpk= 10, iat=  -1, 696, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 710, 711, 160,
 &end
#
#   46 ALA  MB           46 ALA  HN          2.80    (#    405:10  Unique         2.06, 2.89 A)
 &rst
  ixpk= 405, nxpk= 10, iat=  -1, 696, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1= 700, 701, 702,
 &end
#
#   40 ILE  QD1          46 ALA  HN          4.20    (#    406:10  Unique         3.49, 5.16 A)
 &rst
  ixpk= 406, nxpk= 10, iat=  -1, 696, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1= 629, 630, 631,
 &end
#
#    0 AMB  10-2:407     46 ALA  HN          5.50    (#    407:10  Single Ambig)
 &rst
  ixpk= 407, nxpk= 10, iat=  -1, 696, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1= 626, 627,1058,1059,1060,1567,1568,
 &end
#
#   46 ALA  HN           47 GLU  HN          3.50    (#    408:10  Unique         2.62, 2.68 A)
 &rst
  ixpk= 408, nxpk= 10, iat= 696, 706, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:409      0 AMB  10-1:409    5.50    (#    409:10  Double Ambig)
 &rst
  ixpk= 409, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 738, 104,
 igr2= 706,1543,
 &end
#
#    0 AMB  10-2:410      0 AMB  10-1:410    5.50    (#    410:10  Double Ambig)
 &rst
  ixpk= 410, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 748,1266,
 igr2= 706,1543,
 &end
#
#   48 GLN  HN           47 GLU  HN          3.50    (#    411:10  Unique         2.51, 2.54 A)
 &rst
  ixpk= 411, nxpk= 10, iat= 721, 706, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:412     47 GLU  HN          5.50    (#    412:10  Single Ambig)
 &rst
  ixpk= 412, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782,1653,1661,
 &end
#
#   48 GLN  HE2-         47 GLU  HN          5.50    (#    413:10  Unique         3.96, 5.33 A)
 &rst
  ixpk= 413, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 733, 734,
 &end
#
#    7 TYR  HE           95 GLN  HN          5.50    (#    415:10  Unique         2.71, 5.68 A)
 &rst
  ixpk= 415, nxpk= 10, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  93,  98,
 &end
#
#   95 GLN  HA           95 GLN  HN          5.50    (#    416:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 416, nxpk= 10, iat=1545,1543, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   45 SER  HB+          47 GLU  HN          5.50    (#    418:10  Unique         2.62, 3.34 A)
 &rst
  ixpk= 418, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 689, 690,
 &end
#
#   94 GLY  HA+          95 GLN  HN          3.50    (#    419:10  Unique         2.19, 2.61 A)
 &rst
  ixpk= 419, nxpk= 10, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1538,1539,
 &end
#
#   94 GLY  HA-          95 GLN  HN          4.20    (#    420:10  Unique         2.19, 2.61 A4.2)
 &rst
  ixpk= 420, nxpk= 10, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1538,1539,
 &end
#
#   47 GLU  HA           47 GLU  HN          3.50    (#    421:10  Unique         2.86, 2.86 A)
 &rst
  ixpk= 421, nxpk= 10, iat= 708, 706, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   48 GLN  HG+          47 GLU  HN          5.50    (#    422:10  Unique         3.88, 5.01 A)
 &rst
  ixpk= 422, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 728, 729,
 &end
#
#   47 GLU  HB+          47 GLU  HN          2.80    (#    423:10  Unique         2.20, 2.56 A)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 710, 711,
 &end
#
#   47 GLU  HB-          47 GLU  HN          2.80    (#    424:10  Unique         2.20, 2.56 A)
 &rst
  ixpk= 424, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 710, 711,
 &end
#
#   46 ALA  MB           47 GLU  HN          2.80    (#    425:10  Unique         2.55, 3.36 A)
 &rst
  ixpk= 425, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1= 700, 701, 702,
 &end
#
#    0 AMB  10-2:426     47 GLU  HN          5.50    (#    426:10  Single Ambig)
 &rst
  ixpk= 426, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 629, 630, 631, 622, 623, 624,
 &end
#
#   22 VAL  HA           17 ASN  HN          5.50    (#    428:10  Unique         3.81, 4.30 A)
 &rst
  ixpk= 428, nxpk= 10, iat= 325, 244, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   46 ALA  HN           48 GLN  HN          5.50    (#    429:10  Unique         4.03, 4.12 A)
 &rst
  ixpk= 429, nxpk= 10, iat= 696, 721, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:430     49 ALA  HN          5.50    (#    430:10  Single Ambig)
 &rst
  ixpk= 430, nxpk= 10, iat=  -1, 738, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 162, 163, 164, 166, 167, 168,1609,1610,
 &end
#
#   40 ILE  QG2          49 ALA  HN          4.20    (#    431:10  Unique         3.79, 4.85 A)
 &rst
  ixpk= 431, nxpk= 10, iat=  -1, 738, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1= 622, 623, 624,
 &end
#
#   49 ALA  MB           49 ALA  HN          2.80    (#    432:10  Unique         2.13, 2.90 A)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1, 738, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1= 742, 743, 744,
 &end
#
#   48 GLN  HB-          49 ALA  HN          3.50    (#    433:10  Unique         2.47, 3.05 A)
 &rst
  ixpk= 433, nxpk= 10, iat=  -1, 738, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 725, 726,
 &end
#
#   48 GLN  HB+          49 ALA  HN          2.80    (#    434:10  Unique         2.47, 3.05 A)
 &rst
  ixpk= 434, nxpk= 10, iat=  -1, 738, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 725, 726,
 &end
#
#   48 GLN  HG+          49 ALA  HN          4.20    (#    435:10  Unique         3.99, 4.57 A)
 &rst
  ixpk= 435, nxpk= 10, iat=  -1, 738, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 728, 729,
 &end
#
#    0 AMB  10-2:436     49 ALA  HN          3.50    (#    436:10  Single Ambig)
 &rst
  ixpk= 436, nxpk= 10, iat=  -1, 738, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 740, 723, 689, 690,
 &end
#
#   44 GLU  HA           49 ALA  HN          5.50    (#    437:10  Unique         4.88, 5.12 A)
 &rst
  ixpk= 437, nxpk= 10, iat= 672, 738, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   51 TYR  HN           49 ALA  HN          5.50    (#    438:10  Unique         4.02, 4.10 A)
 &rst
  ixpk= 438, nxpk= 10, iat= 765, 738, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   50 MET  HN           49 ALA  HN          3.50    (#    439:10  Unique         2.54, 2.59 A)
 &rst
  ixpk= 439, nxpk= 10, iat= 748, 738, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:440     49 ALA  HN          5.50    (#    440:10  Single Ambig)
 &rst
  ixpk= 440, nxpk= 10, iat=  -1, 738, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 685, 706,
 &end
#
#  113 MET  HN          114 GLN  HN          4.20    (#    441:10  Unique         1.89, 2.73 A)
 &rst
  ixpk= 441, nxpk= 10, iat=1843,1860, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:442      0 AMB  10-1:442    3.50    (#    442:10  Double Ambig)
 &rst
  ixpk= 442, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 738,  40,
 igr2= 748,  83,
 &end
#
#   51 TYR  HN           50 MET  HN          3.50    (#    443:10  Unique         2.63, 2.72 A)
 &rst
  ixpk= 443, nxpk= 10, iat= 765, 748, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  115 THR  HN          114 GLN  HN          3.50    (#    444:10  Unique         1.94, 2.24 A)
 &rst
  ixpk= 444, nxpk= 10, iat=1877,1860, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:445      0 AMB  10-1:445    5.50    (#    445:10  Double Ambig)
 &rst
  ixpk= 445, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 773, 782, 852, 860,1653,1661,
 igr2= 748,1860,
 &end
#
#  114 GLN  HA          114 GLN  HN          2.80    (#    447:10  Unique         2.91, 2.93 A)
 &rst
  ixpk= 447, nxpk= 10, iat=1862,1860, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  113 MET  HA          114 GLN  HN          4.20    (#    448:10  Unique         2.66, 2.91 A)
 &rst
  ixpk= 448, nxpk= 10, iat=1845,1860, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:449    114 GLN  HN          5.50    (#    449:10  Single Ambig)
 &rst
  ixpk= 449, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1879,1881,
 &end
#
#    0 AMB  10-2:450      0 AMB  10-1:450    4.20    (#    450:10  Double Ambig)
 &rst
  ixpk= 450, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.16, r4= 6.91,
 igr1= 740, 723, 912, 913,1881,
 igr2= 748,1860,
 &end
#
#   50 MET  HA           50 MET  HN          4.20    (#    451:10  Unique         2.77, 2.80 A)
 &rst
  ixpk= 451, nxpk= 10, iat= 750, 748, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   47 GLU  HA           50 MET  HN          4.20    (#    452:10  Unique         3.42, 3.52 A)
 &rst
  ixpk= 452, nxpk= 10, iat= 708, 748, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   51 TYR  HB+          50 MET  HN          5.50    (#    453:10  Unique         4.51, 5.39 A)
 &rst
  ixpk= 453, nxpk= 10, iat=  -1, 748, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 769, 770,
 &end
#
#  113 MET  HG+         114 GLN  HN          5.50    (#    454:10  Unique         4.53, 5.09 A)
 &rst
  ixpk= 454, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1850,1851,
 &end
#
#    0 AMB  10-2:455    114 GLN  HN          2.80    (#    455:10  Single Ambig)
 &rst
  ixpk= 455, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1867,1868,1864,1865,
 &end
#
#  114 GLN  HB-         114 GLN  HN          3.50    (#    456:10  Unique         2.66, 3.38 A)
 &rst
  ixpk= 456, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1864,1865,
 &end
#
#  113 MET  HB+         114 GLN  HN          4.20    (#    457:10  Unique         3.65, 4.26 A)
 &rst
  ixpk= 457, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1847,1848,
 &end
#
#    0 AMB  10-2:458     50 MET  HN          2.80    (#    458:10  Single Ambig)
 &rst
  ixpk= 458, nxpk= 10, iat=  -1, 748, r1= 0.00, r2= 1.80, r3= 3.66, r4= 4.41,
 igr1= 742, 743, 744, 626, 627,
 &end
#
#   50 MET  HB-          50 MET  HN          4.20    (#    459:10  Unique         2.28, 2.53 A)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1, 748, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 752, 753,
 &end
#
#   11 VAL  MGY          50 MET  HN          4.20    (#    460:10  Unique         2.97, 4.60 A)
 &rst
  ixpk= 460, nxpk= 10, iat=  -1, 748, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGX          50 MET  HN          3.50    (#    461:10  Unique         2.97, 4.60 A)
 &rst
  ixpk= 461, nxpk= 10, iat=  -1, 748, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#  115 THR  MG2         114 GLN  HN          4.20    (#    462:10  Unique         4.25, 5.58 A)
 &rst
  ixpk= 462, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1883,1884,1885,
 &end
#
#    0 AMB  10-2:463      0 AMB  10-1:463    4.20    (#    463:10  Double Ambig)
 &rst
  ixpk= 463, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.52, r4= 7.27,
 igr1=1527,1528, 759, 760, 761,1606,1607,
 igr2=  83, 748,
 &end
#
#   50 MET  ME           51 TYR  HN          3.50    (#    464:10  Unique         3.48, 4.98 A)
 &rst
  ixpk= 464, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 759, 760, 761,
 &end
#
#    0 AMB  10-2:465     51 TYR  HN          4.20    (#    465:10  Single Ambig)
 &rst
  ixpk= 465, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 7.27, r4= 8.02,
 igr1= 162, 163, 164, 166, 167, 168, 834, 835, 836, 838,
       839, 840, 834, 835, 836, 838, 839, 840, 185, 186,
       187,1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  10-2:466      0 AMB  10-1:466    5.50    (#    466:10  Double Ambig)
 &rst
  ixpk= 466, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1= 162, 163, 164, 166, 167, 168,2570,2571,2572,2574,
      2575,2576,1073,1074,1075,1077,1078,1079,
 igr2= 765,2673,
 &end
#
#    0 AMB  10-2:467      0 AMB  10-1:467    3.50    (#    467:10  Double Ambig)
 &rst
  ixpk= 467, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 752, 753,2679,2680,2681,
 igr2= 765,2673,
 &end
#
#    0 AMB  10-2:468     51 TYR  HN          2.80    (#    468:10  Single Ambig)
 &rst
  ixpk= 468, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 752, 753, 755, 756,
 &end
#
#    0 AMB  10-2:469      0 AMB  10-1:469    5.50    (#    469:10  Double Ambig)
 &rst
  ixpk= 469, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 713, 714, 829, 830,2648,2649, 262, 263,
 igr2= 765,2673,
 &end
#
#    0 AMB  10-2:470     51 TYR  HN          5.50    (#    470:10  Single Ambig)
 &rst
  ixpk= 470, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 713, 714, 677, 678,
 &end
#
#   51 TYR  HB-          51 TYR  HN          2.80    (#    471:10  Unique         2.17, 2.86 A)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 769, 770,
 &end
#
#   51 TYR  HB+          51 TYR  HN          3.50    (#    472:10  Unique         2.17, 2.86 A)
 &rst
  ixpk= 472, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 769, 770,
 &end
#
#   50 MET  HA           51 TYR  HN          4.20    (#    473:10  Unique         3.53, 3.54 A)
 &rst
  ixpk= 473, nxpk= 10, iat= 750, 765, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:474     51 TYR  HN          2.80    (#    474:10  Single Ambig)
 &rst
  ixpk= 474, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1= 767, 723, 740,
 &end
#
#   51 TYR  HE           51 TYR  HN          5.50    (#    476:10  Unique         4.44, 5.64 A)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 775, 780,
 &end
#
#   51 TYR  HD           51 TYR  HN          3.50    (#    477:10  Unique         2.00, 3.69 A)
 &rst
  ixpk= 477, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 773, 782,
 &end
#
#  159 GLN  HN          162 THR  HN          5.50    (#    478:10  Unique)
 &rst
  ixpk= 478, nxpk= 10, iat=2627,2673, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:479     51 TYR  HN          2.80    (#    479:10  Single Ambig)
 &rst
  ixpk= 479, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 786, 748,
 &end
#
#   49 ALA  HN           51 TYR  HN          5.50    (#    480:10  Unique         4.02, 4.10 A)
 &rst
  ixpk= 480, nxpk= 10, iat= 738, 765, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:481     51 TYR  HN          5.50    (#    481:10  Single Ambig)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1, 765, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 810, 706,
 &end
#
#   53 GLU  HN           52 ARG  HN          3.50    (#    482:10  Unique         2.55, 2.64 A)
 &rst
  ixpk= 482, nxpk= 10, iat= 810, 786, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   51 TYR  HN           52 ARG  HN          4.20    (#    483:10  Unique         2.58, 2.68 A)
 &rst
  ixpk= 483, nxpk= 10, iat= 765, 786, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:484     52 ARG  HN          5.50    (#    484:10  Single Ambig)
 &rst
  ixpk= 484, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782, 644, 645,
 &end
#
#   52 ARG  HA           52 ARG  HN          3.50    (#    485:10  Unique         2.81, 2.83 A)
 &rst
  ixpk= 485, nxpk= 10, iat= 788, 786, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:486     52 ARG  HN          3.50    (#    486:10  Single Ambig)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 740, 767, 723,
 &end
#
#    0 AMB  10-2:487     52 ARG  HN          5.50    (#    487:10  Single Ambig)
 &rst
  ixpk= 487, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 796, 797, 848, 849,
 &end
#
#   52 ARG  HD+          52 ARG  HN          4.20    (#    488:10  Unique         4.41, 5.32 A)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 796, 797,
 &end
#
#   51 TYR  HB-          52 ARG  HN          4.20    (#    489:10  Unique         2.65, 2.99 A)
 &rst
  ixpk= 489, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 769, 770,
 &end
#
#    0 AMB  10-2:490     52 ARG  HN          5.50    (#    490:10  Single Ambig)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 677, 678, 886, 887,
 &end
#
#   52 ARG  HB-          52 ARG  HN          3.50    (#    491:10  Unique         2.07, 2.58 A)
 &rst
  ixpk= 491, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 790, 791,
 &end
#
#   52 ARG  HB+          52 ARG  HN          2.80    (#    492:10  Unique         2.07, 2.58 A)
 &rst
  ixpk= 492, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 790, 791,
 &end
#
#    0 AMB  10-2:493     52 ARG  HN          5.50    (#    493:10  Single Ambig)
 &rst
  ixpk= 493, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 9.14, r4= 9.89,
 igr1= 834, 835, 836, 838, 839, 840, 834, 835, 836, 838,
       839, 840, 162, 163, 164, 166, 167, 168, 185, 186,
       187,
 &end
#
#    0 AMB  10-2:494     53 GLU  HN          5.50    (#    494:10  Single Ambig)
 &rst
  ixpk= 494, nxpk= 10, iat=  -1, 810, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 185, 186, 187, 834, 835, 836, 838, 839, 840, 227,
       228, 229,
 &end
#
#    0 AMB  10-2:495     53 GLU  HN          4.20    (#    495:10  Single Ambig)
 &rst
  ixpk= 495, nxpk= 10, iat=  -1, 810, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1= 829, 830, 742, 743, 744, 626, 627,
 &end
#
#    0 AMB  10-2:496     53 GLU  HN          2.80    (#    496:10  Single Ambig)
 &rst
  ixpk= 496, nxpk= 10, iat=  -1, 810, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1= 814, 815, 793, 794, 790, 791,
 &end
#
#   53 GLU  HG-          53 GLU  HN          2.80    (#    497:10  Unique         1.92, 3.67 A)
 &rst
  ixpk= 497, nxpk= 10, iat=  -1, 810, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 817, 818,
 &end
#
#    0 AMB  10-2:498     53 GLU  HN          5.50    (#    498:10  Single Ambig)
 &rst
  ixpk= 498, nxpk= 10, iat=  -1, 810, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1= 886, 887, 677, 678, 883, 884, 898,
 &end
#
#    0 AMB  10-2:499     53 GLU  HN          5.50    (#    499:10  Single Ambig)
 &rst
  ixpk= 499, nxpk= 10, iat=  -1, 810, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 750, 848, 849,
 &end
#
#   54 LEU  HA           53 GLU  HN          5.50    (#    500:10  Unique         5.06, 5.13 A)
 &rst
  ixpk= 500, nxpk= 10, iat= 827, 810, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   53 GLU  HA           53 GLU  HN          3.50    (#    501:10  Unique         2.82, 2.84 A)
 &rst
  ixpk= 501, nxpk= 10, iat= 812, 810, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:502     53 GLU  HN          5.50    (#    502:10  Single Ambig)
 &rst
  ixpk= 502, nxpk= 10, iat=  -1, 810, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 773, 782, 852, 860, 644, 645,
 &end
#
#   55 PHE  HN           53 GLU  HN          5.50    (#    503:10  Unique         4.17, 4.25 A)
 &rst
  ixpk= 503, nxpk= 10, iat= 844, 810, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   52 ARG  HN           53 GLU  HN          3.50    (#    504:10  Unique         2.55, 2.64 A)
 &rst
  ixpk= 504, nxpk= 10, iat= 786, 810, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   54 LEU  HN           53 GLU  HN          4.20    (#    505:10  Unique         2.48, 2.53 A)
 &rst
  ixpk= 505, nxpk= 10, iat= 825, 810, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:506     54 LEU  HN          5.50    (#    506:10  Single Ambig)
 &rst
  ixpk= 506, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 786, 748,
 &end
#
#   51 TYR  HA           54 LEU  HN          4.20    (#    507:10  Unique         3.40, 3.56 A)
 &rst
  ixpk= 507, nxpk= 10, iat= 767, 825, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   54 LEU  HA           54 LEU  HN          4.20    (#    508:10  Unique         2.77, 2.78 A)
 &rst
  ixpk= 508, nxpk= 10, iat= 827, 825, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:509     54 LEU  HN          5.50    (#    509:10  Single Ambig)
 &rst
  ixpk= 509, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 750, 848, 849,
 &end
#
#    0 AMB  10-2:510     54 LEU  HN          5.50    (#    510:10  Single Ambig)
 &rst
  ixpk= 510, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 886, 887, 883, 884, 898,
 &end
#
#    0 AMB  10-2:511     54 LEU  HN          2.80    (#    511:10  Single Ambig)
 &rst
  ixpk= 511, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 829, 830, 817, 818,
 &end
#
#    0 AMB  10-2:512     54 LEU  HN          4.20    (#    512:10  Single Ambig)
 &rst
  ixpk= 512, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 814, 815, 790, 791,
 &end
#
#   54 LEU  HB-          54 LEU  HN          2.80    (#    513:10  Unique         2.20, 2.51 A)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 829, 830,
 &end
#
#    0 AMB  10-2:514     54 LEU  HN          3.50    (#    514:10  Single Ambig)
 &rst
  ixpk= 514, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1= 185, 186, 187, 834, 835, 836, 838, 839, 840, 834,
       835, 836, 838, 839, 840, 162, 163, 164, 166, 167,
       168,
 &end
#
#    0 AMB  10-2:515     55 PHE  HN          3.50    (#    515:10  Single Ambig)
 &rst
  ixpk= 515, nxpk= 10, iat=  -1, 844, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 834, 835, 836, 838, 839, 840, 834, 835, 836, 838,
       839, 840,
 &end
#
#    0 AMB  10-2:516     55 PHE  HN          4.20    (#    516:10  Single Ambig)
 &rst
  ixpk= 516, nxpk= 10, iat=  -1, 844, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1= 832, 793, 794,
 &end
#
#    0 AMB  10-2:517     55 PHE  HN          3.50    (#    517:10  Single Ambig)
 &rst
  ixpk= 517, nxpk= 10, iat=  -1, 844, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 829, 830, 868, 869,
 &end
#
#   55 PHE  HB-          55 PHE  HN          3.50    (#    518:10  Unique         2.32, 2.55 A)
 &rst
  ixpk= 518, nxpk= 10, iat=  -1, 844, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 848, 849,
 &end
#
#   55 PHE  HB+          55 PHE  HN          3.50    (#    519:10  Unique         2.32, 2.55 A)
 &rst
  ixpk= 519, nxpk= 10, iat=  -1, 844, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 848, 849,
 &end
#
#   54 LEU  HA           55 PHE  HN          4.20    (#    520:10  Unique         3.50, 3.52 A)
 &rst
  ixpk= 520, nxpk= 10, iat= 827, 844, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   51 TYR  HA           55 PHE  HN          5.50    (#    521:10  Unique         4.23, 4.67 A)
 &rst
  ixpk= 521, nxpk= 10, iat= 767, 844, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   55 PHE  HA           55 PHE  HN          3.50    (#    522:10  Unique         2.82, 2.85 A)
 &rst
  ixpk= 522, nxpk= 10, iat= 846, 844, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:524     55 PHE  HN          4.20    (#    524:10  Single Ambig)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1, 844, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 852, 860, 773, 782,
 &end
#
#    0 AMB  10-2:525     55 PHE  HN          5.50    (#    525:10  Single Ambig)
 &rst
  ixpk= 525, nxpk= 10, iat=  -1, 844, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 894, 854, 858,
 &end
#
#    0 AMB  10-2:526     55 PHE  HN          3.50    (#    526:10  Single Ambig)
 &rst
  ixpk= 526, nxpk= 10, iat=  -1, 844, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 864, 879,
 &end
#
#   54 LEU  HN           55 PHE  HN          4.20    (#    527:10  Unique         2.69, 2.73 A)
 &rst
  ixpk= 527, nxpk= 10, iat= 825, 844, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   58 VAL  MGX          56 GLU  HN          5.50    (#    530:10  Unique         5.16, 7.55 A)
 &rst
  ixpk= 530, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  10-2:531     56 GLU  HN          5.50    (#    531:10  Single Ambig)
 &rst
  ixpk= 531, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 829, 830, 418, 419,
 &end
#
#   56 GLU  HB+          56 GLU  HN          2.80    (#    533:10  Unique         2.42, 3.09 A)
 &rst
  ixpk= 533, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 868, 869,
 &end
#
#   56 GLU  HG-          56 GLU  HN          3.50    (#    534:10  Unique         2.33, 2.82 A)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 871, 872,
 &end
#
#   56 GLU  HG+          56 GLU  HN          3.50    (#    535:10  Unique         2.33, 2.82 A)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 871, 872,
 &end
#
#   55 PHE  HB-          56 GLU  HN          4.20    (#    536:10  Unique         2.63, 3.47 A)
 &rst
  ixpk= 536, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 848, 849,
 &end
#
#   55 PHE  HB+          56 GLU  HN          4.20    (#    537:10  Unique         2.63, 3.47 A)
 &rst
  ixpk= 537, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 848, 849,
 &end
#
#   56 GLU  HA           56 GLU  HN          3.50    (#    538:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 538, nxpk= 10, iat= 866, 864, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   53 GLU  HA           56 GLU  HN          5.50    (#    539:10  Unique         3.09, 3.19 A)
 &rst
  ixpk= 539, nxpk= 10, iat= 812, 864, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   55 PHE  HA           56 GLU  HN          4.20    (#    540:10  Unique         3.40, 3.47 A)
 &rst
  ixpk= 540, nxpk= 10, iat= 846, 864, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   55 PHE  HD           56 GLU  HN          5.50    (#    542:10  Unique         3.65, 4.90 A)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 852, 860,
 &end
#
#   55 PHE  HN           56 GLU  HN          3.50    (#    543:10  Unique         2.44, 2.51 A)
 &rst
  ixpk= 543, nxpk= 10, iat= 844, 864, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   54 LEU  HN           56 GLU  HN          5.50    (#    544:10  Unique         3.87, 4.04 A)
 &rst
  ixpk= 544, nxpk= 10, iat= 825, 864, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:547     57 GLU  HN          5.50    (#    547:10  Single Ambig)
 &rst
  ixpk= 547, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 8.20, r4= 8.95,
 igr1= 189, 190, 192, 193, 194, 926, 927, 928, 930, 931,
       932,
 &end
#
#   58 VAL  MGX          57 GLU  HN          3.50    (#    548:10  Unique         3.80, 6.02 A)
 &rst
  ixpk= 548, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 900, 901, 902, 904, 905, 906,
 &end
#
#  120 GLU  HB+          57 GLU  HN          5.50    (#    549:10  Unique         9.95,11.52 A)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1945,1946,
 &end
#
#   56 GLU  HB+          57 GLU  HN          3.50    (#    550:10  Unique         2.61, 3.50 A)
 &rst
  ixpk= 550, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 868, 869,
 &end
#
#   57 GLU  HG+          57 GLU  HN          3.50    (#    551:10  Unique         1.72, 3.01 A)
 &rst
  ixpk= 551, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 886, 887,
 &end
#
#   57 GLU  HG-          57 GLU  HN          4.20    (#    552:10  Unique         1.72, 3.01 A)
 &rst
  ixpk= 552, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 886, 887,
 &end
#
#   56 GLU  HA           57 GLU  HN          5.50    (#    553:10  Unique         3.41, 3.45 A)
 &rst
  ixpk= 553, nxpk= 10, iat= 866, 879, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:554     57 GLU  HN          5.50    (#    554:10  Single Ambig)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 846, 604, 605,
 &end
#
#   58 VAL  HN           57 GLU  HN          3.50    (#    556:10  Unique         2.25, 2.34 A)
 &rst
  ixpk= 556, nxpk= 10, iat= 894, 879, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   59 GLY  HN           57 GLU  HN          4.20    (#    557:10  Unique         3.09, 3.17 A)
 &rst
  ixpk= 557, nxpk= 10, iat= 910, 879, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   55 PHE  HN           57 GLU  HN          5.50    (#    558:10  Unique         3.78, 3.92 A)
 &rst
  ixpk= 558, nxpk= 10, iat= 844, 879, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   57 GLU  HN           58 VAL  HN          3.50    (#    559:10  Unique         2.25, 2.34 A)
 &rst
  ixpk= 559, nxpk= 10, iat= 879, 894, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   59 GLY  HN           58 VAL  HN          3.50    (#    561:10  Unique         1.78, 2.00 A)
 &rst
  ixpk= 561, nxpk= 10, iat= 910, 894, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   58 VAL  HA           58 VAL  HN          4.20    (#    563:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 563, nxpk= 10, iat= 896, 894, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   59 GLY  HA+          58 VAL  HN          5.50    (#    564:10  Unique         4.06, 4.44 A)
 &rst
  ixpk= 564, nxpk= 10, iat=  -1, 894, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 912, 913,
 &end
#
#   56 GLU  HA           58 VAL  HN          5.50    (#    565:10  Unique         4.76, 4.91 A)
 &rst
  ixpk= 565, nxpk= 10, iat= 866, 894, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   59 GLY  HA-          58 VAL  HN          5.50    (#    566:10  Unique         4.06, 4.44 A)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1, 894, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 912, 913,
 &end
#
#   57 GLU  HB-          58 VAL  HN          5.50    (#    567:10  Unique         2.37, 3.29 A)
 &rst
  ixpk= 567, nxpk= 10, iat=  -1, 894, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 883, 884,
 &end
#
#    0 AMB  10-2:568     58 VAL  HN          3.50    (#    568:10  Single Ambig)
 &rst
  ixpk= 568, nxpk= 10, iat=  -1, 894, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 883, 884, 898,
 &end
#
#   58 VAL  MGX          58 VAL  HN          2.80    (#    570:10  Unique         1.94, 3.91 A)
 &rst
  ixpk= 570, nxpk= 10, iat=  -1, 894, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  10-2:571     59 GLY  HN          5.50    (#    571:10  Single Ambig)
 &rst
  ixpk= 571, nxpk= 10, iat=  -1, 910, r1= 0.00, r2= 1.80, r3= 8.54, r4= 9.29,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932, 189, 190,
 &end
#
#    0 AMB  10-2:572     59 GLY  HN          2.80    (#    572:10  Single Ambig)
 &rst
  ixpk= 572, nxpk= 10, iat=  -1, 910, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,
 &end
#
#    0 AMB  10-2:574     59 GLY  HN          5.50    (#    574:10  Single Ambig)
 &rst
  ixpk= 574, nxpk= 10, iat=  -1, 910, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 898, 886, 887, 883, 884,
 &end
#
#   59 GLY  HA-          59 GLY  HN          3.50    (#    575:10  Unique         2.29, 2.55 A)
 &rst
  ixpk= 575, nxpk= 10, iat=  -1, 910, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 912, 913,
 &end
#
#   59 GLY  HA+          59 GLY  HN          3.50    (#    576:10  Unique         2.29, 2.55 A)
 &rst
  ixpk= 576, nxpk= 10, iat=  -1, 910, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 912, 913,
 &end
#
#    0 AMB  10-2:577     59 GLY  HN          3.50    (#    577:10  Single Ambig)
 &rst
  ixpk= 577, nxpk= 10, iat=  -1, 910, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 846, 896,
 &end
#
#   60 LEU  HN           59 GLY  HN          4.20    (#    579:10  Unique         2.39, 2.70 A)
 &rst
  ixpk= 579, nxpk= 10, iat= 917, 910, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   58 VAL  HN           59 GLY  HN          2.80    (#    581:10  Unique         1.78, 2.00 A)
 &rst
  ixpk= 581, nxpk= 10, iat= 894, 910, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:582     59 GLY  HN          4.20    (#    582:10  Single Ambig)
 &rst
  ixpk= 582, nxpk= 10, iat=  -1, 910, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 879, 864,
 &end
#
#   59 GLY  HN           60 LEU  HN          3.50    (#    584:10  Unique         2.39, 2.70 A)
 &rst
  ixpk= 584, nxpk= 10, iat= 910, 917, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:585     60 LEU  HN          5.50    (#    585:10  Single Ambig)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 894, 854, 858,
 &end
#
#   55 PHE  HD           60 LEU  HN          5.50    (#    586:10  Unique         3.80, 5.28 A)
 &rst
  ixpk= 586, nxpk= 10, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 852, 860,
 &end
#
#   60 LEU  HA           60 LEU  HN          4.20    (#    587:10  Unique         2.90, 2.91 A)
 &rst
  ixpk= 587, nxpk= 10, iat= 919, 917, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   55 PHE  HA           60 LEU  HN          3.50    (#    588:10  Unique         1.92, 2.50 A)
 &rst
  ixpk= 588, nxpk= 10, iat= 846, 917, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   59 GLY  HA+          60 LEU  HN          5.50    (#    589:10  Unique         2.71, 3.23 A)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 912, 913,
 &end
#
#   59 GLY  HA-          60 LEU  HN          4.20    (#    590:10  Unique         2.71, 3.23 A)
 &rst
  ixpk= 590, nxpk= 10, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 912, 913,
 &end
#
#   58 VAL  HB           60 LEU  HN          5.50    (#    591:10  Unique         2.48, 3.29 A)
 &rst
  ixpk= 591, nxpk= 10, iat= 898, 917, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   54 LEU  HG           60 LEU  HN          4.20    (#    592:10  Unique         2.45, 2.97 A)
 &rst
  ixpk= 592, nxpk= 10, iat= 832, 917, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   60 LEU  HG           60 LEU  HN          5.50    (#    593:10  Unique         3.71, 4.26 A)
 &rst
  ixpk= 593, nxpk= 10, iat= 924, 917, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   58 VAL  MGX          60 LEU  HN          2.80    (#    594:10  Unique         1.86, 4.45 A)
 &rst
  ixpk= 594, nxpk= 10, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1= 900, 901, 902, 904, 905, 906,
 &end
#
#    0 AMB  10-2:595     60 LEU  HN          3.50    (#    595:10  Single Ambig)
 &rst
  ixpk= 595, nxpk= 10, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#   55 PHE  HB+          60 LEU  HN          5.50    (#    596:10  Unique         3.89, 5.04 A)
 &rst
  ixpk= 596, nxpk= 10, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 848, 849,
 &end
#
#   55 PHE  HN           60 LEU  HN          5.50    (#    597:10  Unique         4.07, 4.66 A)
 &rst
  ixpk= 597, nxpk= 10, iat= 844, 917, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:598     61 SER  HN          2.80    (#    598:10  Single Ambig)
 &rst
  ixpk= 598, nxpk= 10, iat=  -1, 936, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#    0 AMB  10-2:599     61 SER  HN          4.20    (#    599:10  Single Ambig)
 &rst
  ixpk= 599, nxpk= 10, iat=  -1, 936, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=1011,1012,1013,1015,1016,1017, 900, 901, 902, 904,
       905, 906,1745,1746,1747,1749,1750,1751,
 &end
#
#   60 LEU  HB+          61 SER  HN          3.50    (#    600:10  Unique         2.65, 3.52 A)
 &rst
  ixpk= 600, nxpk= 10, iat=  -1, 936, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 921, 922,
 &end
#
#   64 ASP  HB+          61 SER  HN          5.50    (#    601:10  Unique         2.07, 3.01 A)
 &rst
  ixpk= 601, nxpk= 10, iat=  -1, 936, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 997, 998,
 &end
#
#   61 SER  HB-          61 SER  HN          3.50    (#    602:10  Unique         2.13, 3.09 A)
 &rst
  ixpk= 602, nxpk= 10, iat=  -1, 936, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 940, 941,
 &end
#
#    0 AMB  10-2:605     62 ARG  HN          5.50    (#    605:10  Single Ambig)
 &rst
  ixpk= 605, nxpk= 10, iat=  -1, 947, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 834, 835, 836, 838, 839, 840, 834, 835, 836, 838,
       839, 840,
 &end
#
#   62 ARG  HG-          62 ARG  HN          3.50    (#    606:10  Unique         1.91, 2.42 A)
 &rst
  ixpk= 606, nxpk= 10, iat=  -1, 947, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 954, 955,
 &end
#
#   62 ARG  HG+          62 ARG  HN          2.80    (#    607:10  Unique         1.91, 2.42 A)
 &rst
  ixpk= 607, nxpk= 10, iat=  -1, 947, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 954, 955,
 &end
#
#    0 AMB  10-2:608     62 ARG  HN          2.80    (#    608:10  Single Ambig)
 &rst
  ixpk= 608, nxpk= 10, iat=  -1, 947, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 951, 952, 951, 952,
 &end
#
#    0 AMB  10-2:609     62 ARG  HN          5.50    (#    609:10  Single Ambig)
 &rst
  ixpk= 609, nxpk= 10, iat=  -1, 947, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 975, 976, 975, 976,
 &end
#
#    0 AMB  10-2:610     62 ARG  HN          4.20    (#    610:10  Single Ambig)
 &rst
  ixpk= 610, nxpk= 10, iat=  -1, 947, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 957, 958, 769, 770,
 &end
#
#   62 ARG  HA           62 ARG  HN          2.80    (#    611:10  Unique         2.78, 2.82 A)
 &rst
  ixpk= 611, nxpk= 10, iat= 949, 947, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   61 SER  HA           62 ARG  HN          2.80    (#    613:10  Unique         2.23, 2.35 A)
 &rst
  ixpk= 613, nxpk= 10, iat= 938, 947, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   51 TYR  HE           62 ARG  HN          5.50    (#    614:10  Unique         4.98, 6.93 A)
 &rst
  ixpk= 614, nxpk= 10, iat=  -1, 947, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 775, 780,
 &end
#
#    0 AMB  10-2:615     62 ARG  HN          5.50    (#    615:10  Single Ambig)
 &rst
  ixpk= 615, nxpk= 10, iat=  -1, 947, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782, 852, 860,
 &end
#
#   63 LYS  HN           62 ARG  HN          3.50    (#    616:10  Unique         2.46, 2.63 A)
 &rst
  ixpk= 616, nxpk= 10, iat= 971, 947, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   61 SER  HN           62 ARG  HN          5.50    (#    617:10  Unique         4.53, 4.58 A)
 &rst
  ixpk= 617, nxpk= 10, iat= 936, 947, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   62 ARG  HN           63 LYS  HN          3.50    (#    619:10  Unique         2.46, 2.63 A)
 &rst
  ixpk= 619, nxpk= 10, iat= 947, 971, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   63 LYS  HA           63 LYS  HN          2.80    (#    622:10  Unique         2.83, 2.87 A)
 &rst
  ixpk= 622, nxpk= 10, iat= 973, 971, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   62 ARG  HA           63 LYS  HN          3.50    (#    623:10  Unique         3.48, 3.52 A)
 &rst
  ixpk= 623, nxpk= 10, iat= 949, 971, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   64 ASP  HB+          63 LYS  HN          5.50    (#    625:10  Unique         4.27, 5.23 A)
 &rst
  ixpk= 625, nxpk= 10, iat=  -1, 971, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 997, 998,
 &end
#
#   62 ARG  HD+          63 LYS  HN          5.50    (#    626:10  Unique         4.13, 4.57 A)
 &rst
  ixpk= 626, nxpk= 10, iat=  -1, 971, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 957, 958,
 &end
#
#    0 AMB  10-2:627     63 LYS  HN          2.80    (#    627:10  Single Ambig)
 &rst
  ixpk= 627, nxpk= 10, iat=  -1, 971, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 975, 976, 975, 976,
 &end
#
#    0 AMB  10-2:628     63 LYS  HN          2.80    (#    628:10  Single Ambig)
 &rst
  ixpk= 628, nxpk= 10, iat=  -1, 971, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 951, 952, 951, 952,
 &end
#
#    0 AMB  10-2:629     63 LYS  HN          2.80    (#    629:10  Single Ambig)
 &rst
  ixpk= 629, nxpk= 10, iat=  -1, 971, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1= 954, 955, 978, 979, 978, 979,
 &end
#
#   62 ARG  HG-          63 LYS  HN          4.20    (#    630:10  Unique         1.94, 2.52 A)
 &rst
  ixpk= 630, nxpk= 10, iat=  -1, 971, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 954, 955,
 &end
#
#    0 AMB  10-2:631     64 ASP  HN          4.20    (#    631:10  Single Ambig)
 &rst
  ixpk= 631, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#    0 AMB  10-2:632     64 ASP  HN          2.80    (#    632:10  Single Ambig)
 &rst
  ixpk= 632, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 4.61, r4= 5.36,
 igr1=1011,1012,1013,1015,1016,1017,1011,1012,1013,1015,
      1016,1017, 954, 955,1745,1746,1747,1749,1750,1751,
      
 &end
#
#    0 AMB  10-2:633     64 ASP  HN          4.20    (#    633:10  Single Ambig)
 &rst
  ixpk= 633, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 978, 979, 978, 979,
 &end
#
#   60 LEU  HG           64 ASP  HN          4.20    (#    634:10  Unique         5.35, 6.65 A)
 &rst
  ixpk= 634, nxpk= 10, iat= 924, 993, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   63 LYS  HD-          64 ASP  HN          4.50    (#    635:10  Unique         3.63, 4.12 A)
 &rst
  ixpk= 635, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 981, 982,
 &end
#
#    0 AMB  10-2:636     64 ASP  HN          4.20    (#    636:10  Single Ambig)
 &rst
  ixpk= 636, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 975, 976, 975, 976,
 &end
#
#   64 ASP  HB+          64 ASP  HN          2.80    (#    637:10  Unique         2.24, 2.97 A)
 &rst
  ixpk= 637, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 997, 998,
 &end
#
#   62 ARG  HA           64 ASP  HN          5.50    (#    638:10  Unique         3.60, 3.76 A)
 &rst
  ixpk= 638, nxpk= 10, iat= 949, 993, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   61 SER  HB+          64 ASP  HN          5.50    (#    639:10  Unique         2.32, 3.37 A)
 &rst
  ixpk= 639, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 940, 941,
 &end
#
#   63 LYS  HA           64 ASP  HN          4.20    (#    640:10  Unique         3.25, 3.34 A)
 &rst
  ixpk= 640, nxpk= 10, iat= 973, 993, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   65 VAL  HN           64 ASP  HN          2.80    (#    642:10  Unique         2.31, 2.45 A)
 &rst
  ixpk= 642, nxpk= 10, iat=1005, 993, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   61 SER  HN           64 ASP  HN          5.50    (#    643:10  Unique         3.78, 4.06 A)
 &rst
  ixpk= 643, nxpk= 10, iat= 936, 993, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  105 VAL  HN           65 VAL  HN          5.50    (#    644:10  Unique         4.30, 4.58 A)
 &rst
  ixpk= 644, nxpk= 10, iat=1739,1005, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   62 ARG  HN           65 VAL  HN          5.50    (#    645:10  Unique         5.27, 5.50 A)
 &rst
  ixpk= 645, nxpk= 10, iat= 947,1005, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   66 ARG  HN           65 VAL  HN          5.50    (#    646:10  Unique         4.22, 4.34 A)
 &rst
  ixpk= 646, nxpk= 10, iat=1021,1005, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   64 ASP  HN           65 VAL  HN          2.80    (#    647:10  Unique         2.31, 2.45 A)
 &rst
  ixpk= 647, nxpk= 10, iat= 993,1005, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   65 VAL  HA           65 VAL  HN          4.20    (#    648:10  Unique         2.90, 2.91 A)
 &rst
  ixpk= 648, nxpk= 10, iat=1007,1005, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   63 LYS  HA           65 VAL  HN          5.50    (#    650:10  Unique         3.35, 3.44 A)
 &rst
  ixpk= 650, nxpk= 10, iat= 973,1005, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   62 ARG  HA           65 VAL  HN          5.50    (#    651:10  Unique         3.71, 4.02 A)
 &rst
  ixpk= 651, nxpk= 10, iat= 949,1005, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   64 ASP  HB+          65 VAL  HN          4.20    (#    652:10  Unique         3.53, 3.97 A)
 &rst
  ixpk= 652, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 997, 998,
 &end
#
#  105 VAL  HB           65 VAL  HN          5.50    (#    653:10  Unique         4.04, 4.86 A)
 &rst
  ixpk= 653, nxpk= 10, iat=1743,1005, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   65 VAL  HB           65 VAL  HN          5.50    (#    654:10  Unique         3.10, 3.21 A)
 &rst
  ixpk= 654, nxpk= 10, iat=1009,1005, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   63 LYS  HB-          65 VAL  HN          5.50    (#    655:10  Unique         5.08, 5.32 A)
 &rst
  ixpk= 655, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 975, 976,
 &end
#
#    0 AMB  10-2:656     65 VAL  HN          5.50    (#    656:10  Single Ambig)
 &rst
  ixpk= 656, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 978, 979, 954, 955,
 &end
#
#   60 LEU  MDY          65 VAL  HN          4.20    (#    657:10  Unique         4.29, 7.14 A)
 &rst
  ixpk= 657, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1= 926, 927, 928, 930, 931, 932,
 &end
#
#   65 VAL  MGX          65 VAL  HN          2.80    (#    658:10  Unique         2.34, 4.15 A)
 &rst
  ixpk= 658, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1011,1012,1013,1015,1016,1017,
 &end
#
#    0 AMB  10-2:659     66 ARG  HN          3.50    (#    659:10  Single Ambig)
 &rst
  ixpk= 659, nxpk= 10, iat=  -1,1021, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1745,1746,1747,1749,1750,1751,1073,1074,1075,1077,
      1078,1079, 227, 228, 229,
 &end
#
#    0 AMB  10-2:660     66 ARG  HN          2.80    (#    660:10  Single Ambig)
 &rst
  ixpk= 660, nxpk= 10, iat=  -1,1021, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=1011,1012,1013,1015,1016,1017,1011,1012,1013,1015,
      1016,1017,
 &end
#
#  102 LEU  HG           66 ARG  HN          5.50    (#    661:10  Unique         4.30, 5.50 A)
 &rst
  ixpk= 661, nxpk= 10, iat=1691,1021, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:662     66 ARG  HN          2.80    (#    662:10  Single Ambig)
 &rst
  ixpk= 662, nxpk= 10, iat=  -1,1021, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1025,1026,1025,1026,
 &end
#
#   65 VAL  HB           66 ARG  HN          3.50    (#    664:10  Unique         3.27, 3.98 A)
 &rst
  ixpk= 664, nxpk= 10, iat=1009,1021, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  104 LEU  HA           66 ARG  HN          5.50    (#    665:10  Unique         3.92, 4.27 A)
 &rst
  ixpk= 665, nxpk= 10, iat=1722,1021, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   66 ARG  HA           66 ARG  HN          4.20    (#    666:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 666, nxpk= 10, iat=1023,1021, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   65 VAL  HA           66 ARG  HN          3.50    (#    667:10  Unique         2.17, 2.27 A)
 &rst
  ixpk= 667, nxpk= 10, iat=1007,1021, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   65 VAL  HN           66 ARG  HN          5.50    (#    668:10  Unique         4.22, 4.34 A)
 &rst
  ixpk= 668, nxpk= 10, iat=1005,1021, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  105 VAL  HN           66 ARG  HN          5.50    (#    669:10  Unique         4.14, 4.48 A)
 &rst
  ixpk= 669, nxpk= 10, iat=1739,1021, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:670     66 ARG  HN          3.50    (#    670:10  Single Ambig)
 &rst
  ixpk= 670, nxpk= 10, iat=  -1,1021, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1703,1045,
 &end
#
#   68 LEU  HN           67 ILE  HN          5.50    (#    671:10  Unique         4.30, 4.50 A)
 &rst
  ixpk= 671, nxpk= 10, iat=1064,1045, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   66 ARG  HN           67 ILE  HN          5.50    (#    672:10  Unique         4.32, 4.35 A)
 &rst
  ixpk= 672, nxpk= 10, iat=1021,1045, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   66 ARG  HA           67 ILE  HN          2.80    (#    673:10  Unique         2.19, 2.21 A)
 &rst
  ixpk= 673, nxpk= 10, iat=1023,1045, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   67 ILE  HA           67 ILE  HN          4.20    (#    674:10  Unique         2.84, 2.88 A)
 &rst
  ixpk= 674, nxpk= 10, iat=1047,1045, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   66 ARG  HD+          67 ILE  HN          5.50    (#    675:10  Unique         5.07, 5.46 A)
 &rst
  ixpk= 675, nxpk= 10, iat=  -1,1045, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1031,1032,
 &end
#
#   67 ILE  HB           67 ILE  HN          2.80    (#    676:10  Unique         2.49, 2.57 A)
 &rst
  ixpk= 676, nxpk= 10, iat=1049,1045, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:677     67 ILE  HN          2.80    (#    677:10  Single Ambig)
 &rst
  ixpk= 677, nxpk= 10, iat=  -1,1045, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1055,1056,1025,1026,
 &end
#
#   67 ILE  QG2          67 ILE  HN          4.20    (#    678:10  Unique         4.37, 4.55 A)
 &rst
  ixpk= 678, nxpk= 10, iat=  -1,1045, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1051,1052,1053,
 &end
#
#    0 AMB  10-2:679     67 ILE  HN          3.50    (#    679:10  Single Ambig)
 &rst
  ixpk= 679, nxpk= 10, iat=  -1,1045, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1693,1694,1695,1697,1698,1699,1058,1059,1060,
 &end
#
#    0 AMB  10-2:680     67 ILE  HN          2.80    (#    680:10  Single Ambig)
 &rst
  ixpk= 680, nxpk= 10, iat=  -1,1045, r1= 0.00, r2= 1.80, r3= 3.96, r4= 4.71,
 igr1=1055,1056,1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  10-2:681     68 LEU  HN          2.80    (#    681:10  Single Ambig)
 &rst
  ixpk= 681, nxpk= 10, iat=  -1,1064, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=1693,1694,1695,1697,1698,1699,1073,1074,1075,1077,
      1078,1079,
 &end
#
#    0 AMB  10-2:682     68 LEU  HN          3.50    (#    682:10  Single Ambig)
 &rst
  ixpk= 682, nxpk= 10, iat=  -1,1064, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1051,1052,1053,1073,1074,1075,1077,1078,1079,
 &end
#
#   68 LEU  HB-          68 LEU  HN          3.50    (#    683:10  Unique         2.64, 3.23 A)
 &rst
  ixpk= 683, nxpk= 10, iat=  -1,1064, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1068,1069,
 &end
#
#   66 ARG  HG+          68 LEU  HN          4.20    (#    684:10  Unique         3.75, 5.22 A)
 &rst
  ixpk= 684, nxpk= 10, iat=  -1,1064, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1028,1029,
 &end
#
#   67 ILE  HB           68 LEU  HN          5.50    (#    685:10  Unique         3.91, 4.12 A)
 &rst
  ixpk= 685, nxpk= 10, iat=1049,1064, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   67 ILE  HA           68 LEU  HN          3.50    (#    686:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 686, nxpk= 10, iat=1047,1064, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   68 LEU  HA           68 LEU  HN          4.20    (#    687:10  Unique         2.85, 2.93 A)
 &rst
  ixpk= 687, nxpk= 10, iat=1066,1064, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  102 LEU  HA           68 LEU  HN          5.50    (#    688:10  Unique         2.20, 2.48 A)
 &rst
  ixpk= 688, nxpk= 10, iat=1686,1064, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   69 ALA  HN           68 LEU  HN          3.50    (#    689:10  Unique         1.88, 2.10 A)
 &rst
  ixpk= 689, nxpk= 10, iat=1083,1064, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:690     68 LEU  HN          5.50    (#    690:10  Single Ambig)
 &rst
  ixpk= 690, nxpk= 10, iat=  -1,1064, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1703,1045,
 &end
#
#  102 LEU  HN           69 ALA  HN          5.50    (#    691:10  Unique         5.04, 5.31 A)
 &rst
  ixpk= 691, nxpk= 10, iat=1684,1083, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   68 LEU  HN           69 ALA  HN          3.50    (#    692:10  Unique         1.88, 2.10 A)
 &rst
  ixpk= 692, nxpk= 10, iat=1064,1083, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:693     69 ALA  HN          5.50    (#    693:10  Single Ambig)
 &rst
  ixpk= 693, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1045, 198,
 &end
#
#  101 LEU  HN           69 ALA  HN          4.20    (#    694:10  Unique         3.31, 3.51 A)
 &rst
  ixpk= 694, nxpk= 10, iat=1665,1083, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   70 SER  HN           69 ALA  HN          4.20    (#    695:10  Unique         4.28, 4.32 A)
 &rst
  ixpk= 695, nxpk= 10, iat=1093,1083, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  100 PHE  HD           69 ALA  HN          5.50    (#    696:10  Unique         4.97, 6.75 A)
 &rst
  ixpk= 696, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1653,1661,
 &end
#
#  151 PHE  HD           69 ALA  HN          5.50    (#    697:10  Unique         4.55, 6.59 A)
 &rst
  ixpk= 697, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#  102 LEU  HA           69 ALA  HN          5.50    (#    698:10  Unique         3.83, 4.14 A)
 &rst
  ixpk= 698, nxpk= 10, iat=1686,1083, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   69 ALA  HA           69 ALA  HN          3.50    (#    700:10  Unique         2.85, 2.89 A)
 &rst
  ixpk= 700, nxpk= 10, iat=1085,1083, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   68 LEU  HA           69 ALA  HN          4.20    (#    701:10  Unique         3.50, 3.52 A)
 &rst
  ixpk= 701, nxpk= 10, iat=1066,1083, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   67 ILE  HA           69 ALA  HN          4.20    (#    702:10  Unique         3.68, 3.84 A)
 &rst
  ixpk= 702, nxpk= 10, iat=1047,1083, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:703     69 ALA  HN          5.50    (#    703:10  Single Ambig)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1691,1028,1029,
 &end
#
#    0 AMB  10-2:704     69 ALA  HN          2.80    (#    704:10  Single Ambig)
 &rst
  ixpk= 704, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 3.66, r4= 4.41,
 igr1=1068,1069,1087,1088,1089,
 &end
#
#   67 ILE  QG2          69 ALA  HN          2.80    (#    705:10  Unique         2.50, 3.57 A)
 &rst
  ixpk= 705, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=1051,1052,1053,
 &end
#
#   68 LEU  HG           69 ALA  HN          5.50    (#    706:10  Unique         3.77, 3.95 A)
 &rst
  ixpk= 706, nxpk= 10, iat=1071,1083, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  MDY          69 ALA  HN          4.20    (#    707:10  Unique         2.36, 4.90 A)
 &rst
  ixpk= 707, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  10-2:709     70 SER  HN          5.50    (#    709:10  Single Ambig)
 &rst
  ixpk= 709, nxpk= 10, iat=  -1,1093, r1= 0.00, r2= 1.80, r3= 8.20, r4= 8.95,
 igr1=1674,1675,1676,1678,1679,1680,1606,1607, 759, 760,
       761,
 &end
#
#    0 AMB  10-2:710     70 SER  HN          5.50    (#    710:10  Single Ambig)
 &rst
  ixpk= 710, nxpk= 10, iat=  -1,1093, r1= 0.00, r2= 1.80, r3= 8.64, r4= 9.39,
 igr1=2554,2555,2556,2558,2559,2560,1058,1059,1060,1693,
      1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  10-2:711     70 SER  HN          4.20    (#    711:10  Single Ambig)
 &rst
  ixpk= 711, nxpk= 10, iat=  -1,1093, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1669,1670,2554,2555,2556,2558,2559,2560,
 &end
#
#   69 ALA  MB           70 SER  HN          2.80    (#    712:10  Unique         2.55, 3.56 A)
 &rst
  ixpk= 712, nxpk= 10, iat=  -1,1093, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=1087,1088,1089,
 &end
#
#   70 SER  HB-          70 SER  HN          4.20    (#    714:10  Unique         2.69, 3.61 A)
 &rst
  ixpk= 714, nxpk= 10, iat=  -1,1093, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1097,1098,
 &end
#
#   70 SER  HB+          70 SER  HN          5.50    (#    715:10  Unique         2.69, 3.61 A)
 &rst
  ixpk= 715, nxpk= 10, iat=  -1,1093, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1097,1098,
 &end
#
#   69 ALA  HA           70 SER  HN          2.80    (#    717:10  Unique         2.22, 2.26 A)
 &rst
  ixpk= 717, nxpk= 10, iat=1085,1093, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   70 SER  HA           70 SER  HN          3.50    (#    719:10  Unique         2.92, 2.92 A)
 &rst
  ixpk= 719, nxpk= 10, iat=1095,1093, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  151 PHE  HD           70 SER  HN          3.50    (#    721:10  Unique         3.80, 6.67 A)
 &rst
  ixpk= 721, nxpk= 10, iat=  -1,1093, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2515,2523,
 &end
#
#   69 ALA  HN           70 SER  HN          4.20    (#    722:10  Unique         4.28, 4.32 A)
 &rst
  ixpk= 722, nxpk= 10, iat=1083,1093, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  101 LEU  HN           70 SER  HN          5.50    (#    723:10  Unique         4.71, 4.87 A)
 &rst
  ixpk= 723, nxpk= 10, iat=1665,1093, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   71 THR  HN           70 SER  HN          5.50    (#    724:10  Unique         4.39, 4.40 A)
 &rst
  ixpk= 724, nxpk= 10, iat=1104,1093, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   72 ARG  HN           71 THR  HN          5.50    (#    726:10  Unique         4.47, 4.48 A)
 &rst
  ixpk= 726, nxpk= 10, iat=1118,1104, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   70 SER  HN           71 THR  HN          5.50    (#    727:10  Unique         4.39, 4.40 A)
 &rst
  ixpk= 727, nxpk= 10, iat=1093,1104, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HN           71 THR  HN          5.50    (#    729:10  Unique         4.13, 4.34 A)
 &rst
  ixpk= 729, nxpk= 10, iat=1621,1104, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HD           71 THR  HN          5.50    (#    730:10  Unique         5.09, 6.32 A)
 &rst
  ixpk= 730, nxpk= 10, iat=  -1,1104, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#   70 SER  HA           71 THR  HN          3.50    (#    731:10  Unique         2.32, 2.34 A)
 &rst
  ixpk= 731, nxpk= 10, iat=1095,1104, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   71 THR  HB           71 THR  HN          5.50    (#    733:10  Unique         3.65, 3.67 A)
 &rst
  ixpk= 733, nxpk= 10, iat=1108,1104, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   71 THR  HA           71 THR  HN          3.50    (#    734:10  Unique         2.90, 2.90 A)
 &rst
  ixpk= 734, nxpk= 10, iat=1106,1104, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   70 SER  HB+          71 THR  HN          4.20    (#    735:10  Unique         2.59, 3.19 A)
 &rst
  ixpk= 735, nxpk= 10, iat=  -1,1104, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1097,1098,
 &end
#
#    0 AMB  10-2:736     71 THR  HN          3.50    (#    736:10  Single Ambig)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1,1104, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1097,1098,1625,1626,
 &end
#
#   99 TRP  HB-          71 THR  HN          5.50    (#    737:10  Unique         3.59, 4.56 A)
 &rst
  ixpk= 737, nxpk= 10, iat=  -1,1104, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1625,1626,
 &end
#
#    0 AMB  10-2:738     71 THR  HN          5.50    (#    738:10  Single Ambig)
 &rst
  ixpk= 738, nxpk= 10, iat=  -1,1104, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1087,1088,1089,1068,1069,
 &end
#
#    0 AMB  10-2:739     71 THR  HN          5.50    (#    739:10  Single Ambig)
 &rst
  ixpk= 739, nxpk= 10, iat=  -1,1104, r1= 0.00, r2= 1.80, r3= 8.64, r4= 9.39,
 igr1=1189,1190,1191,1193,1194,1195,1051,1052,1053, 162,
       163, 164, 166, 167, 168,
 &end
#
#   71 THR  MG2          71 THR  HN          3.50    (#    740:10  Unique         2.02, 3.01 A)
 &rst
  ixpk= 740, nxpk= 10, iat=  -1,1104, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1110,1111,1112,
 &end
#
#    0 AMB  10-2:741     71 THR  HN          5.50    (#    741:10  Single Ambig)
 &rst
  ixpk= 741, nxpk= 10, iat=  -1,1104, r1= 0.00, r2= 1.80, r3= 8.54, r4= 9.29,
 igr1=1609,1610,1693,1694,1695,1697,1698,1699, 162, 163,
       164, 166, 167, 168,
 &end
#
#   71 THR  MG2          72 ARG  HN          3.50    (#    743:10  Unique         4.37, 5.13 A)
 &rst
  ixpk= 743, nxpk= 10, iat=  -1,1118, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1110,1111,1112,
 &end
#
#   72 ARG  HG-          72 ARG  HN          2.80    (#    744:10  Unique         1.99, 2.95 A)
 &rst
  ixpk= 744, nxpk= 10, iat=  -1,1118, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1125,1126,
 &end
#
#   72 ARG  HB+          72 ARG  HN          2.80    (#    745:10  Unique         2.14, 3.05 A)
 &rst
  ixpk= 745, nxpk= 10, iat=  -1,1118, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1122,1123,
 &end
#
#   72 ARG  HD+          72 ARG  HN          5.50    (#    746:10  Unique         3.78, 4.47 A)
 &rst
  ixpk= 746, nxpk= 10, iat=  -1,1118, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1128,1129,
 &end
#
#   72 ARG  HA           72 ARG  HN          3.50    (#    747:10  Unique         2.84, 2.89 A)
 &rst
  ixpk= 747, nxpk= 10, iat=1120,1118, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   71 THR  HA           72 ARG  HN          2.80    (#    748:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 748, nxpk= 10, iat=1106,1118, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   71 THR  HB           72 ARG  HN          4.20    (#    749:10  Unique         3.33, 3.37 A)
 &rst
  ixpk= 749, nxpk= 10, iat=1108,1118, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   73 ASN  HA           72 ARG  HN          5.50    (#    751:10  Unique         4.90, 5.03 A)
 &rst
  ixpk= 751, nxpk= 10, iat=1144,1118, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   73 ASN  HN           72 ARG  HN          3.50    (#    752:10  Unique         2.24, 2.36 A)
 &rst
  ixpk= 752, nxpk= 10, iat=1142,1118, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   71 THR  HN           72 ARG  HN          5.50    (#    753:10  Unique         4.47, 4.48 A)
 &rst
  ixpk= 753, nxpk= 10, iat=1104,1118, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   72 ARG  HN           73 ASN  HN          3.50    (#    754:10  Unique         2.24, 2.36 A)
 &rst
  ixpk= 754, nxpk= 10, iat=1118,1142, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   73 ASN  HD2+         73 ASN  HN          5.50    (#    755:10  Unique         2.18, 3.13 A)
 &rst
  ixpk= 755, nxpk= 10, iat=  -1,1142, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1151,1152,
 &end
#
#   73 ASN  HA           73 ASN  HN          2.80    (#    756:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 756, nxpk= 10, iat=1144,1142, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   71 THR  HB           73 ASN  HN          4.20    (#    758:10  Unique         2.77, 3.01 A)
 &rst
  ixpk= 758, nxpk= 10, iat=1108,1142, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   71 THR  HA           73 ASN  HN          4.20    (#    759:10  Unique         3.48, 3.57 A)
 &rst
  ixpk= 759, nxpk= 10, iat=1106,1142, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   72 ARG  HA           73 ASN  HN          3.50    (#    760:10  Unique         3.32, 3.41 A)
 &rst
  ixpk= 760, nxpk= 10, iat=1120,1142, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   72 ARG  HD+          73 ASN  HN          5.50    (#    761:10  Unique         4.99, 5.82 A)
 &rst
  ixpk= 761, nxpk= 10, iat=  -1,1142, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1128,1129,
 &end
#
#   73 ASN  HB+          73 ASN  HN          3.50    (#    762:10  Unique         2.27, 3.14 A)
 &rst
  ixpk= 762, nxpk= 10, iat=  -1,1142, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1146,1147,
 &end
#
#   73 ASN  HB-          73 ASN  HN          2.80    (#    763:10  Unique         2.27, 3.14 A)
 &rst
  ixpk= 763, nxpk= 10, iat=  -1,1142, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1146,1147,
 &end
#
#   72 ARG  HG-          73 ASN  HN          4.20    (#    764:10  Unique         3.10, 4.58 A)
 &rst
  ixpk= 764, nxpk= 10, iat=  -1,1142, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1125,1126,
 &end
#
#   72 ARG  HB+          73 ASN  HN          2.80    (#    765:10  Unique         2.88, 3.66 A)
 &rst
  ixpk= 765, nxpk= 10, iat=  -1,1142, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1122,1123,
 &end
#
#   71 THR  MG2          73 ASN  HN          4.20    (#    766:10  Unique         4.92, 5.47 A)
 &rst
  ixpk= 766, nxpk= 10, iat=  -1,1142, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1110,1111,1112,
 &end
#
#    0 AMB  10-2:767     74 TRP  HN          5.50    (#    767:10  Single Ambig)
 &rst
  ixpk= 767, nxpk= 10, iat=  -1,1156, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1189,1190,1191,1193,1194,1195,1206,1207,
 &end
#
#    0 AMB  10-2:768     74 TRP  HN          2.80    (#    768:10  Single Ambig)
 &rst
  ixpk= 768, nxpk= 10, iat=  -1,1156, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1160,1161,1146,1147,
 &end
#
#   73 ASN  HB-          74 TRP  HN          2.81    (#    769:10  Unique         3.06, 3.89 A)
 &rst
  ixpk= 769, nxpk= 10, iat=  -1,1156, r1= 0.00, r2= 1.80, r3= 3.15, r4= 3.90,
 igr1=1146,1147,
 &end
#
#   74 TRP  HA           74 TRP  HN          4.20    (#    770:10  Unique         2.75, 2.84 A)
 &rst
  ixpk= 770, nxpk= 10, iat=1158,1156, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   73 ASN  HA           74 TRP  HN          2.85    (#    772:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 772, nxpk= 10, iat=1144,1156, r1= 0.00, r2= 1.80, r3= 2.85, r4= 3.60,  &end
#
#   74 TRP  HD1          74 TRP  HN          4.20    (#    773:10  Unique         1.92, 2.10 A)
 &rst
  ixpk= 773, nxpk= 10, iat=1164,1156, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   75 LEU  HN           74 TRP  HN          5.50    (#    775:10  Unique         4.23, 4.38 A)
 &rst
  ixpk= 775, nxpk= 10, iat=1180,1156, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   74 TRP  HE1          74 TRP  HN          5.50    (#    776:10  Unique         4.22, 4.38 A)
 &rst
  ixpk= 776, nxpk= 10, iat=1166,1156, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   97 GLN  HN           75 LEU  HN          5.50    (#    777:10  Unique         4.05, 4.70 A)
 &rst
  ixpk= 777, nxpk= 10, iat=1582,1180, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   76 ARG  HN           75 LEU  HN          5.50    (#    778:10  Unique         2.76, 3.51 A)
 &rst
  ixpk= 778, nxpk= 10, iat=1199,1180, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:779     75 LEU  HN          5.50    (#    779:10  Single Ambig)
 &rst
  ixpk= 779, nxpk= 10, iat=  -1,1180, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1156,1142,
 &end
#
#   74 TRP  HA           75 LEU  HN          2.80    (#    782:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 782, nxpk= 10, iat=1158,1180, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   74 TRP  HB-          75 LEU  HN          5.50    (#    783:10  Unique         2.97, 3.97 A)
 &rst
  ixpk= 783, nxpk= 10, iat=  -1,1180, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1160,1161,
 &end
#
#    0 AMB  10-2:784     75 LEU  HN          4.20    (#    784:10  Single Ambig)
 &rst
  ixpk= 784, nxpk= 10, iat=  -1,1180, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1160,1161,1146,1147,
 &end
#
#   97 GLN  HB+          75 LEU  HN          5.50    (#    785:10  Unique         3.73, 4.72 A)
 &rst
  ixpk= 785, nxpk= 10, iat=  -1,1180, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1586,1587,
 &end
#
#   75 LEU  HB-          75 LEU  HN          3.50    (#    786:10  Unique         2.47, 3.16 A)
 &rst
  ixpk= 786, nxpk= 10, iat=  -1,1180, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1184,1185,
 &end
#
#   75 LEU  HG           75 LEU  HN          2.80    (#    787:10  Unique         1.93, 2.20 A)
 &rst
  ixpk= 787, nxpk= 10, iat=1187,1180, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:788     75 LEU  HN          3.50    (#    788:10  Single Ambig)
 &rst
  ixpk= 788, nxpk= 10, iat=  -1,1180, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1189,1190,1191,1193,1194,1195,1189,1190,1191,1193,
      1194,1195,
 &end
#
#   98 LYS  HG+          75 LEU  HN          5.50    (#    789:10  Unique         6.30, 7.96 A)
 &rst
  ixpk= 789, nxpk= 10, iat=  -1,1180, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1606,1607,
 &end
#
#   75 LEU  MDY          76 ARG  HN          5.50    (#    790:10  Unique         4.43, 6.14 A)
 &rst
  ixpk= 790, nxpk= 10, iat=  -1,1199, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1189,1190,1191,1193,1194,1195,
 &end
#
#   76 ARG  HB-          76 ARG  HN          2.80    (#    791:10  Unique         2.25, 3.24 A)
 &rst
  ixpk= 791, nxpk= 10, iat=  -1,1199, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1203,1204,
 &end
#
#   76 ARG  HB+          76 ARG  HN          3.50    (#    792:10  Unique         2.25, 3.24 A)
 &rst
  ixpk= 792, nxpk= 10, iat=  -1,1199, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1203,1204,
 &end
#
#    0 AMB  10-2:793     76 ARG  HN          4.20    (#    793:10  Single Ambig)
 &rst
  ixpk= 793, nxpk= 10, iat=  -1,1199, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1184,1185,1254,1255,
 &end
#
#    0 AMB  10-2:794     76 ARG  HN          5.50    (#    794:10  Single Ambig)
 &rst
  ixpk= 794, nxpk= 10, iat=  -1,1199, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1586,1587,1187,
 &end
#
#    0 AMB  10-2:795     76 ARG  HN          5.50    (#    795:10  Single Ambig)
 &rst
  ixpk= 795, nxpk= 10, iat=  -1,1199, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1209,1210,1586,1587,
 &end
#
#   76 ARG  HD+          76 ARG  HN          5.50    (#    796:10  Unique         3.55, 4.36 A)
 &rst
  ixpk= 796, nxpk= 10, iat=  -1,1199, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1209,1210,
 &end
#
#   76 ARG  HA           76 ARG  HN          4.20    (#    797:10  Unique         2.91, 2.94 A)
 &rst
  ixpk= 797, nxpk= 10, iat=1201,1199, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   75 LEU  HN           76 ARG  HN          5.50    (#    798:10  Unique         2.76, 3.51 A)
 &rst
  ixpk= 798, nxpk= 10, iat=1180,1199, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   95 GLN  HN           77 TYR  HN          4.20    (#    799:10  Unique         3.48, 4.83 A)
 &rst
  ixpk= 799, nxpk= 10, iat=1543,1223, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  100 PHE  HD          100 PHE  HN          3.50    (#    801:10  Unique         3.10, 4.55 A)
 &rst
  ixpk= 801, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1653,1661,
 &end
#
#  100 PHE  HD          100 PHE  HN          2.80    (#    802:10  Unique         3.10, 4.55 A)
 &rst
  ixpk= 802, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1653,1661,
 &end
#
#  151 PHE  HD          100 PHE  HN          5.50    (#    804:10  Unique         5.58, 6.38 A)
 &rst
  ixpk= 804, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#   77 TYR  HD           77 TYR  HN          5.50    (#    805:10  Unique         2.68, 3.61 A)
 &rst
  ixpk= 805, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1231,1240,
 &end
#
#   96 LYS  HA           77 TYR  HN          5.50    (#    806:10  Unique         3.57, 5.02 A)
 &rst
  ixpk= 806, nxpk= 10, iat=1562,1223, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   96 LYS  HA           77 TYR  HN          5.50    (#    807:10  Unique         3.57, 5.02 A)
 &rst
  ixpk= 807, nxpk= 10, iat=1562,1223, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HA          100 PHE  HN          2.80    (#    808:10  Unique         2.14, 2.19 A)
 &rst
  ixpk= 808, nxpk= 10, iat=1623,1645, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   76 ARG  HA           77 TYR  HN          2.80    (#    809:10  Unique         2.16, 2.28 A)
 &rst
  ixpk= 809, nxpk= 10, iat=1201,1223, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  101 LEU  HA          100 PHE  HN          5.50    (#    810:10  Unique         4.65, 4.73 A)
 &rst
  ixpk= 810, nxpk= 10, iat=1667,1645, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   77 TYR  HA           77 TYR  HN          5.50    (#    811:10  Unique         2.89, 2.94 A)
 &rst
  ixpk= 811, nxpk= 10, iat=1225,1223, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   77 TYR  HA           77 TYR  HN          5.50    (#    812:10  Unique         2.89, 2.94 A)
 &rst
  ixpk= 812, nxpk= 10, iat=1225,1223, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   77 TYR  HB+          77 TYR  HN          4.20    (#    816:10  Unique         2.38, 3.45 A)
 &rst
  ixpk= 816, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1227,1228,
 &end
#
#   76 ARG  HD+          77 TYR  HN          5.50    (#    817:10  Unique         1.88, 4.11 A)
 &rst
  ixpk= 817, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1209,1210,
 &end
#
#   99 TRP  HB-         100 PHE  HN          5.50    (#    818:10  Unique         2.87, 3.57 A)
 &rst
  ixpk= 818, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1625,1626,
 &end
#
#   99 TRP  HB+         100 PHE  HN          5.50    (#    819:10  Unique         2.87, 3.57 A)
 &rst
  ixpk= 819, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1625,1626,
 &end
#
#  100 PHE  HB+         100 PHE  HN          4.20    (#    820:10  Unique         2.56, 3.13 A)
 &rst
  ixpk= 820, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1649,1650,
 &end
#
#   76 ARG  HD-          77 TYR  HN          5.50    (#    821:10  Unique         1.88, 4.11 A)
 &rst
  ixpk= 821, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1209,1210,
 &end
#
#   76 ARG  HB+          77 TYR  HN          4.20    (#    822:10  Unique         2.65, 3.41 A)
 &rst
  ixpk= 822, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1203,1204,
 &end
#
#   76 ARG  HB-          77 TYR  HN          5.50    (#    824:10  Unique         2.65, 3.41 A)
 &rst
  ixpk= 824, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1203,1204,
 &end
#
#   76 ARG  HB-          77 TYR  HN          3.50    (#    825:10  Unique         2.65, 3.41 A)
 &rst
  ixpk= 825, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1203,1204,
 &end
#
#    0 AMB  10-2:826     77 TYR  HN          5.50    (#    826:10  Single Ambig)
 &rst
  ixpk= 826, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1251,1252,1547,1548,2304,2305,
 &end
#
#   76 ARG  HG-          77 TYR  HN          5.50    (#    827:10  Unique         2.36, 4.60 A)
 &rst
  ixpk= 827, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1206,1207,
 &end
#
#  143 VAL  MGY          77 TYR  HN          5.50    (#    828:10  Unique         5.49, 7.51 A)
 &rst
  ixpk= 828, nxpk= 10, iat=  -1,1223, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#    0 AMB  10-2:829    100 PHE  HN          5.50    (#    829:10  Single Ambig)
 &rst
  ixpk= 829, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 8.64, r4= 9.39,
 igr1= 162, 163, 164, 166, 167, 168,1051,1052,1053,1189,
      1190,1191,1193,1194,1195,
 &end
#
#   71 THR  MG2         100 PHE  HN          5.50    (#    830:10  Unique         4.93, 6.08 A)
 &rst
  ixpk= 830, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1110,1111,1112,
 &end
#
#    0 AMB  10-2:831    100 PHE  HN          4.20    (#    831:10  Single Ambig)
 &rst
  ixpk= 831, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 7.03, r4= 7.78,
 igr1= 162, 163, 164, 166, 167, 168, 185, 186, 187, 227,
       228, 229,1609,1610, 224, 225, 834, 835, 836, 838,
       839, 840,
 &end
#
#    0 AMB  10-2:832    100 PHE  HN          5.50    (#    832:10  Single Ambig)
 &rst
  ixpk= 832, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 204, 205, 206, 208, 209, 210,1606,1607,
 &end
#
#   78 LYS  HG-          78 LYS  HN          4.20    (#    833:10  Unique         2.08, 3.45 A)
 &rst
  ixpk= 833, nxpk= 10, iat=  -1,1244, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1251,1252,
 &end
#
#   78 LYS  HG+          78 LYS  HN          4.20    (#    834:10  Unique         2.08, 3.45 A)
 &rst
  ixpk= 834, nxpk= 10, iat=  -1,1244, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1251,1252,
 &end
#
#    0 AMB  10-2:835     78 LYS  HN          2.80    (#    835:10  Single Ambig)
 &rst
  ixpk= 835, nxpk= 10, iat=  -1,1244, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1254,1255,1248,1249,
 &end
#
#   78 LYS  HB+          78 LYS  HN          3.50    (#    836:10  Unique         2.56, 3.17 A)
 &rst
  ixpk= 836, nxpk= 10, iat=  -1,1244, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1248,1249,
 &end
#
#    0 AMB  10-2:837     78 LYS  HN          2.80    (#    837:10  Single Ambig)
 &rst
  ixpk= 837, nxpk= 10, iat=  -1,1244, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1227,1228,1227,1228,
 &end
#
#   78 LYS  HA           78 LYS  HN          4.20    (#    838:10  Unique         2.90, 2.93 A)
 &rst
  ixpk= 838, nxpk= 10, iat=1246,1244, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   77 TYR  HA           78 LYS  HN          2.80    (#    839:10  Unique         2.14, 2.27 A)
 &rst
  ixpk= 839, nxpk= 10, iat=1225,1244, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:841     79 LEU  HN          5.50    (#    841:10  Single Ambig)
 &rst
  ixpk= 841, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1543,1299,
 &end
#
#    0 AMB  10-2:842     79 LEU  HN          5.50    (#    842:10  Single Ambig)
 &rst
  ixpk= 842, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1244,1223,
 &end
#
#   94 GLY  HN           79 LEU  HN          5.50    (#    843:10  Unique         5.47, 5.52 A)
 &rst
  ixpk= 843, nxpk= 10, iat=1536,1266, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   77 TYR  HD           79 LEU  HN          5.50    (#    844:10  Unique         3.80, 6.24 A)
 &rst
  ixpk= 844, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1231,1240,
 &end
#
#   78 LYS  HA           79 LEU  HN          2.80    (#    845:10  Unique         2.14, 2.22 A)
 &rst
  ixpk= 845, nxpk= 10, iat=1246,1266, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:846     79 LEU  HN          2.80    (#    846:10  Single Ambig)
 &rst
  ixpk= 846, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=1268,1538,1539,
 &end
#
#   77 TYR  HB-          79 LEU  HN          5.50    (#    848:10  Unique         5.13, 6.54 A)
 &rst
  ixpk= 848, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1227,1228,
 &end
#
#   80 PRO  HD+          79 LEU  HN          5.50    (#    849:10  Unique         4.81, 4.91 A)
 &rst
  ixpk= 849, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1286,1287,
 &end
#
#   78 LYS  HB+          79 LEU  HN          4.20    (#    850:10  Unique         2.82, 3.45 A)
 &rst
  ixpk= 850, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1248,1249,
 &end
#
#    0 AMB  10-2:851     79 LEU  HN          3.50    (#    851:10  Single Ambig)
 &rst
  ixpk= 851, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1248,1249,1254,1255,
 &end
#
#    0 AMB  10-2:852     79 LEU  HN          3.50    (#    852:10  Single Ambig)
 &rst
  ixpk= 852, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1251,1252,1352,
 &end
#
#   79 LEU  HG           79 LEU  HN          2.80    (#    853:10  Unique         1.90, 1.98 A)
 &rst
  ixpk= 853, nxpk= 10, iat=1273,1266, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   79 LEU  HB+          79 LEU  HN          2.80    (#    854:10  Unique         3.10, 3.39 A)
 &rst
  ixpk= 854, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1270,1271,
 &end
#
#   79 LEU  MDY          79 LEU  HN          2.80    (#    855:10  Unique         1.94, 3.65 A)
 &rst
  ixpk= 855, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#   79 LEU  MDX          79 LEU  HN          2.80    (#    856:10  Unique         1.94, 3.65 A)
 &rst
  ixpk= 856, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#   84 VAL  MGY          81 LYS  HN          5.50    (#    857:10  Unique         3.56, 6.08 A)
 &rst
  ixpk= 857, nxpk= 10, iat=  -1,1299, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  10-2:858     81 LYS  HN          3.50    (#    858:10  Single Ambig)
 &rst
  ixpk= 858, nxpk= 10, iat=  -1,1299, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1306,1307,1328,1329,
 &end
#
#    0 AMB  10-2:859     81 LYS  HN          2.80    (#    859:10  Single Ambig)
 &rst
  ixpk= 859, nxpk= 10, iat=  -1,1299, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1303,1304,1303,1304,
 &end
#
#    0 AMB  10-2:860     81 LYS  HN          2.80    (#    860:10  Single Ambig)
 &rst
  ixpk= 860, nxpk= 10, iat=  -1,1299, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1306,1307,1292,1293,
 &end
#
#   81 LYS  HD+          81 LYS  HN          4.20    (#    861:10  Unique         1.88, 3.14 A)
 &rst
  ixpk= 861, nxpk= 10, iat=  -1,1299, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1309,1310,
 &end
#
#   80 PRO  HB+          81 LYS  HN          3.50    (#    862:10  Unique         2.38, 3.04 A)
 &rst
  ixpk= 862, nxpk= 10, iat=  -1,1299, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1292,1293,
 &end
#
#   81 LYS  HE+          81 LYS  HN          5.50    (#    863:10  Unique         1.94, 4.13 A)
 &rst
  ixpk= 863, nxpk= 10, iat=  -1,1299, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1312,1313,
 &end
#
#   81 LYS  HA           81 LYS  HN          2.80    (#    864:10  Unique         2.76, 2.81 A)
 &rst
  ixpk= 864, nxpk= 10, iat=1301,1299, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   80 PRO  HA           81 LYS  HN          2.80    (#    865:10  Unique         2.33, 2.40 A)
 &rst
  ixpk= 865, nxpk= 10, iat=1295,1299, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   83 LEU  HN           81 LYS  HN          5.50    (#    867:10  Unique         4.04, 4.18 A)
 &rst
  ixpk= 867, nxpk= 10, iat=1345,1299, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   83 LEU  HN           82 ARG  HN          3.50    (#    868:10  Unique         2.47, 2.66 A)
 &rst
  ixpk= 868, nxpk= 10, iat=1345,1321, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   84 VAL  HN           82 ARG  HN          5.50    (#    869:10  Unique         3.81, 3.91 A)
 &rst
  ixpk= 869, nxpk= 10, iat=1364,1321, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   82 ARG  HA           82 ARG  HN          2.80    (#    871:10  Unique         2.77, 2.80 A)
 &rst
  ixpk= 871, nxpk= 10, iat=1323,1321, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   81 LYS  HA           82 ARG  HN          4.20    (#    873:10  Unique         3.41, 3.47 A)
 &rst
  ixpk= 873, nxpk= 10, iat=1301,1321, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   82 ARG  HD+          82 ARG  HN          4.20    (#    874:10  Unique         4.14, 4.43 A)
 &rst
  ixpk= 874, nxpk= 10, iat=  -1,1321, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1331,1332,
 &end
#
#   80 PRO  HB+          82 ARG  HN          5.50    (#    875:10  Unique         2.18, 3.19 A)
 &rst
  ixpk= 875, nxpk= 10, iat=  -1,1321, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1292,1293,
 &end
#
#    0 AMB  10-2:876     82 ARG  HN          2.80    (#    876:10  Single Ambig)
 &rst
  ixpk= 876, nxpk= 10, iat=  -1,1321, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1325,1326,1303,1304,1303,1304,
 &end
#
#    0 AMB  10-2:877     82 ARG  HN          2.80    (#    877:10  Single Ambig)
 &rst
  ixpk= 877, nxpk= 10, iat=  -1,1321, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1309,1310,1325,1326,
 &end
#
#    0 AMB  10-2:878     82 ARG  HN          2.80    (#    878:10  Single Ambig)
 &rst
  ixpk= 878, nxpk= 10, iat=  -1,1321, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1328,1329,1306,1307,
 &end
#
#    0 AMB  10-2:879     82 ARG  HN          4.20    (#    879:10  Single Ambig)
 &rst
  ixpk= 879, nxpk= 10, iat=  -1,1321, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 &end
#
#   84 VAL  MGX          83 LEU  HN          5.50    (#    881:10  Unique         3.47, 5.29 A)
 &rst
  ixpk= 881, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  10-2:883     83 LEU  HN          2.80    (#    883:10  Single Ambig)
 &rst
  ixpk= 883, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=1354,1355,1356,1358,1359,1360,1354,1355,1356,1358,
      1359,1360,
 &end
#
#   79 LEU  MDX          83 LEU  HN          5.50    (#    884:10  Unique         4.33, 6.19 A)
 &rst
  ixpk= 884, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#    0 AMB  10-2:885     83 LEU  HN          2.80    (#    885:10  Single Ambig)
 &rst
  ixpk= 885, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1328,1329,1349,1350,
 &end
#
#   83 LEU  HB+          83 LEU  HN          2.80    (#    886:10  Unique         2.26, 3.18 A)
 &rst
  ixpk= 886, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1349,1350,
 &end
#
#    0 AMB  10-2:887     83 LEU  HN          3.50    (#    887:10  Single Ambig)
 &rst
  ixpk= 887, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1325,1326,1303,1304,
 &end
#
#   80 PRO  HB+          83 LEU  HN          5.50    (#    888:10  Unique         3.37, 4.45 A)
 &rst
  ixpk= 888, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1292,1293,
 &end
#
#   82 ARG  HD+          83 LEU  HN          5.50    (#    890:10  Unique         4.12, 4.65 A)
 &rst
  ixpk= 890, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1331,1332,
 &end
#
#   84 VAL  HA           83 LEU  HN          5.50    (#    891:10  Unique         4.59, 4.68 A)
 &rst
  ixpk= 891, nxpk= 10, iat=1366,1345, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   81 LYS  HA           83 LEU  HN          5.50    (#    892:10  Unique         3.43, 3.55 A)
 &rst
  ixpk= 892, nxpk= 10, iat=1301,1345, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   82 ARG  HA           83 LEU  HN          3.50    (#    894:10  Unique         3.30, 3.41 A)
 &rst
  ixpk= 894, nxpk= 10, iat=1323,1345, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:895     83 LEU  HN          2.80    (#    895:10  Single Ambig)
 &rst
  ixpk= 895, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1347,1295,
 &end
#
#   84 VAL  HN           83 LEU  HN          2.80    (#    896:10  Unique         1.88, 1.99 A)
 &rst
  ixpk= 896, nxpk= 10, iat=1364,1345, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   82 ARG  HN           83 LEU  HN          3.50    (#    897:10  Unique         2.47, 2.66 A)
 &rst
  ixpk= 897, nxpk= 10, iat=1321,1345, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 TRP  HE1          84 VAL  HN          5.50    (#    898:10  Unique         4.28, 4.59 A)
 &rst
  ixpk= 898, nxpk= 10, iat=1414,1364, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   82 ARG  HN           84 VAL  HN          5.50    (#    899:10  Unique         3.81, 3.91 A)
 &rst
  ixpk= 899, nxpk= 10, iat=1321,1364, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   85 ARG  HN           84 VAL  HN          5.50    (#    900:10  Unique         4.34, 4.44 A)
 &rst
  ixpk= 900, nxpk= 10, iat=1380,1364, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   83 LEU  HN           84 VAL  HN          2.80    (#    901:10  Unique         1.88, 1.99 A)
 &rst
  ixpk= 901, nxpk= 10, iat=1345,1364, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   82 ARG  HA           84 VAL  HN          4.20    (#    902:10  Unique         3.84, 4.21 A)
 &rst
  ixpk= 902, nxpk= 10, iat=1323,1364, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   83 LEU  HA           84 VAL  HN          3.50    (#    903:10  Unique         3.27, 3.37 A)
 &rst
  ixpk= 903, nxpk= 10, iat=1347,1364, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   81 LYS  HA           84 VAL  HN          4.20    (#    904:10  Unique         2.70, 2.83 A)
 &rst
  ixpk= 904, nxpk= 10, iat=1301,1364, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   84 VAL  HA           84 VAL  HN          3.50    (#    905:10  Unique         2.90, 2.92 A)
 &rst
  ixpk= 905, nxpk= 10, iat=1366,1364, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   80 PRO  HD+          84 VAL  HN          5.50    (#    906:10  Unique         5.30, 6.23 A)
 &rst
  ixpk= 906, nxpk= 10, iat=  -1,1364, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1286,1287,
 &end
#
#    0 AMB  10-2:907     84 VAL  HN          5.50    (#    907:10  Single Ambig)
 &rst
  ixpk= 907, nxpk= 10, iat=  -1,1364, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1303,1304,1325,1326,
 &end
#
#    0 AMB  10-2:908     84 VAL  HN          2.80    (#    908:10  Single Ambig)
 &rst
  ixpk= 908, nxpk= 10, iat=  -1,1364, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=1368,1328,1329,
 &end
#
#   84 VAL  MGY          84 VAL  HN          2.80    (#    909:10  Unique         2.35, 3.83 A)
 &rst
  ixpk= 909, nxpk= 10, iat=  -1,1364, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   84 VAL  MGX          84 VAL  HN          3.50    (#    910:10  Unique         2.35, 3.83 A)
 &rst
  ixpk= 910, nxpk= 10, iat=  -1,1364, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   84 VAL  MGX          85 ARG  HN          2.80    (#    913:10  Unique         2.19, 4.35 A)
 &rst
  ixpk= 913, nxpk= 10, iat=  -1,1380, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   91 VAL  MGX          85 ARG  HN          5.50    (#    914:10  Unique         2.23, 3.98 A)
 &rst
  ixpk= 914, nxpk= 10, iat=  -1,1380, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  10-2:915      0 AMB  10-1:915    2.80    (#    915:10  Double Ambig)
 &rst
  ixpk= 915, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.53, r4= 5.28,
 igr1=1370,1371,1372,1374,1375,1376,  34,  35,  36,
 igr2=1380,1506,
 &end
#
#   91 VAL  MGY          85 ARG  HN          5.50    (#    916:10  Unique         2.23, 3.98 A)
 &rst
  ixpk= 916, nxpk= 10, iat=  -1,1380, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   85 ARG  HG-          85 ARG  HN          3.50    (#    917:10  Unique         2.99, 3.68 A)
 &rst
  ixpk= 917, nxpk= 10, iat=  -1,1380, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1387,1388,
 &end
#
#    0 AMB  10-2:918     85 ARG  HN          2.80    (#    918:10  Single Ambig)
 &rst
  ixpk= 918, nxpk= 10, iat=  -1,1380, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1384,1385,1387,1388,
 &end
#
#   85 ARG  HB+          85 ARG  HN          3.50    (#    919:10  Unique         2.24, 2.94 A)
 &rst
  ixpk= 919, nxpk= 10, iat=  -1,1380, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1384,1385,
 &end
#
#   92 CYS  HB-          92 CYS  HN          5.50    (#    920:10  Unique         2.70, 3.23 A)
 &rst
  ixpk= 920, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1510,1511,
 &end
#
#   85 ARG  HD+          85 ARG  HN          5.50    (#    921:10  Unique         4.40, 4.83 A)
 &rst
  ixpk= 921, nxpk= 10, iat=  -1,1380, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1390,1391,
 &end
#
#   84 VAL  HA           85 ARG  HN          2.80    (#    922:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 922, nxpk= 10, iat=1366,1380, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   91 VAL  HA           92 CYS  HN          5.50    (#    923:10  Unique         2.28, 2.29 A)
 &rst
  ixpk= 923, nxpk= 10, iat=1492,1506, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   85 ARG  HA           85 ARG  HN          3.50    (#    924:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 924, nxpk= 10, iat=1382,1380, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:926     85 ARG  HN          5.50    (#    926:10  Single Ambig)
 &rst
  ixpk= 926, nxpk= 10, iat=  -1,1380, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1364,1419,
 &end
#
#   86 TRP  HN           85 ARG  HN          5.50    (#    928:10  Unique         4.13, 4.25 A)
 &rst
  ixpk= 928, nxpk= 10, iat=1404,1380, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   87 ASP  HN           86 TRP  HN          2.80    (#    930:10  Unique         2.10, 2.19 A)
 &rst
  ixpk= 930, nxpk= 10, iat=1428,1404, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:931     86 TRP  HN          5.50    (#    931:10  Single Ambig)
 &rst
  ixpk= 931, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1380,1490,
 &end
#
#   86 TRP  HE3          86 TRP  HN          5.50    (#    932:10  Unique         4.89, 4.97 A)
 &rst
  ixpk= 932, nxpk= 10, iat=1423,1404, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   88 THR  HN           86 TRP  HN          5.50    (#    933:10  Unique         3.89, 4.19 A)
 &rst
  ixpk= 933, nxpk= 10, iat=1440,1404, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   86 TRP  HD1          86 TRP  HN          3.50    (#    934:10  Unique         2.13, 2.19 A)
 &rst
  ixpk= 934, nxpk= 10, iat=1412,1404, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   85 ARG  HA           86 TRP  HN          2.80    (#    935:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 935, nxpk= 10, iat=1382,1404, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   86 TRP  HA           86 TRP  HN          2.80    (#    936:10  Unique         2.91, 2.92 A)
 &rst
  ixpk= 936, nxpk= 10, iat=1406,1404, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   86 TRP  HB+          86 TRP  HN          2.80    (#    937:10  Unique         2.89, 3.29 A)
 &rst
  ixpk= 937, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1408,1409,
 &end
#
#   85 ARG  HD+          86 TRP  HN          4.20    (#    938:10  Unique         3.41, 4.10 A)
 &rst
  ixpk= 938, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1390,1391,
 &end
#
#   86 TRP  HB-          86 TRP  HN          2.80    (#    939:10  Unique         2.89, 3.29 A)
 &rst
  ixpk= 939, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1408,1409,
 &end
#
#   87 ASP  HB+          86 TRP  HN          5.50    (#    940:10  Unique         3.83, 4.63 A)
 &rst
  ixpk= 940, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1432,1433,
 &end
#
#   87 ASP  HB-          86 TRP  HN          5.50    (#    941:10  Unique         3.83, 4.63 A)
 &rst
  ixpk= 941, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1432,1433,
 &end
#
#   85 ARG  HB+          86 TRP  HN          4.20    (#    942:10  Unique         3.59, 4.12 A)
 &rst
  ixpk= 942, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1384,1385,
 &end
#
#   85 ARG  HB-          86 TRP  HN          3.90    (#    943:10  Unique         3.59, 4.12 A)
 &rst
  ixpk= 943, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 4.38, r4= 5.13,
 igr1=1384,1385,
 &end
#
#   85 ARG  HG-          86 TRP  HN          4.20    (#    944:10  Unique         4.81, 5.20 A)
 &rst
  ixpk= 944, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1387,1388,
 &end
#
#   91 VAL  MGY          86 TRP  HN          5.50    (#    945:10  Unique         3.75, 5.54 A)
 &rst
  ixpk= 945, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   91 VAL  MGX          86 TRP  HN          5.50    (#    946:10  Unique         3.75, 5.54 A)
 &rst
  ixpk= 946, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   84 VAL  MGX          86 TRP  HN          4.20    (#    947:10  Unique         4.22, 6.30 A)
 &rst
  ixpk= 947, nxpk= 10, iat=  -1,1404, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   88 THR  MG2          87 ASP  HN          4.50    (#    948:10  Unique         3.78, 4.86 A)
 &rst
  ixpk= 948, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1446,1447,1448,
 &end
#
#   85 ARG  HG-          87 ASP  HN          5.50    (#    949:10  Unique         5.47, 5.53 A)
 &rst
  ixpk= 949, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1387,1388,
 &end
#
#    0 AMB  10-2:950     87 ASP  HN          3.50    (#    950:10  Single Ambig)
 &rst
  ixpk= 950, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1384,1385,1387,1388,
 &end
#
#   85 ARG  HB+          87 ASP  HN          4.20    (#    951:10  Unique         3.34, 4.20 A)
 &rst
  ixpk= 951, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1384,1385,
 &end
#
#   87 ASP  HB-          87 ASP  HN          2.80    (#    952:10  Unique         2.12, 2.70 A)
 &rst
  ixpk= 952, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1432,1433,
 &end
#
#   87 ASP  HB+          87 ASP  HN          2.80    (#    953:10  Unique         2.12, 2.70 A)
 &rst
  ixpk= 953, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1432,1433,
 &end
#
#   86 TRP  HB-          87 ASP  HN          3.50    (#    954:10  Unique         3.14, 3.87 A)
 &rst
  ixpk= 954, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1408,1409,
 &end
#
#   85 ARG  HD+          87 ASP  HN          5.50    (#    955:10  Unique         3.18, 4.00 A)
 &rst
  ixpk= 955, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1390,1391,
 &end
#
#   86 TRP  HB+          87 ASP  HN          3.50    (#    956:10  Unique         3.14, 3.87 A)
 &rst
  ixpk= 956, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1408,1409,
 &end
#
#   88 THR  HB           87 ASP  HN          5.50    (#    957:10  Unique         4.59, 4.63 A)
 &rst
  ixpk= 957, nxpk= 10, iat=1444,1428, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:958     87 ASP  HN          3.50    (#    958:10  Single Ambig)
 &rst
  ixpk= 958, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1406,1442,
 &end
#
#    0 AMB  10-2:959     87 ASP  HN          2.80    (#    959:10  Single Ambig)
 &rst
  ixpk= 959, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1430,1382,
 &end
#
#   88 THR  HN           87 ASP  HN          2.80    (#    961:10  Unique         2.61, 2.74 A)
 &rst
  ixpk= 961, nxpk= 10, iat=1440,1428, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   86 TRP  HN           87 ASP  HN          2.80    (#    964:10  Unique         2.10, 2.19 A)
 &rst
  ixpk= 964, nxpk= 10, iat=1404,1428, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:965     87 ASP  HN          5.50    (#    965:10  Single Ambig)
 &rst
  ixpk= 965, nxpk= 10, iat=  -1,1428, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1380,1490,
 &end
#
#   91 VAL  MGX          88 THR  HN          5.50    (#    966:10  Unique         4.65, 6.49 A)
 &rst
  ixpk= 966, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   88 THR  MG2          88 THR  HN          2.80    (#    967:10  Unique         2.09, 3.24 A)
 &rst
  ixpk= 967, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=1446,1447,1448,
 &end
#
#   89 LYS  HG+          88 THR  HN          5.50    (#    968:10  Unique         5.89, 6.15 A)
 &rst
  ixpk= 968, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1461,1462,
 &end
#
#    0 AMB  10-2:969     88 THR  HN          3.50    (#    969:10  Single Ambig)
 &rst
  ixpk= 969, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1384,1385,1387,1388,
 &end
#
#   85 ARG  HB+          88 THR  HN          5.50    (#    970:10  Unique         3.14, 4.42 A)
 &rst
  ixpk= 970, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1384,1385,
 &end
#
#   87 ASP  HB-          88 THR  HN          4.20    (#    971:10  Unique         3.92, 4.08 A)
 &rst
  ixpk= 971, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1432,1433,
 &end
#
#   87 ASP  HB+          88 THR  HN          4.20    (#    972:10  Unique         3.92, 4.08 A)
 &rst
  ixpk= 972, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1432,1433,
 &end
#
#    0 AMB  10-2:973     88 THR  HN          5.50    (#    973:10  Single Ambig)
 &rst
  ixpk= 973, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1408,1409,1467,1468,
 &end
#
#   88 THR  HB           88 THR  HN          3.50    (#    975:10  Unique         2.88, 3.21 A)
 &rst
  ixpk= 975, nxpk= 10, iat=1444,1440, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:976     88 THR  HN          2.80    (#    976:10  Single Ambig)
 &rst
  ixpk= 976, nxpk= 10, iat=  -1,1440, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1442,1406,
 &end
#
#   87 ASP  HA           88 THR  HN          3.50    (#    977:10  Unique         3.07, 3.10 A)
 &rst
  ixpk= 977, nxpk= 10, iat=1430,1440, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   89 LYS  HN           88 THR  HN          4.50    (#    979:10  Unique         4.20, 4.20 A)
 &rst
  ixpk= 979, nxpk= 10, iat=1454,1440, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   87 ASP  HN           88 THR  HN          2.80    (#    981:10  Unique         2.61, 2.74 A)
 &rst
  ixpk= 981, nxpk= 10, iat=1428,1440, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   88 THR  HN           89 LYS  HN          4.50    (#    984:10  Unique         4.20, 4.20 A)
 &rst
  ixpk= 984, nxpk= 10, iat=1440,1454, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   89 LYS  HA           89 LYS  HN          2.80    (#    986:10  Unique         2.71, 2.72 A)
 &rst
  ixpk= 986, nxpk= 10, iat=1456,1454, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   88 THR  HB           89 LYS  HN          4.10    (#    987:10  Unique         3.34, 3.35 A)
 &rst
  ixpk= 987, nxpk= 10, iat=1444,1454, r1= 0.00, r2= 1.80, r3= 4.10, r4= 4.85,  &end
#
#   90 PRO  HD+          89 LYS  HN          5.50    (#    988:10  Unique         4.59, 4.83 A)
 &rst
  ixpk= 988, nxpk= 10, iat=  -1,1454, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1477,1478,
 &end
#
#    0 AMB  10-2:989     89 LYS  HN          2.80    (#    989:10  Single Ambig)
 &rst
  ixpk= 989, nxpk= 10, iat=  -1,1454, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1458,1459,1458,1459,
 &end
#
#   89 LYS  HG+          89 LYS  HN          2.80    (#    990:10  Unique         3.17, 3.62 A)
 &rst
  ixpk= 990, nxpk= 10, iat=  -1,1454, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1461,1462,
 &end
#
#   88 THR  MG2          89 LYS  HN          3.10    (#    991:10  Unique         2.31, 3.03 A)
 &rst
  ixpk= 991, nxpk= 10, iat=  -1,1454, r1= 0.00, r2= 1.80, r3= 3.72, r4= 4.47,
 igr1=1446,1447,1448,
 &end
#
#   91 VAL  MGX          91 VAL  HN          3.50    (#    993:10  Unique         1.90, 3.68 A)
 &rst
  ixpk= 993, nxpk= 10, iat=  -1,1490, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  10-2:995     91 VAL  HN          5.50    (#    995:10  Single Ambig)
 &rst
  ixpk= 995, nxpk= 10, iat=  -1,1490, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=  34,  35,  36,1370,1371,1372,1374,1375,1376,
 &end
#
#   91 VAL  MGY          91 VAL  HN          2.80    (#    996:10  Unique         1.90, 3.68 A)
 &rst
  ixpk= 996, nxpk= 10, iat=  -1,1490, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   89 LYS  HG-          91 VAL  HN          5.50    (#    997:10  Unique         3.73, 4.32 A)
 &rst
  ixpk= 997, nxpk= 10, iat=  -1,1490, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1461,1462,
 &end
#
#   91 VAL  HB           91 VAL  HN          2.80    (#    999:10  Unique         2.69, 2.72 A)
 &rst
  ixpk= 999, nxpk= 10, iat=1494,1490, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1000    91 VAL  HN          4.20    (#   1000:10  Single Ambig)
 &rst
  ixpk= 1000, nxpk= 10, iat=  -1,1490, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1483,1484,1480,1481,1384,1385,
 &end
#
#   90 PRO  HB+          91 VAL  HN          4.20    (#   1002:10  Unique         4.12, 4.28 A)
 &rst
  ixpk= 1002, nxpk= 10, iat=  -1,1490, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1483,1484,
 &end
#
#    0 AMB  10-2:1003    91 VAL  HN          5.50    (#   1003:10  Single Ambig)
 &rst
  ixpk= 1003, nxpk= 10, iat=  -1,1490, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1408,1409,1477,1478,1366,
 &end
#
#   91 VAL  HA           91 VAL  HN          3.50    (#   1004:10  Unique         2.87, 2.88 A)
 &rst
  ixpk= 1004, nxpk= 10, iat=1492,1490, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 TRP  HA           91 VAL  HN          5.40    (#   1005:10  Unique         3.50, 3.83 A)
 &rst
  ixpk= 1005, nxpk= 10, iat=1406,1490, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,  &end
#
#    0 AMB  10-2:1006    91 VAL  HN          5.50    (#   1006:10  Single Ambig)
 &rst
  ixpk= 1006, nxpk= 10, iat=  -1,1490, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1456,1382,
 &end
#
#   90 PRO  HA           91 VAL  HN          2.80    (#   1007:10  Unique         2.28, 2.29 A)
 &rst
  ixpk= 1007, nxpk= 10, iat=1486,1490, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   93 ILE  HN           92 CYS  HN          5.50    (#   1008:10  Unique         4.50, 4.53 A)
 &rst
  ixpk= 1008, nxpk= 10, iat=1517,1506, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   91 VAL  HA           92 CYS  HN          2.80    (#   1011:10  Unique         2.28, 2.29 A)
 &rst
  ixpk= 1011, nxpk= 10, iat=1492,1506, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   92 CYS  HB-          92 CYS  HN          2.80    (#   1013:10  Unique         2.70, 3.23 A)
 &rst
  ixpk= 1013, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1510,1511,
 &end
#
#    0 AMB  10-2:1014    92 CYS  HN          5.50    (#   1014:10  Single Ambig)
 &rst
  ixpk= 1014, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1483,1484,1480,1481,1384,1385,
 &end
#
#    0 AMB  10-2:1015    92 CYS  HN          4.20    (#   1015:10  Single Ambig)
 &rst
  ixpk= 1015, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1494,  25,
 &end
#
#    2 ILE  HG1-         92 CYS  HN          5.50    (#   1016:10  Unique         4.11, 4.67 A)
 &rst
  ixpk= 1016, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  31,  32,
 &end
#
#   91 VAL  MGY          92 CYS  HN          3.50    (#   1017:10  Unique         1.92, 3.66 A)
 &rst
  ixpk= 1017, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#    0 AMB  10-2:1018    92 CYS  HN          3.50    (#   1018:10  Single Ambig)
 &rst
  ixpk= 1018, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=  34,  35,  36,1370,1371,1372,1374,1375,1376,
 &end
#
#   91 VAL  MGX          92 CYS  HN          3.50    (#   1019:10  Unique         1.92, 3.66 A)
 &rst
  ixpk= 1019, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   84 VAL  MGX          92 CYS  HN          4.20    (#   1020:10  Unique         4.06, 5.80 A)
 &rst
  ixpk= 1020, nxpk= 10, iat=  -1,1506, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   93 ILE  QD1          93 ILE  HN          3.50    (#   1022:10  Unique         1.84, 2.75 A)
 &rst
  ixpk= 1022, nxpk= 10, iat=  -1,1517, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1530,1531,1532,
 &end
#
#   93 ILE  HG1-         93 ILE  HN          3.50    (#   1023:10  Unique         2.30, 3.00 A)
 &rst
  ixpk= 1023, nxpk= 10, iat=  -1,1517, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1527,1528,
 &end
#
#   93 ILE  HB           93 ILE  HN          5.50    (#   1024:10  Unique         3.62, 3.64 A)
 &rst
  ixpk= 1024, nxpk= 10, iat=1521,1517, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   92 CYS  HB-          93 ILE  HN          4.20    (#   1025:10  Unique         2.93, 3.57 A)
 &rst
  ixpk= 1025, nxpk= 10, iat=  -1,1517, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1510,1511,
 &end
#
#    6 GLY  HA-          93 ILE  HN          5.50    (#   1026:10  Unique         3.03, 3.72 A)
 &rst
  ixpk= 1026, nxpk= 10, iat=  -1,1517, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  78,  79,
 &end
#
#   93 ILE  HA           93 ILE  HN          4.20    (#   1027:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 1027, nxpk= 10, iat=1519,1517, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    6 GLY  HA+          93 ILE  HN          4.20    (#   1028:10  Unique         3.03, 3.72 A)
 &rst
  ixpk= 1028, nxpk= 10, iat=  -1,1517, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=  78,  79,
 &end
#
#    7 TYR  HA           93 ILE  HN          5.50    (#   1029:10  Unique         3.65, 3.82 A)
 &rst
  ixpk= 1029, nxpk= 10, iat=  85,1517, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   94 GLY  HN           93 ILE  HN          3.50    (#   1031:10  Unique         2.61, 2.70 A)
 &rst
  ixpk= 1031, nxpk= 10, iat=1536,1517, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1032    93 ILE  HN          5.50    (#   1032:10  Single Ambig)
 &rst
  ixpk= 1032, nxpk= 10, iat=  -1,1517, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1506, 104,1490,
 &end
#
#   93 ILE  HN           94 GLY  HN          2.80    (#   1033:10  Unique         2.61, 2.70 A)
 &rst
  ixpk= 1033, nxpk= 10, iat=1517,1536, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   95 GLN  HN           94 GLY  HN          4.20    (#   1034:10  Unique         4.04, 4.12 A)
 &rst
  ixpk= 1034, nxpk= 10, iat=1543,1536, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1035    94 GLY  HN          5.50    (#   1035:10  Single Ambig)
 &rst
  ixpk= 1035, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 104,1506,
 &end
#
#   79 LEU  HN           94 GLY  HN          5.50    (#   1036:10  Unique         5.47, 5.52 A)
 &rst
  ixpk= 1036, nxpk= 10, iat=1266,1536, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    7 TYR  HD           94 GLY  HN          5.50    (#   1037:10  Unique         4.76, 5.17 A)
 &rst
  ixpk= 1037, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  91, 100,
 &end
#
#    7 TYR  HA           94 GLY  HN          4.20    (#   1040:10  Unique         3.26, 3.48 A)
 &rst
  ixpk= 1040, nxpk= 10, iat=  85,1536, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   94 GLY  HA+          94 GLY  HN          3.50    (#   1041:10  Unique         2.61, 2.79 A)
 &rst
  ixpk= 1041, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1538,1539,
 &end
#
#   94 GLY  HA-          94 GLY  HN          4.20    (#   1042:10  Unique         2.61, 2.79 A)
 &rst
  ixpk= 1042, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1538,1539,
 &end
#
#    6 GLY  HA-          94 GLY  HN          5.50    (#   1043:10  Unique         5.53, 5.88 A)
 &rst
  ixpk= 1043, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  78,  79,
 &end
#
#   93 ILE  HB           94 GLY  HN          5.50    (#   1044:10  Unique         4.29, 4.38 A)
 &rst
  ixpk= 1044, nxpk= 10, iat=1521,1536, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   93 ILE  HG1-         94 GLY  HN          3.50    (#   1045:10  Unique         2.99, 4.08 A)
 &rst
  ixpk= 1045, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1527,1528,
 &end
#
#    0 AMB  10-2:1046    94 GLY  HN          2.80    (#   1046:10  Single Ambig)
 &rst
  ixpk= 1046, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 3.66, r4= 4.41,
 igr1=1527,1528,1530,1531,1532,
 &end
#
#   91 VAL  MGX          94 GLY  HN          5.50    (#   1047:10  Unique         5.14, 6.80 A)
 &rst
  ixpk= 1047, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1496,1497,1498,1500,1501,1502,
 &end
#
#   79 LEU  HG           94 GLY  HN          5.50    (#   1049:10  Unique         5.07, 5.42 A)
 &rst
  ixpk= 1049, nxpk= 10, iat=1273,1536, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1050    94 GLY  HN          5.50    (#   1050:10  Single Ambig)
 &rst
  ixpk= 1050, nxpk= 10, iat=  -1,1536, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1=1251,1252,1203,1204,1368,1306,1307,
 &end
#
#    0 AMB  10-2:1051    47 GLU  HN          5.50    (#   1051:10  Single Ambig)
 &rst
  ixpk= 1051, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 773, 782,1653,1661,
 &end
#
#    0 AMB  10-2:1052    47 GLU  HN          4.20    (#   1052:10  Single Ambig)
 &rst
  ixpk= 1052, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 733, 734,1655,1659,
 &end
#
#    7 TYR  HD           95 GLN  HN          5.50    (#   1053:10  Unique         3.65, 5.79 A)
 &rst
  ixpk= 1053, nxpk= 10, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  91, 100,
 &end
#
#   46 ALA  HA           47 GLU  HN          3.50    (#   1055:10  Unique         3.55, 3.55 A)
 &rst
  ixpk= 1055, nxpk= 10, iat= 698, 706, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1056    95 GLN  HN          5.50    (#   1056:10  Single Ambig)
 &rst
  ixpk= 1056, nxpk= 10, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1547,1548,1251,1252,
 &end
#
#    0 AMB  10-2:1057     0 AMB  10-1:1057   5.50    (#   1057:10  Double Ambig)
 &rst
  ixpk= 1057, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.06, r4= 9.81,
 igr1=1275,1276,1277,1279,1280,1281,1567,1568, 626, 627,
      
 igr2=1543, 706,
 &end
#
#   95 GLN  HB+          96 LYS  HN          4.20    (#   1058:10  Unique         2.50, 3.43 A)
 &rst
  ixpk= 1058, nxpk= 10, iat=  -1,1560, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1547,1548,
 &end
#
#   95 GLN  HG-          96 LYS  HN          5.50    (#   1059:10  Unique         2.31, 3.84 A)
 &rst
  ixpk= 1059, nxpk= 10, iat=  -1,1560, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1550,1551,
 &end
#
#   96 LYS  HD+          96 LYS  HN          4.20    (#   1060:10  Unique         1.97, 4.53 A)
 &rst
  ixpk= 1060, nxpk= 10, iat=  -1,1560, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1570,1571,
 &end
#
#   95 GLN  HA           96 LYS  HN          3.50    (#   1061:10  Unique         2.23, 2.31 A)
 &rst
  ixpk= 1061, nxpk= 10, iat=1545,1560, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   96 LYS  HA           96 LYS  HN          5.50    (#   1062:10  Unique         2.95, 2.95 A)
 &rst
  ixpk= 1062, nxpk= 10, iat=1562,1560, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   10 ASN  HN           96 LYS  HN          5.50    (#   1063:10  Unique         2.99, 3.49 A)
 &rst
  ixpk= 1063, nxpk= 10, iat= 142,1560, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   76 ARG  HG-          97 GLN  HN          5.50    (#   1064:10  Unique         2.49, 4.04 A)
 &rst
  ixpk= 1064, nxpk= 10, iat=  -1,1582, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1206,1207,
 &end
#
#   96 LYS  HB-          97 GLN  HN          5.50    (#   1065:10  Unique         2.76, 3.48 A)
 &rst
  ixpk= 1065, nxpk= 10, iat=  -1,1582, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1564,1565,
 &end
#
#    0 AMB  10-2:1067    97 GLN  HN          5.50    (#   1067:10  Single Ambig)
 &rst
  ixpk= 1067, nxpk= 10, iat=  -1,1582, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1203,1204,1564,1565,
 &end
#
#   97 GLN  HB-          97 GLN  HN          4.20    (#   1068:10  Unique         2.33, 2.97 A)
 &rst
  ixpk= 1068, nxpk= 10, iat=  -1,1582, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1586,1587,
 &end
#
#   97 GLN  HG+          97 GLN  HN          5.50    (#   1069:10  Unique         3.01, 4.25 A)
 &rst
  ixpk= 1069, nxpk= 10, iat=  -1,1582, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1589,1590,
 &end
#
#    0 AMB  10-2:1070    97 GLN  HN          4.20    (#   1070:10  Single Ambig)
 &rst
  ixpk= 1070, nxpk= 10, iat=  -1,1582, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1586,1587,1589,1590,1209,1210,
 &end
#
#   76 ARG  HA           97 GLN  HN          5.50    (#   1071:10  Unique         2.47, 3.92 A)
 &rst
  ixpk= 1071, nxpk= 10, iat=1201,1582, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   96 LYS  HA           97 GLN  HN          4.20    (#   1072:10  Unique         2.16, 2.22 A)
 &rst
  ixpk= 1072, nxpk= 10, iat=1562,1582, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   97 GLN  HA           97 GLN  HN          5.50    (#   1073:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 1073, nxpk= 10, iat=1584,1582, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   98 LYS  HN           97 GLN  HN          5.50    (#   1074:10  Unique         4.26, 4.34 A)
 &rst
  ixpk= 1074, nxpk= 10, iat=1599,1582, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   75 LEU  HN           97 GLN  HN          5.50    (#   1075:10  Unique         4.05, 4.70 A)
 &rst
  ixpk= 1075, nxpk= 10, iat=1180,1582, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1076    97 GLN  HN          5.50    (#   1076:10  Single Ambig)
 &rst
  ixpk= 1076, nxpk= 10, iat=  -1,1582, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1199,1223,
 &end
#
#   97 GLN  HN           98 LYS  HN          5.50    (#   1077:10  Unique         4.26, 4.34 A)
 &rst
  ixpk= 1077, nxpk= 10, iat=1582,1599, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   10 ASN  HN           98 LYS  HN          5.50    (#   1078:10  Unique         3.79, 4.08 A)
 &rst
  ixpk= 1078, nxpk= 10, iat= 142,1599, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   97 GLN  HE2+         98 LYS  HN          5.50    (#   1079:10  Unique         5.81, 6.68 A)
 &rst
  ixpk= 1079, nxpk= 10, iat=  -1,1599, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1594,1595,
 &end
#
#   97 GLN  HA           98 LYS  HN          3.50    (#   1080:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1080, nxpk= 10, iat=1584,1599, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   11 VAL  HA           98 LYS  HN          5.50    (#   1081:10  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1081, nxpk= 10, iat= 158,1599, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1082    98 LYS  HN          5.50    (#   1082:10  Single Ambig)
 &rst
  ixpk= 1082, nxpk= 10, iat=  -1,1599, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1601, 174, 175,
 &end
#
#   11 VAL  HB           98 LYS  HN          5.50    (#   1083:10  Unique         4.89, 5.21 A)
 &rst
  ixpk= 1083, nxpk= 10, iat= 160,1599, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1084    98 LYS  HN          5.50    (#   1084:10  Single Ambig)
 &rst
  ixpk= 1084, nxpk= 10, iat=  -1,1599, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1586,1587,1589,1590,
 &end
#
#   98 LYS  HB+          98 LYS  HN          4.20    (#   1085:10  Unique         2.33, 2.87 A)
 &rst
  ixpk= 1085, nxpk= 10, iat=  -1,1599, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1603,1604,
 &end
#
#   11 VAL  MGY          98 LYS  HN          5.50    (#   1086:10  Unique         3.46, 5.34 A)
 &rst
  ixpk= 1086, nxpk= 10, iat=  -1,1599, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGX          98 LYS  HN          5.50    (#   1087:10  Unique         3.46, 5.34 A)
 &rst
  ixpk= 1087, nxpk= 10, iat=  -1,1599, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HB-          98 LYS  HN          5.50    (#   1088:10  Unique         2.33, 2.87 A)
 &rst
  ixpk= 1088, nxpk= 10, iat=  -1,1599, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1603,1604,
 &end
#
#   98 LYS  HB-          99 TRP  HN          5.50    (#   1089:10  Unique         3.25, 4.14 A)
 &rst
  ixpk= 1089, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1603,1604,
 &end
#
#   98 LYS  HG-          99 TRP  HN          4.20    (#   1090:10  Unique         2.60, 4.10 A)
 &rst
  ixpk= 1090, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1606,1607,
 &end
#
#   71 THR  MG2          99 TRP  HN          3.50    (#   1091:10  Unique         3.22, 4.61 A)
 &rst
  ixpk= 1091, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1110,1111,1112,
 &end
#
#    0 AMB  10-2:1092    99 TRP  HN          5.50    (#   1092:10  Single Ambig)
 &rst
  ixpk= 1092, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1189,1190,1191,1193,1194,1195, 162, 163, 164, 166,
       167, 168,
 &end
#
#   98 LYS  HE-          99 TRP  HN          5.50    (#   1093:10  Unique         2.19, 4.32 A)
 &rst
  ixpk= 1093, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1612,1613,
 &end
#
#   99 TRP  HB-          99 TRP  HN          4.20    (#   1094:10  Unique         2.59, 3.21 A)
 &rst
  ixpk= 1094, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1625,1626,
 &end
#
#   99 TRP  HB+          99 TRP  HN          4.20    (#   1095:10  Unique         2.59, 3.21 A)
 &rst
  ixpk= 1095, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1625,1626,
 &end
#
#   98 LYS  HA           99 TRP  HN          2.80    (#   1096:10  Unique         2.14, 2.14 A)
 &rst
  ixpk= 1096, nxpk= 10, iat=1601,1621, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   71 THR  HB           99 TRP  HN          5.50    (#   1097:10  Unique         4.83, 5.19 A)
 &rst
  ixpk= 1097, nxpk= 10, iat=1108,1621, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HA           99 TRP  HN          5.50    (#   1099:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 1099, nxpk= 10, iat=1623,1621, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HD1          99 TRP  HN          4.20    (#   1100:10  Unique         2.64, 3.25 A)
 &rst
  ixpk= 1100, nxpk= 10, iat=1629,1621, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1101    99 TRP  HN          4.20    (#   1101:10  Single Ambig)
 &rst
  ixpk= 1101, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1104,1645,
 &end
#
#    0 AMB  10-2:1103    99 TRP  HN          5.50    (#   1103:10  Single Ambig)
 &rst
  ixpk= 1103, nxpk= 10, iat=  -1,1621, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1631,1582,
 &end
#
#   77 TYR  HA           77 TYR  HN          5.50    (#   1104:10  Unique         2.89, 2.94 A)
 &rst
  ixpk= 1104, nxpk= 10, iat=1225,1223, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  100 PHE  HD          100 PHE  HN          2.80    (#   1105:10  Unique         3.10, 4.55 A)
 &rst
  ixpk= 1105, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1653,1661,
 &end
#
#   99 TRP  HE3         100 PHE  HN          5.50    (#   1106:10  Unique         3.42, 3.74 A)
 &rst
  ixpk= 1106, nxpk= 10, iat=1640,1645, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1107   100 PHE  HN          4.20    (#   1107:10  Single Ambig)
 &rst
  ixpk= 1107, nxpk= 10, iat=  -1,1645, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 172,1621,
 &end
#
#  101 LEU  HN          100 PHE  HN          5.50    (#   1108:10  Unique         4.20, 4.33 A)
 &rst
  ixpk= 1108, nxpk= 10, iat=1665,1645, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   14 VAL  HN          100 PHE  HN          5.50    (#   1109:10  Unique         3.65, 3.75 A)
 &rst
  ixpk= 1109, nxpk= 10, iat= 198,1645, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  HB-         101 LEU  HN          4.20    (#   1111:10  Unique         2.30, 2.77 A)
 &rst
  ixpk= 1111, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1669,1670,
 &end
#
#    0 AMB  10-2:1112   101 LEU  HN          4.20    (#   1112:10  Single Ambig)
 &rst
  ixpk= 1112, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1674,1675,1676,1678,1679,1680,1606,1607,
 &end
#
#  101 LEU  HB+         101 LEU  HN          2.80    (#   1113:10  Unique         2.30, 2.77 A)
 &rst
  ixpk= 1113, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1669,1670,
 &end
#
#    0 AMB  10-2:1114   101 LEU  HN          4.20    (#   1114:10  Single Ambig)
 &rst
  ixpk= 1114, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1674,1675,1676,1678,1679,1680, 759, 760, 761,
 &end
#
#    0 AMB  10-2:1115   101 LEU  HN          4.20    (#   1115:10  Single Ambig)
 &rst
  ixpk= 1115, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.49, r4= 6.24,
 igr1=1087,1088,1089,1068,1069,
 &end
#
#  100 PHE  HB+         101 LEU  HN          4.20    (#   1117:10  Unique         3.04, 3.74 A)
 &rst
  ixpk= 1117, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1649,1650,
 &end
#
#   70 SER  HB+         101 LEU  HN          5.50    (#   1118:10  Unique         3.52, 4.32 A)
 &rst
  ixpk= 1118, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1097,1098,
 &end
#
#  101 LEU  HA          101 LEU  HN          4.20    (#   1120:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 1120, nxpk= 10, iat=1667,1665, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   70 SER  HA          101 LEU  HN          3.50    (#   1121:10  Unique         2.87, 3.04 A)
 &rst
  ixpk= 1121, nxpk= 10, iat=1095,1665, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  151 PHE  HD          101 LEU  HN          4.20    (#   1122:10  Unique         4.06, 5.14 A)
 &rst
  ixpk= 1122, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2515,2523,
 &end
#
#   69 ALA  HN          101 LEU  HN          4.20    (#   1124:10  Unique         3.31, 3.51 A)
 &rst
  ixpk= 1124, nxpk= 10, iat=1083,1665, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   70 SER  HN          101 LEU  HN          5.50    (#   1125:10  Unique         4.71, 4.87 A)
 &rst
  ixpk= 1125, nxpk= 10, iat=1093,1665, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1126   101 LEU  HN          4.20    (#   1126:10  Single Ambig)
 &rst
  ixpk= 1126, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1645,1104,
 &end
#
#  102 LEU  HN          101 LEU  HN          5.50    (#   1127:10  Unique         4.15, 4.26 A)
 &rst
  ixpk= 1127, nxpk= 10, iat=1684,1665, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   14 VAL  HN          101 LEU  HN          5.50    (#   1128:10  Unique         5.16, 5.48 A)
 &rst
  ixpk= 1128, nxpk= 10, iat= 198,1665, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  102 LEU  HA          102 LEU  HN          5.50    (#   1131:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 1131, nxpk= 10, iat=1686,1684, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  HA          102 LEU  HN          2.80    (#   1132:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1132, nxpk= 10, iat=1667,1684, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   15 ILE  HA          102 LEU  HN          4.20    (#   1133:10  Unique         2.76, 2.92 A)
 &rst
  ixpk= 1133, nxpk= 10, iat= 216,1684, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  101 LEU  HB-         102 LEU  HN          5.50    (#   1134:10  Unique         3.99, 4.34 A)
 &rst
  ixpk= 1134, nxpk= 10, iat=  -1,1684, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1669,1670,
 &end
#
#    0 AMB  10-2:1135   102 LEU  HN          2.80    (#   1135:10  Single Ambig)
 &rst
  ixpk= 1135, nxpk= 10, iat=  -1,1684, r1= 0.00, r2= 1.80, r3= 4.40, r4= 5.15,
 igr1=1693,1694,1695,1697,1698,1699, 227, 228, 229,1073,
      1074,1075,1077,1078,1079,
 &end
#
#    0 AMB  10-2:1136   102 LEU  HN          4.20    (#   1136:10  Single Ambig)
 &rst
  ixpk= 1136, nxpk= 10, iat=  -1,1684, r1= 0.00, r2= 1.80, r3= 6.52, r4= 7.27,
 igr1=1669,1670,1073,1074,1075,1077,1078,1079,2554,2555,
      2556,2558,2559,2560,
 &end
#
#  101 LEU  MDX         102 LEU  HN          2.80    (#   1137:10  Unique         1.94, 4.25 A)
 &rst
  ixpk= 1137, nxpk= 10, iat=  -1,1684, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#  102 LEU  HB-         102 LEU  HN          5.50    (#   1138:10  Unique         2.40, 3.51 A)
 &rst
  ixpk= 1138, nxpk= 10, iat=  -1,1684, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1688,1689,
 &end
#
#  102 LEU  HB+         102 LEU  HN          4.20    (#   1139:10  Unique         2.40, 3.51 A)
 &rst
  ixpk= 1139, nxpk= 10, iat=  -1,1684, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1688,1689,
 &end
#
#   14 VAL  HB          102 LEU  HN          5.50    (#   1140:10  Unique         3.00, 3.84 A)
 &rst
  ixpk= 1140, nxpk= 10, iat= 202,1684, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   66 ARG  HN          103 GLN  HN          4.20    (#   1141:10  Unique         2.75, 3.31 A)
 &rst
  ixpk= 1141, nxpk= 10, iat=1021,1703, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   65 VAL  HA          103 GLN  HN          5.50    (#   1142:10  Unique         4.35, 5.03 A)
 &rst
  ixpk= 1142, nxpk= 10, iat=1007,1703, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  102 LEU  HA          103 GLN  HN          3.50    (#   1143:10  Unique         2.14, 2.24 A)
 &rst
  ixpk= 1143, nxpk= 10, iat=1686,1703, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  103 GLN  HA          103 GLN  HN          4.20    (#   1144:10  Unique         2.85, 2.90 A)
 &rst
  ixpk= 1144, nxpk= 10, iat=1705,1703, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   66 ARG  HA          103 GLN  HN          5.50    (#   1145:10  Unique         4.92, 5.25 A)
 &rst
  ixpk= 1145, nxpk= 10, iat=1023,1703, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1146   103 GLN  HN          5.50    (#   1146:10  Single Ambig)
 &rst
  ixpk= 1146, nxpk= 10, iat=  -1,1703, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1066,1741,
 &end
#
#   67 ILE  HA          103 GLN  HN          5.50    (#   1147:10  Unique         3.71, 4.06 A)
 &rst
  ixpk= 1147, nxpk= 10, iat=1047,1703, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  103 GLN  HG+         103 GLN  HN          4.20    (#   1148:10  Unique         3.64, 4.22 A)
 &rst
  ixpk= 1148, nxpk= 10, iat=  -1,1703, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1710,1711,
 &end
#
#  103 GLN  HB+         103 GLN  HN          3.50    (#   1149:10  Unique         2.09, 2.73 A)
 &rst
  ixpk= 1149, nxpk= 10, iat=  -1,1703, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1707,1708,
 &end
#
#  103 GLN  HB-         103 GLN  HN          2.80    (#   1150:10  Unique         2.09, 2.73 A)
 &rst
  ixpk= 1150, nxpk= 10, iat=  -1,1703, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1707,1708,
 &end
#
#   66 ARG  HG+         103 GLN  HN          3.50    (#   1151:10  Unique         2.76, 3.97 A)
 &rst
  ixpk= 1151, nxpk= 10, iat=  -1,1703, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1028,1029,
 &end
#
#  102 LEU  HB-         103 GLN  HN          5.50    (#   1152:10  Unique         2.54, 3.39 A)
 &rst
  ixpk= 1152, nxpk= 10, iat=  -1,1703, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1688,1689,
 &end
#
#    0 AMB  10-2:1153   103 GLN  HN          2.80    (#   1153:10  Single Ambig)
 &rst
  ixpk= 1153, nxpk= 10, iat=  -1,1703, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=1073,1074,1075,1077,1078,1079,1693,1694,1695,1697,
      1698,1699,
 &end
#
#    0 AMB  10-2:1154   104 LEU  HN          3.50    (#   1154:10  Single Ambig)
 &rst
  ixpk= 1154, nxpk= 10, iat=  -1,1720, r1= 0.00, r2= 1.80, r3= 5.90, r4= 6.65,
 igr1= 227, 228, 229,1745,1746,1747,1749,1750,1751,1073,
      1074,1075,1077,1078,1079, 224, 225,1693,1694,1695,
      1697,1698,1699,
 &end
#
#    0 AMB  10-2:1155   104 LEU  HN          2.80    (#   1155:10  Single Ambig)
 &rst
  ixpk= 1155, nxpk= 10, iat=  -1,1720, r1= 0.00, r2= 1.80, r3= 4.04, r4= 4.79,
 igr1= 220, 221, 222,1011,1012,1013,1015,1016,1017,
 &end
#
#  104 LEU  MDY         104 LEU  HN          3.50    (#   1156:10  Unique         3.59, 4.96 A)
 &rst
  ixpk= 1156, nxpk= 10, iat=  -1,1720, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1729,1730,1731,1733,1734,1735,
 &end
#
#  104 LEU  HB-         104 LEU  HN          4.20    (#   1157:10  Unique         2.11, 2.55 A)
 &rst
  ixpk= 1157, nxpk= 10, iat=  -1,1720, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1724,1725,
 &end
#
#    0 AMB  10-2:1158   104 LEU  HN          5.50    (#   1158:10  Single Ambig)
 &rst
  ixpk= 1158, nxpk= 10, iat=  -1,1720, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 248, 249,1691, 924,
 &end
#
#  103 GLN  HB-         104 LEU  HN          4.20    (#   1159:10  Unique         3.38, 4.01 A)
 &rst
  ixpk= 1159, nxpk= 10, iat=  -1,1720, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1707,1708,
 &end
#
#    0 AMB  10-2:1160   104 LEU  HN          2.80    (#   1160:10  Single Ambig)
 &rst
  ixpk= 1160, nxpk= 10, iat=  -1,1720, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1724,1725,1710,1711,
 &end
#
#  104 LEU  HA          104 LEU  HN          4.20    (#   1161:10  Unique         2.80, 2.85 A)
 &rst
  ixpk= 1161, nxpk= 10, iat=1722,1720, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  103 GLN  HA          104 LEU  HN          2.80    (#   1162:10  Unique         2.14, 2.21 A)
 &rst
  ixpk= 1162, nxpk= 10, iat=1705,1720, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   17 ASN  HA          104 LEU  HN          5.50    (#   1163:10  Unique         3.13, 3.72 A)
 &rst
  ixpk= 1163, nxpk= 10, iat= 246,1720, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  103 GLN  HE2-        104 LEU  HN          5.50    (#   1164:10  Unique         3.77, 4.91 A)
 &rst
  ixpk= 1164, nxpk= 10, iat=  -1,1720, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1715,1716,
 &end
#
#  103 GLN  HN          104 LEU  HN          5.50    (#   1165:10  Unique         4.31, 4.52 A)
 &rst
  ixpk= 1165, nxpk= 10, iat=1703,1720, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1166   105 VAL  HN          5.50    (#   1166:10  Single Ambig)
 &rst
  ixpk= 1166, nxpk= 10, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1021,1766,
 &end
#
#  106 SER  HN          105 VAL  HN          4.20    (#   1167:10  Unique         1.95, 2.36 A)
 &rst
  ixpk= 1167, nxpk= 10, iat=1755,1739, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   65 VAL  HA          105 VAL  HN          4.20    (#   1168:10  Unique         2.38, 2.75 A)
 &rst
  ixpk= 1168, nxpk= 10, iat=1007,1739, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  104 LEU  HA          105 VAL  HN          3.50    (#   1169:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1169, nxpk= 10, iat=1722,1739, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  105 VAL  HA          105 VAL  HN          4.20    (#   1170:10  Unique         2.86, 2.91 A)
 &rst
  ixpk= 1170, nxpk= 10, iat=1741,1739, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1171   105 VAL  HN          4.20    (#   1171:10  Single Ambig)
 &rst
  ixpk= 1171, nxpk= 10, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1743,1724,1725,
 &end
#
#    0 AMB  10-2:1172   105 VAL  HN          5.50    (#   1172:10  Single Ambig)
 &rst
  ixpk= 1172, nxpk= 10, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1724,1725, 350, 351, 352,
 &end
#
#  104 LEU  MDX         105 VAL  HN          3.50    (#   1173:10  Unique         2.07, 4.71 A)
 &rst
  ixpk= 1173, nxpk= 10, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1729,1730,1731,1733,1734,1735,
 &end
#
#  105 VAL  MGY         105 VAL  HN          2.80    (#   1174:10  Unique         1.95, 3.67 A)
 &rst
  ixpk= 1174, nxpk= 10, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#  105 VAL  MGX         105 VAL  HN          2.80    (#   1175:10  Unique         1.95, 3.67 A)
 &rst
  ixpk= 1175, nxpk= 10, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#    0 AMB  10-2:1176   106 SER  HN          5.50    (#   1176:10  Single Ambig)
 &rst
  ixpk= 1176, nxpk= 10, iat=  -1,1755, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#  105 VAL  MGX         106 SER  HN          3.50    (#   1177:10  Unique         1.97, 4.04 A)
 &rst
  ixpk= 1177, nxpk= 10, iat=  -1,1755, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#  104 LEU  MDX         106 SER  HN          2.80    (#   1178:10  Unique         3.27, 5.07 A)
 &rst
  ixpk= 1178, nxpk= 10, iat=  -1,1755, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  10-2:1179   106 SER  HN          5.50    (#   1179:10  Single Ambig)
 &rst
  ixpk= 1179, nxpk= 10, iat=  -1,1755, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1724,1725, 978, 979,
 &end
#
#  105 VAL  HB          106 SER  HN          3.50    (#   1181:10  Unique         1.95, 3.07 A)
 &rst
  ixpk= 1181, nxpk= 10, iat=1743,1755, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  106 SER  HB-         106 SER  HN          4.20    (#   1182:10  Unique         2.08, 2.72 A)
 &rst
  ixpk= 1182, nxpk= 10, iat=  -1,1755, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1759,1760,
 &end
#
#  106 SER  HB+         106 SER  HN          4.20    (#   1183:10  Unique         2.08, 2.72 A)
 &rst
  ixpk= 1183, nxpk= 10, iat=  -1,1755, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1759,1760,
 &end
#
#  105 VAL  HA          106 SER  HN          4.20    (#   1184:10  Unique         3.45, 3.53 A)
 &rst
  ixpk= 1184, nxpk= 10, iat=1741,1755, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  107 GLY  HN          106 SER  HN          5.50    (#   1187:10  Unique         2.68, 2.93 A)
 &rst
  ixpk= 1187, nxpk= 10, iat=1766,1755, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  105 VAL  HN          106 SER  HN          3.50    (#   1188:10  Unique         1.95, 2.36 A)
 &rst
  ixpk= 1188, nxpk= 10, iat=1739,1755, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  109 ALA  HN          107 GLY  HN          5.50    (#   1189:10  Unique         4.36, 4.80 A)
 &rst
  ixpk= 1189, nxpk= 10, iat=1785,1766, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  110 GLU  HN          107 GLY  HN          5.50    (#   1191:10  Unique         3.67, 4.10 A)
 &rst
  ixpk= 1191, nxpk= 10, iat=1795,1766, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  106 SER  HN          107 GLY  HN          5.50    (#   1192:10  Unique         2.68, 2.93 A)
 &rst
  ixpk= 1192, nxpk= 10, iat=1755,1766, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1195   107 GLY  HN          2.80    (#   1195:10  Single Ambig)
 &rst
  ixpk= 1195, nxpk= 10, iat=  -1,1766, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1759,1760,1768,1769,
 &end
#
#  106 SER  HB-         107 GLY  HN          3.50    (#   1196:10  Unique         1.94, 2.54 A)
 &rst
  ixpk= 1196, nxpk= 10, iat=  -1,1766, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1759,1760,
 &end
#
#  107 GLY  HA+         107 GLY  HN          2.80    (#   1197:10  Unique         2.61, 2.79 A)
 &rst
  ixpk= 1197, nxpk= 10, iat=  -1,1766, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1768,1769,
 &end
#
#  110 GLU  HG-         107 GLY  HN          5.50    (#   1200:10  Unique         2.58, 3.81 A)
 &rst
  ixpk= 1200, nxpk= 10, iat=  -1,1766, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1802,1803,
 &end
#
#  110 GLU  HB-         107 GLY  HN          4.20    (#   1201:10  Unique         2.66, 4.21 A)
 &rst
  ixpk= 1201, nxpk= 10, iat=  -1,1766, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1799,1800,
 &end
#
#  104 LEU  MDX         107 GLY  HN          5.50    (#   1202:10  Unique         2.81, 4.02 A)
 &rst
  ixpk= 1202, nxpk= 10, iat=  -1,1766, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1729,1730,1731,1733,1734,1735,
 &end
#
#  104 LEU  MDY         108 ASP  HN          4.20    (#   1203:10  Unique         2.66, 5.14 A)
 &rst
  ixpk= 1203, nxpk= 10, iat=  -1,1773, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1729,1730,1731,1733,1734,1735,
 &end
#
#    0 AMB  10-2:1204   108 ASP  HN          4.20    (#   1204:10  Single Ambig)
 &rst
  ixpk= 1204, nxpk= 10, iat=  -1,1773, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1789,1790,1791, 924, 248, 249,
 &end
#
#  111 ILE  QD1         108 ASP  HN          5.50    (#   1205:10  Unique         4.44, 5.56 A)
 &rst
  ixpk= 1205, nxpk= 10, iat=  -1,1773, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1823,1824,1825,
 &end
#
#    0 AMB  10-2:1207   108 ASP  HN          5.50    (#   1207:10  Single Ambig)
 &rst
  ixpk= 1207, nxpk= 10, iat=  -1,1773, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1724,1725, 350, 351, 352,
 &end
#
#  108 ASP  HB+         108 ASP  HN          2.80    (#   1208:10  Unique         2.24, 2.95 A)
 &rst
  ixpk= 1208, nxpk= 10, iat=  -1,1773, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1777,1778,
 &end
#
#  108 ASP  HA          108 ASP  HN          2.80    (#   1209:10  Unique         2.76, 2.83 A)
 &rst
  ixpk= 1209, nxpk= 10, iat=1775,1773, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  107 GLY  HA+         108 ASP  HN          2.80    (#   1210:10  Unique         2.35, 2.56 A)
 &rst
  ixpk= 1210, nxpk= 10, iat=  -1,1773, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1768,1769,
 &end
#
#  107 GLY  HA-         108 ASP  HN          2.80    (#   1211:10  Unique         2.35, 2.56 A)
 &rst
  ixpk= 1211, nxpk= 10, iat=  -1,1773, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1768,1769,
 &end
#
#  110 GLU  HN          108 ASP  HN          5.50    (#   1213:10  Unique         4.12, 4.30 A)
 &rst
  ixpk= 1213, nxpk= 10, iat=1795,1773, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  109 ALA  HN          108 ASP  HN          2.80    (#   1214:10  Unique         2.40, 2.58 A)
 &rst
  ixpk= 1214, nxpk= 10, iat=1785,1773, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  108 ASP  HN          109 ALA  HN          3.50    (#   1216:10  Unique         2.40, 2.58 A)
 &rst
  ixpk= 1216, nxpk= 10, iat=1773,1785, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  110 GLU  HN          109 ALA  HN          3.50    (#   1217:10  Unique         2.58, 2.68 A)
 &rst
  ixpk= 1217, nxpk= 10, iat=1795,1785, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 ILE  HN          109 ALA  HN          5.50    (#   1218:10  Unique         4.10, 4.15 A)
 &rst
  ixpk= 1218, nxpk= 10, iat=1810,1785, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1219   109 ALA  HN          2.80    (#   1219:10  Single Ambig)
 &rst
  ixpk= 1219, nxpk= 10, iat=  -1,1785, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1787,1775,
 &end
#
#  107 GLY  HA-         109 ALA  HN          4.20    (#   1220:10  Unique         2.98, 3.64 A)
 &rst
  ixpk= 1220, nxpk= 10, iat=  -1,1785, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1768,1769,
 &end
#
#  108 ASP  HB+         109 ALA  HN          3.50    (#   1221:10  Unique         3.57, 4.07 A)
 &rst
  ixpk= 1221, nxpk= 10, iat=  -1,1785, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1777,1778,
 &end
#
#  109 ALA  MB          109 ALA  HN          2.80    (#   1222:10  Unique         2.07, 2.88 A)
 &rst
  ixpk= 1222, nxpk= 10, iat=  -1,1785, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=1789,1790,1791,
 &end
#
#    0 AMB  10-2:1223     0 AMB  10-1:1223   5.50    (#   1223:10  Double Ambig)
 &rst
  ixpk= 1223, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2443,2444,2445,2447,2448,2449,1823,1824,1825,
 igr2=2507,1795,
 &end
#
#    0 AMB  10-2:1224     0 AMB  10-1:1224   4.20    (#   1224:10  Double Ambig)
 &rst
  ixpk= 1224, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.63, r4= 8.38,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,1674,1675,1676,1678,1679,1680,
 igr2=1795,2507,
 &end
#
#    0 AMB  10-2:1225     0 AMB  10-1:1225   5.50    (#   1225:10  Double Ambig)
 &rst
  ixpk= 1225, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.17, r4=10.92,
 igr1=1729,1730,1731,1733,1734,1735,2554,2555,2556,2558,
      2559,2560,1669,1670,2570,2571,2572,2574,2575,2576,
      
 igr2=1795,2507,
 &end
#
#    0 AMB  10-2:1226   110 GLU  HN          5.50    (#   1226:10  Single Ambig)
 &rst
  ixpk= 1226, nxpk= 10, iat=  -1,1795, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1= 350, 351, 352,1724,1725, 978, 979,
 &end
#
#    0 AMB  10-2:1227   110 GLU  HN          3.50    (#   1227:10  Single Ambig)
 &rst
  ixpk= 1227, nxpk= 10, iat=  -1,1795, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1789,1790,1791, 924,
 &end
#
#    0 AMB  10-2:1228   151 PHE  HN          2.80    (#   1228:10  Single Ambig)
 &rst
  ixpk= 1228, nxpk= 10, iat=  -1,2507, r1= 0.00, r2= 1.80, r3= 3.66, r4= 4.41,
 igr1=2496,2497,2531,2532,2533,
 &end
#
#  110 GLU  HB-         110 GLU  HN          2.80    (#   1229:10  Unique         2.10, 2.93 A)
 &rst
  ixpk= 1229, nxpk= 10, iat=  -1,1795, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1799,1800,
 &end
#
#    0 AMB  10-2:1230     0 AMB  10-1:1230   2.80    (#   1230:10  Double Ambig)
 &rst
  ixpk= 1230, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.96, r4= 4.71,
 igr1=1799,1800,2499,2500,
 igr2=1795,2507,
 &end
#
#  110 GLU  HG-         110 GLU  HN          3.50    (#   1231:10  Unique         1.97, 3.36 A)
 &rst
  ixpk= 1231, nxpk= 10, iat=  -1,1795, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1802,1803,
 &end
#
#  151 PHE  HB-         151 PHE  HN          3.50    (#   1233:10  Unique         2.43, 3.05 A)
 &rst
  ixpk= 1233, nxpk= 10, iat=  -1,2507, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2511,2512,
 &end
#
#  151 PHE  HB+         151 PHE  HN          4.20    (#   1234:10  Unique         2.43, 3.05 A)
 &rst
  ixpk= 1234, nxpk= 10, iat=  -1,2507, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2511,2512,
 &end
#
#    0 AMB  10-2:1235     0 AMB  10-1:1235   3.50    (#   1235:10  Double Ambig)
 &rst
  ixpk= 1235, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2494,1759,1760,1768,1769,
 igr2=2507,1795,
 &end
#
#  109 ALA  HA          110 GLU  HN          3.50    (#   1236:10  Unique         3.33, 3.44 A)
 &rst
  ixpk= 1236, nxpk= 10, iat=1787,1795, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  151 PHE  HA          151 PHE  HN          4.20    (#   1238:10  Unique         2.82, 2.87 A)
 &rst
  ixpk= 1238, nxpk= 10, iat=2509,2507, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  151 PHE  HD          151 PHE  HN          3.50    (#   1239:10  Unique         2.93, 3.63 A)
 &rst
  ixpk= 1239, nxpk= 10, iat=  -1,2507, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2515,2523,
 &end
#
#  111 ILE  HN          110 GLU  HN          3.50    (#   1240:10  Unique         2.16, 2.38 A)
 &rst
  ixpk= 1240, nxpk= 10, iat=1810,1795, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  109 ALA  HN          110 GLU  HN          3.50    (#   1241:10  Unique         2.58, 2.68 A)
 &rst
  ixpk= 1241, nxpk= 10, iat=1785,1795, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1243   110 GLU  HN          4.20    (#   1243:10  Single Ambig)
 &rst
  ixpk= 1243, nxpk= 10, iat=  -1,1795, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1766,1773,
 &end
#
#    0 AMB  10-2:1244   111 ILE  HN          5.50    (#   1244:10  Single Ambig)
 &rst
  ixpk= 1244, nxpk= 10, iat=  -1,1810, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1785,1829,
 &end
#
#  110 GLU  HN          111 ILE  HN          3.50    (#   1245:10  Unique         2.16, 2.38 A)
 &rst
  ixpk= 1245, nxpk= 10, iat=1795,1810, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1246   111 ILE  HN          5.50    (#   1246:10  Single Ambig)
 &rst
  ixpk= 1246, nxpk= 10, iat=  -1,1810, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1775,1787,
 &end
#
#  110 GLU  HA          111 ILE  HN          5.50    (#   1247:10  Unique         3.32, 3.43 A)
 &rst
  ixpk= 1247, nxpk= 10, iat=1797,1810, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  111 ILE  HA          111 ILE  HN          5.50    (#   1248:10  Unique         2.74, 2.77 A)
 &rst
  ixpk= 1248, nxpk= 10, iat=1812,1810, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  108 ASP  HB+         111 ILE  HN          5.50    (#   1249:10  Unique         4.53, 5.09 A)
 &rst
  ixpk= 1249, nxpk= 10, iat=  -1,1810, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1777,1778,
 &end
#
#  111 ILE  HB          111 ILE  HN          3.50    (#   1250:10  Unique         2.49, 2.60 A)
 &rst
  ixpk= 1250, nxpk= 10, iat=1814,1810, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 ILE  HG1-        111 ILE  HN          4.20    (#   1251:10  Unique         1.90, 2.63 A)
 &rst
  ixpk= 1251, nxpk= 10, iat=  -1,1810, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1820,1821,
 &end
#
#  111 ILE  QG2         111 ILE  HN          4.20    (#   1252:10  Unique         4.38, 4.53 A)
 &rst
  ixpk= 1252, nxpk= 10, iat=  -1,1810, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1816,1817,1818,
 &end
#
#  111 ILE  HG1+        111 ILE  HN          5.50    (#   1253:10  Unique         1.90, 2.63 A)
 &rst
  ixpk= 1253, nxpk= 10, iat=  -1,1810, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1820,1821,
 &end
#
#    0 AMB  10-2:1254   111 ILE  HN          5.50    (#   1254:10  Single Ambig)
 &rst
  ixpk= 1254, nxpk= 10, iat=  -1,1810, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#  111 ILE  QD1         111 ILE  HN          4.20    (#   1255:10  Unique         3.57, 4.30 A)
 &rst
  ixpk= 1255, nxpk= 10, iat=  -1,1810, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1823,1824,1825,
 &end
#
#  111 ILE  QD1         112 ASN  HN          5.50    (#   1256:10  Unique         5.88, 6.46 A)
 &rst
  ixpk= 1256, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1823,1824,1825,
 &end
#
#  111 ILE  QG2         112 ASN  HN          3.50    (#   1257:10  Unique         2.65, 3.91 A)
 &rst
  ixpk= 1257, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1816,1817,1818,
 &end
#
#  111 ILE  HG1+        112 ASN  HN          5.50    (#   1258:10  Unique         4.36, 4.83 A)
 &rst
  ixpk= 1258, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1820,1821,
 &end
#
#    0 AMB  10-2:1259   112 ASN  HN          4.20    (#   1259:10  Single Ambig)
 &rst
  ixpk= 1259, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1= 926, 927, 928, 930, 931, 932, 926, 927, 928, 930,
       931, 932,
 &end
#
#    0 AMB  10-2:1260   112 ASN  HN          4.20    (#   1260:10  Single Ambig)
 &rst
  ixpk= 1260, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1= 900, 901, 902, 904, 905, 906, 900, 901, 902, 904,
       905, 906,
 &end
#
#  111 ILE  HG1-        112 ASN  HN          5.50    (#   1261:10  Unique         4.36, 4.83 A)
 &rst
  ixpk= 1261, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1820,1821,
 &end
#
#  111 ILE  HB          112 ASN  HN          5.50    (#   1262:10  Unique         4.08, 4.35 A)
 &rst
  ixpk= 1262, nxpk= 10, iat=1814,1829, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1263   112 ASN  HN          5.50    (#   1263:10  Single Ambig)
 &rst
  ixpk= 1263, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1=1854,1855,1856,1847,1848,1799,1800,
 &end
#
#  112 ASN  HB+         112 ASN  HN          3.50    (#   1264:10  Unique         2.24, 2.69 A)
 &rst
  ixpk= 1264, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1833,1834,
 &end
#
#  111 ILE  HA          112 ASN  HN          2.80    (#   1265:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1265, nxpk= 10, iat=1812,1829, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   59 GLY  HA+         112 ASN  HN          4.20    (#   1266:10  Unique         1.90, 3.24 A)
 &rst
  ixpk= 1266, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 912, 913,
 &end
#
#    0 AMB  10-2:1267   112 ASN  HN          5.50    (#   1267:10  Single Ambig)
 &rst
  ixpk= 1267, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1845, 846,1775,
 &end
#
#  112 ASN  HD2-        112 ASN  HN          5.50    (#   1269:10  Unique         4.13, 5.14 A)
 &rst
  ixpk= 1269, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1838,1839,
 &end
#
#  111 ILE  HN          112 ASN  HN          5.50    (#   1270:10  Unique         4.23, 4.39 A)
 &rst
  ixpk= 1270, nxpk= 10, iat=1810,1829, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1271   112 ASN  HN          5.50    (#   1271:10  Single Ambig)
 &rst
  ixpk= 1271, nxpk= 10, iat=  -1,1829, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 910,1838,1839,
 &end
#
#  113 MET  HN          112 ASN  HN          5.50    (#   1272:10  Unique         2.69, 3.78 A)
 &rst
  ixpk= 1272, nxpk= 10, iat=1843,1829, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  114 GLN  HN          113 MET  HN          3.50    (#   1275:10  Unique         1.89, 2.73 A)
 &rst
  ixpk= 1275, nxpk= 10, iat=1860,1843, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  113 MET  HA          113 MET  HN          4.20    (#   1277:10  Unique         2.27, 2.77 A)
 &rst
  ixpk= 1277, nxpk= 10, iat=1845,1843, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  113 MET  HG-         113 MET  HN          3.50    (#   1278:10  Unique         2.36, 3.17 A)
 &rst
  ixpk= 1278, nxpk= 10, iat=  -1,1843, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1850,1851,
 &end
#
#  113 MET  HG+         113 MET  HN          3.50    (#   1279:10  Unique         2.36, 3.17 A)
 &rst
  ixpk= 1279, nxpk= 10, iat=  -1,1843, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1850,1851,
 &end
#
#    0 AMB  10-2:1280   113 MET  HN          5.50    (#   1280:10  Single Ambig)
 &rst
  ixpk= 1280, nxpk= 10, iat=  -1,1843, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1864,1865,1867,1868,
 &end
#
#  114 GLN  HB-         113 MET  HN          5.50    (#   1281:10  Unique         3.73, 5.11 A)
 &rst
  ixpk= 1281, nxpk= 10, iat=  -1,1843, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1864,1865,
 &end
#
#  111 ILE  QG2         113 MET  HN          5.50    (#   1282:10  Unique         3.14, 4.57 A)
 &rst
  ixpk= 1282, nxpk= 10, iat=  -1,1843, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1816,1817,1818,
 &end
#
#  114 GLN  HG-         114 GLN  HN          5.50    (#   1283:10  Unique         2.19, 2.76 A)
 &rst
  ixpk= 1283, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1867,1868,
 &end
#
#  112 ASN  HD2-        114 GLN  HN          5.50    (#   1285:10  Unique         1.94, 2.84 A)
 &rst
  ixpk= 1285, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1838,1839,
 &end
#
#    0 AMB  10-2:1286   114 GLN  HN          5.50    (#   1286:10  Single Ambig)
 &rst
  ixpk= 1286, nxpk= 10, iat=  -1,1860, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1941, 438,
 &end
#
#  113 MET  HN          114 GLN  HN          3.50    (#   1287:10  Unique         1.89, 2.73 A)
 &rst
  ixpk= 1287, nxpk= 10, iat=1843,1860, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  116 SER  HN          115 THR  HN          2.80    (#   1288:10  Unique         2.77, 3.03 A)
 &rst
  ixpk= 1288, nxpk= 10, iat=1891,1877, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  114 GLN  HA          115 THR  HN          2.97    (#   1289:10  Unique         3.08, 3.11 A)
 &rst
  ixpk= 1289, nxpk= 10, iat=1862,1877, r1= 0.00, r2= 1.80, r3= 2.97, r4= 3.72,  &end
#
#  113 MET  HA          115 THR  HN          5.50    (#   1291:10  Unique         3.07, 3.33 A)
 &rst
  ixpk= 1291, nxpk= 10, iat=1845,1877, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  115 THR  HA          115 THR  HN          2.80    (#   1292:10  Unique         2.74, 2.76 A)
 &rst
  ixpk= 1292, nxpk= 10, iat=1879,1877, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1293   115 THR  HN          3.50    (#   1293:10  Single Ambig)
 &rst
  ixpk= 1293, nxpk= 10, iat=  -1,1877, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1881, 912, 913,
 &end
#
#  116 SER  HB-         115 THR  HN          5.50    (#   1294:10  Unique         4.89, 5.63 A)
 &rst
  ixpk= 1294, nxpk= 10, iat=  -1,1877, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1895,1896,
 &end
#
#    0 AMB  10-2:1295   115 THR  HN          3.50    (#   1295:10  Single Ambig)
 &rst
  ixpk= 1295, nxpk= 10, iat=  -1,1877, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1867,1868,1864,1865,
 &end
#
#    0 AMB  10-2:1296   115 THR  HN          3.50    (#   1296:10  Single Ambig)
 &rst
  ixpk= 1296, nxpk= 10, iat=  -1,1877, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1864,1865,1934,1935,
 &end
#
#  114 GLN  HG-         115 THR  HN          5.50    (#   1297:10  Unique         3.28, 3.90 A)
 &rst
  ixpk= 1297, nxpk= 10, iat=  -1,1877, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1867,1868,
 &end
#
#  115 THR  MG2         115 THR  HN          2.80    (#   1300:10  Unique         2.81, 3.99 A)
 &rst
  ixpk= 1300, nxpk= 10, iat=  -1,1877, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=1883,1884,1885,
 &end
#
#  115 THR  HA          116 SER  HN          3.50    (#   1303:10  Unique         3.48, 3.55 A)
 &rst
  ixpk= 1303, nxpk= 10, iat=1879,1891, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  116 SER  HB-         116 SER  HN          5.50    (#   1304:10  Unique         2.11, 2.79 A)
 &rst
  ixpk= 1304, nxpk= 10, iat=  -1,1891, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1895,1896,
 &end
#
#  118 THR  MG2         117 SER  HN          5.50    (#   1306:10  Unique         5.58, 6.70 A)
 &rst
  ixpk= 1306, nxpk= 10, iat=  -1,1902, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1919,1920,1921,
 &end
#
#  116 SER  HB-         117 SER  HN          3.50    (#   1307:10  Unique         2.43, 3.39 A)
 &rst
  ixpk= 1307, nxpk= 10, iat=  -1,1902, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1895,1896,
 &end
#
#    0 AMB  10-2:1308   117 SER  HN          2.80    (#   1308:10  Single Ambig)
 &rst
  ixpk= 1308, nxpk= 10, iat=  -1,1902, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1906,1907,1895,1896,
 &end
#
#  117 SER  HA          117 SER  HN          2.80    (#   1309:10  Unique         2.75, 2.76 A)
 &rst
  ixpk= 1309, nxpk= 10, iat=1904,1902, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  116 SER  HA          117 SER  HN          2.80    (#   1310:10  Unique         2.35, 2.40 A)
 &rst
  ixpk= 1310, nxpk= 10, iat=1893,1902, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  118 THR  HN          117 SER  HN          2.80    (#   1313:10  Unique         2.83, 2.94 A)
 &rst
  ixpk= 1313, nxpk= 10, iat=1913,1902, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  117 SER  HN          118 THR  HN          2.80    (#   1315:10  Unique         2.83, 2.94 A)
 &rst
  ixpk= 1315, nxpk= 10, iat=1902,1913, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1316   118 THR  HN          4.20    (#   1316:10  Single Ambig)
 &rst
  ixpk= 1316, nxpk= 10, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1893,1862,
 &end
#
#    0 AMB  10-2:1318   118 THR  HN          2.80    (#   1318:10  Single Ambig)
 &rst
  ixpk= 1318, nxpk= 10, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1915,1904,
 &end
#
#  118 THR  HB          118 THR  HN          3.50    (#   1319:10  Unique         3.53, 3.61 A)
 &rst
  ixpk= 1319, nxpk= 10, iat=1917,1913, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1320   118 THR  HN          2.80    (#   1320:10  Single Ambig)
 &rst
  ixpk= 1320, nxpk= 10, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1906,1907,1895,1896,
 &end
#
#  116 SER  HB-         118 THR  HN          4.20    (#   1321:10  Unique         2.76, 3.83 A)
 &rst
  ixpk= 1321, nxpk= 10, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1895,1896,
 &end
#
#  119 PRO  HD+         118 THR  HN          4.20    (#   1322:10  Unique         4.25, 4.50 A)
 &rst
  ixpk= 1322, nxpk= 10, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1928,1929,
 &end
#
#  119 PRO  HD-         118 THR  HN          4.20    (#   1323:10  Unique         4.25, 4.50 A)
 &rst
  ixpk= 1323, nxpk= 10, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1928,1929,
 &end
#
#  118 THR  MG2         118 THR  HN          3.50    (#   1326:10  Unique         3.23, 4.12 A)
 &rst
  ixpk= 1326, nxpk= 10, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1919,1920,1921,
 &end
#
#  120 GLU  HB-         120 GLU  HN          4.20    (#   1327:10  Unique         2.09, 2.90 A)
 &rst
  ixpk= 1327, nxpk= 10, iat=  -1,1941, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1945,1946,
 &end
#
#    0 AMB  10-2:1328   120 GLU  HN          3.55    (#   1328:10  Single Ambig)
 &rst
  ixpk= 1328, nxpk= 10, iat=  -1,1941, r1= 0.00, r2= 1.80, r3= 4.47, r4= 5.22,
 igr1=1948,1949,1931,1932,
 &end
#
#  120 GLU  HB+         120 GLU  HN          2.80    (#   1329:10  Unique         2.09, 2.90 A)
 &rst
  ixpk= 1329, nxpk= 10, iat=  -1,1941, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1945,1946,
 &end
#
#  119 PRO  HB+         120 GLU  HN          5.50    (#   1330:10  Unique         2.72, 3.55 A)
 &rst
  ixpk= 1330, nxpk= 10, iat=  -1,1941, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1934,1935,
 &end
#
#  119 PRO  HA          120 GLU  HN          2.80    (#   1332:10  Unique         2.15, 2.22 A)
 &rst
  ixpk= 1332, nxpk= 10, iat=1937,1941, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  121 PHE  HN          120 GLU  HN          5.50    (#   1333:10  Unique         1.88, 2.19 A)
 &rst
  ixpk= 1333, nxpk= 10, iat=1956,1941, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  121 PHE  HA          121 PHE  HN          5.50    (#   1334:10  Unique         2.75, 2.83 A)
 &rst
  ixpk= 1334, nxpk= 10, iat=1958,1956, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  121 PHE  HB-         122 ASP  HN          5.50    (#   1336:10  Unique         2.60, 3.92 A)
 &rst
  ixpk= 1336, nxpk= 10, iat=  -1,1976, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1960,1961,
 &end
#
#  121 PHE  HB+         122 ASP  HN          5.50    (#   1337:10  Unique         2.60, 3.92 A)
 &rst
  ixpk= 1337, nxpk= 10, iat=  -1,1976, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1960,1961,
 &end
#
#    0 AMB  10-2:1338     0 AMB  10-1:1338   5.50    (#   1338:10  Double Ambig)
 &rst
  ixpk= 1338, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 440,1492,
 igr2=1976,1428,
 &end
#
#  121 PHE  HA          122 ASP  HN          5.50    (#   1339:10  Unique         2.22, 2.77 A)
 &rst
  ixpk= 1339, nxpk= 10, iat=1958,1976, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  123 GLY  HN          122 ASP  HN          3.50    (#   1340:10  Unique         2.61, 2.93 A)
 &rst
  ixpk= 1340, nxpk= 10, iat=1988,1976, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  122 ASP  HN          123 GLY  HN          3.50    (#   1342:10  Unique         2.61, 2.93 A)
 &rst
  ixpk= 1342, nxpk= 10, iat=1976,1988, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  123 GLY  HA+         123 GLY  HN          4.20    (#   1344:10  Unique         2.30, 2.72 A)
 &rst
  ixpk= 1344, nxpk= 10, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1990,1991,
 &end
#
#  123 GLY  HA-         123 GLY  HN          4.20    (#   1345:10  Unique         2.30, 2.72 A)
 &rst
  ixpk= 1345, nxpk= 10, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1990,1991,
 &end
#
#  125 ARG  HN          124 TRP  HN          5.50    (#   1347:10  Unique         4.25, 4.43 A)
 &rst
  ixpk= 1347, nxpk= 10, iat=2019,1995, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  123 GLY  HN          124 TRP  HN          5.50    (#   1348:10  Unique         3.76, 4.31 A)
 &rst
  ixpk= 1348, nxpk= 10, iat=1988,1995, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1349   124 TRP  HN          4.20    (#   1349:10  Single Ambig)
 &rst
  ixpk= 1349, nxpk= 10, iat=  -1,1995, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 525,1966,1970,2058,
 &end
#
#  124 TRP  HA          124 TRP  HN          4.20    (#   1351:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 1351, nxpk= 10, iat=1997,1995, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  123 GLY  HA+         124 TRP  HN          2.80    (#   1353:10  Unique         2.14, 2.59 A)
 &rst
  ixpk= 1353, nxpk= 10, iat=  -1,1995, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1990,1991,
 &end
#
#  123 GLY  HA-         124 TRP  HN          2.80    (#   1354:10  Unique         2.14, 2.59 A)
 &rst
  ixpk= 1354, nxpk= 10, iat=  -1,1995, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1990,1991,
 &end
#
#  124 TRP  HB+         124 TRP  HN          5.50    (#   1355:10  Unique         2.26, 3.25 A)
 &rst
  ixpk= 1355, nxpk= 10, iat=  -1,1995, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1999,2000,
 &end
#
#   33 TRP  HH2         125 ARG  HN          5.50    (#   1357:10  Unique         4.26, 6.17 A)
 &rst
  ixpk= 1357, nxpk= 10, iat= 525,2019, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  124 TRP  HA          125 ARG  HN          5.50    (#   1358:10  Unique         2.15, 2.20 A)
 &rst
  ixpk= 1358, nxpk= 10, iat=1997,2019, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   25 ALA  HA          125 ARG  HN          5.50    (#   1359:10  Unique         3.15, 3.95 A)
 &rst
  ixpk= 1359, nxpk= 10, iat= 382,2019, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  125 ARG  HA          125 ARG  HN          5.50    (#   1360:10  Unique         2.89, 2.93 A)
 &rst
  ixpk= 1360, nxpk= 10, iat=2021,2019, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  124 TRP  HB-         125 ARG  HN          5.50    (#   1361:10  Unique         2.47, 3.68 A)
 &rst
  ixpk= 1361, nxpk= 10, iat=  -1,2019, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1999,2000,
 &end
#
#  125 ARG  HG+         125 ARG  HN          5.50    (#   1362:10  Unique         4.04, 4.59 A)
 &rst
  ixpk= 1362, nxpk= 10, iat=  -1,2019, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2026,2027,
 &end
#
#  125 ARG  HB+         125 ARG  HN          5.50    (#   1363:10  Unique         2.51, 2.99 A)
 &rst
  ixpk= 1363, nxpk= 10, iat=  -1,2019, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2023,2024,
 &end
#
#    0 AMB  10-2:1366     2 ILE  HN          3.50    (#   1366:10  Single Ambig)
 &rst
  ixpk= 1366, nxpk= 10, iat=  -1,  21, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=   6,  23,
 &end
#
#    1 MET  HB+           2 ILE  HN          5.50    (#   1368:10  Unique         2.16, 4.03 A)
 &rst
  ixpk= 1368, nxpk= 10, iat=  -1,  21, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=   8,   9,
 &end
#
#  125 ARG  HG-         126 TRP  HN          5.50    (#   1369:10  Unique         1.98, 3.03 A)
 &rst
  ixpk= 1369, nxpk= 10, iat=  -1,2043, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2026,2027,
 &end
#
#  127 VAL  MGY         127 VAL  HN          4.20    (#   1370:10  Unique         1.92, 3.51 A)
 &rst
  ixpk= 1370, nxpk= 10, iat=  -1,2067, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#  127 VAL  MGX         127 VAL  HN          3.50    (#   1371:10  Unique         1.92, 3.51 A)
 &rst
  ixpk= 1371, nxpk= 10, iat=  -1,2067, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#   22 VAL  MGX         127 VAL  HN          4.20    (#   1372:10  Unique         2.20, 5.08 A)
 &rst
  ixpk= 1372, nxpk= 10, iat=  -1,2067, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   21 GLN  HB+         127 VAL  HN          5.50    (#   1373:10  Unique         2.44, 4.26 A)
 &rst
  ixpk= 1373, nxpk= 10, iat=  -1,2067, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 310, 311,
 &end
#
#  126 TRP  HB+         127 VAL  HN          4.20    (#   1375:10  Unique         2.66, 3.51 A)
 &rst
  ixpk= 1375, nxpk= 10, iat=  -1,2067, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2047,2048,
 &end
#
#  126 TRP  HA          127 VAL  HN          3.50    (#   1377:10  Unique         2.14, 2.23 A)
 &rst
  ixpk= 1377, nxpk= 10, iat=2045,2067, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  126 TRP  HN          127 VAL  HN          5.50    (#   1379:10  Unique         4.30, 4.47 A)
 &rst
  ixpk= 1379, nxpk= 10, iat=2043,2067, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   22 VAL  HN          127 VAL  HN          5.50    (#   1380:10  Unique         2.37, 3.18 A)
 &rst
  ixpk= 1380, nxpk= 10, iat= 323,2067, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  128 SER  HA          128 SER  HN          5.50    (#   1382:10  Unique         2.74, 2.84 A)
 &rst
  ixpk= 1382, nxpk= 10, iat=2085,2083, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  128 SER  HB+         128 SER  HN          3.50    (#   1383:10  Unique         2.09, 2.90 A)
 &rst
  ixpk= 1383, nxpk= 10, iat=  -1,2083, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2087,2088,
 &end
#
#  127 VAL  HB          128 SER  HN          3.50    (#   1384:10  Unique         1.87, 2.13 A)
 &rst
  ixpk= 1384, nxpk= 10, iat=2071,2083, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  127 VAL  MGX         128 SER  HN          4.20    (#   1385:10  Unique         1.94, 4.09 A)
 &rst
  ixpk= 1385, nxpk= 10, iat=  -1,2083, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#  127 VAL  MGY         128 SER  HN          3.50    (#   1386:10  Unique         1.94, 4.09 A)
 &rst
  ixpk= 1386, nxpk= 10, iat=  -1,2083, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#   22 VAL  MGX         129 TYR  HN          5.50    (#   1387:10  Unique         3.49, 5.54 A)
 &rst
  ixpk= 1387, nxpk= 10, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#  129 TYR  HB-         129 TYR  HN          4.20    (#   1388:10  Unique         2.13, 3.08 A)
 &rst
  ixpk= 1388, nxpk= 10, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2098,2099,
 &end
#
#  129 TYR  HB+         129 TYR  HN          4.20    (#   1389:10  Unique         2.13, 3.08 A)
 &rst
  ixpk= 1389, nxpk= 10, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2098,2099,
 &end
#
#  128 SER  HB+         129 TYR  HN          3.50    (#   1390:10  Unique         2.24, 3.35 A)
 &rst
  ixpk= 1390, nxpk= 10, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2087,2088,
 &end
#
#  128 SER  HA          129 TYR  HN          2.80    (#   1391:10  Unique         2.26, 2.40 A)
 &rst
  ixpk= 1391, nxpk= 10, iat=2085,2094, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  129 TYR  HD          129 TYR  HN          4.20    (#   1393:10  Unique         2.05, 3.45 A)
 &rst
  ixpk= 1393, nxpk= 10, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2102,2111,
 &end
#
#  130 TRP  HN          129 TYR  HN          5.50    (#   1394:10  Unique         2.35, 2.45 A)
 &rst
  ixpk= 1394, nxpk= 10, iat=2115,2094, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  129 TYR  HB-         130 TRP  HN          5.50    (#   1395:10  Unique         3.27, 4.04 A)
 &rst
  ixpk= 1395, nxpk= 10, iat=  -1,2115, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2098,2099,
 &end
#
#    0 AMB  10-2:1396   130 TRP  HN          4.20    (#   1396:10  Single Ambig)
 &rst
  ixpk= 1396, nxpk= 10, iat=  -1,2115, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=2119,2120,2098,2099,
 &end
#
#  130 TRP  HB+         130 TRP  HN          5.50    (#   1397:10  Unique         2.21, 3.02 A)
 &rst
  ixpk= 1397, nxpk= 10, iat=  -1,2115, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2119,2120,
 &end
#
#  128 SER  HB+         130 TRP  HN          5.50    (#   1398:10  Unique         2.11, 3.13 A)
 &rst
  ixpk= 1398, nxpk= 10, iat=  -1,2115, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2087,2088,
 &end
#
#  131 TYR  HN          130 TRP  HN          5.50    (#   1399:10  Unique         1.96, 2.19 A)
 &rst
  ixpk= 1399, nxpk= 10, iat=2139,2115, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  127 VAL  MGX         131 TYR  HN          5.50    (#   1400:10  Unique         4.13, 6.39 A)
 &rst
  ixpk= 1400, nxpk= 10, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#    0 AMB  10-2:1401   131 TYR  HN          5.50    (#   1401:10  Single Ambig)
 &rst
  ixpk= 1401, nxpk= 10, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2180,2181,2182,2184,2185,2186,2167,2168,
 &end
#
#    0 AMB  10-2:1403   131 TYR  HN          5.50    (#   1403:10  Single Ambig)
 &rst
  ixpk= 1403, nxpk= 10, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=2071,2194,2195,2457,2458,
 &end
#
#  131 TYR  HB+         131 TYR  HN          3.50    (#   1404:10  Unique         2.08, 2.64 A)
 &rst
  ixpk= 1404, nxpk= 10, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2143,2144,
 &end
#
#  130 TRP  HB+         131 TYR  HN          4.20    (#   1405:10  Unique         3.68, 4.03 A)
 &rst
  ixpk= 1405, nxpk= 10, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2119,2120,
 &end
#
#  132 PRO  HD+         131 TYR  HN          5.50    (#   1406:10  Unique         1.86, 2.58 A)
 &rst
  ixpk= 1406, nxpk= 10, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2161,2162,
 &end
#
#  128 SER  HB+         131 TYR  HN          5.50    (#   1407:10  Unique         2.06, 3.17 A)
 &rst
  ixpk= 1407, nxpk= 10, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2087,2088,
 &end
#
#  131 TYR  HA          131 TYR  HN          4.20    (#   1408:10  Unique         2.73, 2.83 A)
 &rst
  ixpk= 1408, nxpk= 10, iat=2141,2139, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  131 TYR  HD          131 TYR  HN          5.50    (#   1409:10  Unique         2.42, 4.40 A)
 &rst
  ixpk= 1409, nxpk= 10, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2147,2156,
 &end
#
#  130 TRP  HN          131 TYR  HN          5.50    (#   1410:10  Unique         1.96, 2.19 A)
 &rst
  ixpk= 1410, nxpk= 10, iat=2115,2139, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  134 ARG  HN          133 VAL  HN          3.50    (#   1412:10  Unique         2.42, 2.55 A)
 &rst
  ixpk= 1412, nxpk= 10, iat=2190,2174, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  133 VAL  HA          133 VAL  HN          3.50    (#   1413:10  Unique         2.81, 2.84 A)
 &rst
  ixpk= 1413, nxpk= 10, iat=2176,2174, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  132 PRO  HA          133 VAL  HN          5.50    (#   1414:10  Unique         2.46, 3.42 A)
 &rst
  ixpk= 1414, nxpk= 10, iat=2170,2174, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  133 VAL  HB          133 VAL  HN          3.50    (#   1415:10  Unique         2.30, 2.68 A)
 &rst
  ixpk= 1415, nxpk= 10, iat=2178,2174, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1416   133 VAL  HN          4.20    (#   1416:10  Single Ambig)
 &rst
  ixpk= 1416, nxpk= 10, iat=  -1,2174, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=2167,2168,2221,2222,2464,2465,2466,
 &end
#
#    0 AMB  10-2:1417   133 VAL  HN          5.50    (#   1417:10  Single Ambig)
 &rst
  ixpk= 1417, nxpk= 10, iat=  -1,2174, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2194,2195,2071,
 &end
#
#  133 VAL  MGY         133 VAL  HN          2.80    (#   1418:10  Unique         1.93, 3.67 A)
 &rst
  ixpk= 1418, nxpk= 10, iat=  -1,2174, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2180,2181,2182,2184,2185,2186,
 &end
#
#    0 AMB  10-2:1419   134 ARG  HN          4.20    (#   1419:10  Single Ambig)
 &rst
  ixpk= 1419, nxpk= 10, iat=  -1,2190, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 &end
#
#    0 AMB  10-2:1420   134 ARG  HN          3.50    (#   1420:10  Single Ambig)
 &rst
  ixpk= 1420, nxpk= 10, iat=  -1,2190, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2197,2198,2221,2222,
 &end
#
#  134 ARG  HB+         134 ARG  HN          3.50    (#   1421:10  Unique         2.11, 2.78 A)
 &rst
  ixpk= 1421, nxpk= 10, iat=  -1,2190, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2194,2195,
 &end
#
#  134 ARG  HB-         134 ARG  HN          2.80    (#   1422:10  Unique         2.11, 2.78 A)
 &rst
  ixpk= 1422, nxpk= 10, iat=  -1,2190, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2194,2195,
 &end
#
#  133 VAL  HB          134 ARG  HN          4.20    (#   1423:10  Unique         2.82, 3.12 A)
 &rst
  ixpk= 1423, nxpk= 10, iat=2178,2190, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  134 ARG  HD+         134 ARG  HN          5.50    (#   1424:10  Unique         4.66, 5.14 A)
 &rst
  ixpk= 1424, nxpk= 10, iat=  -1,2190, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2200,2201,
 &end
#
#  133 VAL  HA          134 ARG  HN          5.50    (#   1425:10  Unique         3.38, 3.44 A)
 &rst
  ixpk= 1425, nxpk= 10, iat=2176,2190, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  134 ARG  HA          134 ARG  HN          3.50    (#   1426:10  Unique         2.87, 2.91 A)
 &rst
  ixpk= 1426, nxpk= 10, iat=2192,2190, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  131 TYR  HD          134 ARG  HN          5.50    (#   1427:10  Unique         4.91, 6.50 A)
 &rst
  ixpk= 1427, nxpk= 10, iat=  -1,2190, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2147,2156,
 &end
#
#  133 VAL  HN          134 ARG  HN          3.50    (#   1428:10  Unique         2.42, 2.55 A)
 &rst
  ixpk= 1428, nxpk= 10, iat=2174,2190, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  136 VAL  HN          134 ARG  HN          5.50    (#   1429:10  Unique         3.56, 3.79 A)
 &rst
  ixpk= 1429, nxpk= 10, iat=2231,2190, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  136 VAL  HN          135 GLN  HN          3.50    (#   1432:10  Unique         2.08, 2.31 A)
 &rst
  ixpk= 1432, nxpk= 10, iat=2231,2214, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  133 VAL  HN          135 GLN  HN          4.20    (#   1433:10  Unique         3.67, 4.00 A)
 &rst
  ixpk= 1433, nxpk= 10, iat=2174,2214, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1434   135 GLN  HN          3.50    (#   1434:10  Single Ambig)
 &rst
  ixpk= 1434, nxpk= 10, iat=  -1,2214, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2216,2192,
 &end
#
#  134 ARG  HB+         135 GLN  HN          4.20    (#   1436:10  Unique         3.09, 3.42 A)
 &rst
  ixpk= 1436, nxpk= 10, iat=  -1,2214, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2194,2195,
 &end
#
#  135 GLN  HG+         135 GLN  HN          3.50    (#   1437:10  Unique         2.14, 3.19 A)
 &rst
  ixpk= 1437, nxpk= 10, iat=  -1,2214, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2221,2222,
 &end
#
#  135 GLN  HB-         135 GLN  HN          3.50    (#   1438:10  Unique         2.45, 3.17 A)
 &rst
  ixpk= 1438, nxpk= 10, iat=  -1,2214, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2218,2219,
 &end
#
#    0 AMB  10-2:1439   135 GLN  HN          5.50    (#   1439:10  Single Ambig)
 &rst
  ixpk= 1439, nxpk= 10, iat=  -1,2214, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,
 &end
#
#  136 VAL  MGY         136 VAL  HN          2.80    (#   1441:10  Unique         1.91, 3.46 A)
 &rst
  ixpk= 1441, nxpk= 10, iat=  -1,2231, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2237,2238,2239,2241,2242,2243,
 &end
#
#  136 VAL  MGX         136 VAL  HN          2.80    (#   1442:10  Unique         1.91, 3.46 A)
 &rst
  ixpk= 1442, nxpk= 10, iat=  -1,2231, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2237,2238,2239,2241,2242,2243,
 &end
#
#    0 AMB  10-2:1443   136 VAL  HN          3.50    (#   1443:10  Single Ambig)
 &rst
  ixpk= 1443, nxpk= 10, iat=  -1,2231, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2216,2192,
 &end
#
#  136 VAL  HA          136 VAL  HN          4.20    (#   1444:10  Unique         2.74, 2.79 A)
 &rst
  ixpk= 1444, nxpk= 10, iat=2233,2231, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  133 VAL  HA          136 VAL  HN          5.50    (#   1445:10  Unique         3.30, 3.60 A)
 &rst
  ixpk= 1445, nxpk= 10, iat=2176,2231, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  132 PRO  HA          136 VAL  HN          5.50    (#   1446:10  Unique         3.39, 4.38 A)
 &rst
  ixpk= 1446, nxpk= 10, iat=2170,2231, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  136 VAL  HB          136 VAL  HN          3.50    (#   1447:10  Unique         2.38, 3.00 A)
 &rst
  ixpk= 1447, nxpk= 10, iat=2235,2231, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1448   136 VAL  HN          5.50    (#   1448:10  Single Ambig)
 &rst
  ixpk= 1448, nxpk= 10, iat=  -1,2231, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2323,2324,2221,2222,2197,2198,
 &end
#
#    0 AMB  10-2:1449   136 VAL  HN          5.50    (#   1449:10  Single Ambig)
 &rst
  ixpk= 1449, nxpk= 10, iat=  -1,2231, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2174,2378,2383,
 &end
#
#  135 GLN  HN          136 VAL  HN          2.80    (#   1450:10  Unique         2.08, 2.31 A)
 &rst
  ixpk= 1450, nxpk= 10, iat=2214,2231, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  137 VAL  HN          136 VAL  HN          5.50    (#   1451:10  Unique         3.43, 4.56 A)
 &rst
  ixpk= 1451, nxpk= 10, iat=2247,2231, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  137 VAL  HA          137 VAL  HN          4.20    (#   1452:10  Unique         2.70, 2.83 A)
 &rst
  ixpk= 1452, nxpk= 10, iat=2249,2247, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  136 VAL  HA          137 VAL  HN          3.50    (#   1453:10  Unique         2.23, 2.42 A)
 &rst
  ixpk= 1453, nxpk= 10, iat=2233,2247, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1455   137 VAL  HN          3.50    (#   1455:10  Single Ambig)
 &rst
  ixpk= 1455, nxpk= 10, iat=  -1,2247, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2235,2251,
 &end
#
#    0 AMB  10-2:1456   137 VAL  HN          3.50    (#   1456:10  Single Ambig)
 &rst
  ixpk= 1456, nxpk= 10, iat=  -1,2247, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2253,2254,2255,2257,2258,2259,2301,2302,
 &end
#
#    0 AMB  10-2:1457   137 VAL  HN          2.80    (#   1457:10  Single Ambig)
 &rst
  ixpk= 1457, nxpk= 10, iat=  -1,2247, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=2237,2238,2239,2241,2242,2243,2253,2254,2255,2257,
      2258,2259,
 &end
#
#  137 VAL  MGX         138 SER  HN          3.50    (#   1458:10  Unique         1.91, 3.86 A)
 &rst
  ixpk= 1458, nxpk= 10, iat=  -1,2263, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2253,2254,2255,2257,2258,2259,
 &end
#
#  137 VAL  MGY         138 SER  HN          2.80    (#   1459:10  Unique         1.91, 3.86 A)
 &rst
  ixpk= 1459, nxpk= 10, iat=  -1,2263, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  10-2:1460   138 SER  HN          5.50    (#   1460:10  Single Ambig)
 &rst
  ixpk= 1460, nxpk= 10, iat=  -1,2263, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2320,2321,2323,2324,
 &end
#
#  137 VAL  HB          138 SER  HN          3.50    (#   1461:10  Unique         2.38, 3.79 A)
 &rst
  ixpk= 1461, nxpk= 10, iat=2251,2263, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  138 SER  HA          138 SER  HN          3.50    (#   1462:10  Unique         2.76, 2.82 A)
 &rst
  ixpk= 1462, nxpk= 10, iat=2265,2263, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1463   138 SER  HN          2.80    (#   1463:10  Single Ambig)
 &rst
  ixpk= 1463, nxpk= 10, iat=  -1,2263, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=2267,2268,2267,2268,
 &end
#
#  137 VAL  HA          138 SER  HN          2.80    (#   1464:10  Unique         2.14, 2.27 A)
 &rst
  ixpk= 1464, nxpk= 10, iat=2249,2263, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  137 VAL  HN          138 SER  HN          5.50    (#   1466:10  Unique         3.83, 4.56 A)
 &rst
  ixpk= 1466, nxpk= 10, iat=2247,2263, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  139 PHE  HD          139 PHE  HN          3.50    (#   1467:10  Unique         2.32, 3.61 A)
 &rst
  ixpk= 1467, nxpk= 10, iat=  -1,2274, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2282,2290,
 &end
#
#  139 PHE  HB+         139 PHE  HN          5.50    (#   1469:10  Unique         2.11, 3.06 A)
 &rst
  ixpk= 1469, nxpk= 10, iat=  -1,2274, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2278,2279,
 &end
#
#  139 PHE  HB-         139 PHE  HN          4.20    (#   1470:10  Unique         2.11, 3.06 A)
 &rst
  ixpk= 1470, nxpk= 10, iat=  -1,2274, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2278,2279,
 &end
#
#  137 VAL  MGY         139 PHE  HN          4.20    (#   1471:10  Unique         1.92, 3.53 A)
 &rst
  ixpk= 1471, nxpk= 10, iat=  -1,2274, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2253,2254,2255,2257,2258,2259,
 &end
#
#    0 AMB  10-2:1472   140 LYS  HN          3.50    (#   1472:10  Single Ambig)
 &rst
  ixpk= 1472, nxpk= 10, iat=  -1,2294, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2253,2254,2255,2257,2258,2259,2301,2302,
 &end
#
#  140 LYS  HB-         140 LYS  HN          5.50    (#   1473:10  Unique         2.28, 3.14 A)
 &rst
  ixpk= 1473, nxpk= 10, iat=  -1,2294, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2298,2299,
 &end
#
#  140 LYS  HB+         140 LYS  HN          4.20    (#   1474:10  Unique         2.28, 3.14 A)
 &rst
  ixpk= 1474, nxpk= 10, iat=  -1,2294, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2298,2299,
 &end
#
#  141 ARG  HB+         140 LYS  HN          5.50    (#   1475:10  Unique         3.69, 4.59 A)
 &rst
  ixpk= 1475, nxpk= 10, iat=  -1,2294, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2320,2321,
 &end
#
#  139 PHE  HB-         140 LYS  HN          5.50    (#   1476:10  Unique         2.80, 3.59 A)
 &rst
  ixpk= 1476, nxpk= 10, iat=  -1,2294, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2278,2279,
 &end
#
#  140 LYS  HA          140 LYS  HN          5.50    (#   1477:10  Unique         2.86, 2.93 A)
 &rst
  ixpk= 1477, nxpk= 10, iat=2296,2294, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  141 ARG  HN          140 LYS  HN          3.50    (#   1479:10  Unique         1.89, 2.32 A)
 &rst
  ixpk= 1479, nxpk= 10, iat=2316,2294, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  142 ASP  HN          141 ARG  HN          4.20    (#   1480:10  Unique         2.42, 2.46 A)
 &rst
  ixpk= 1480, nxpk= 10, iat=2340,2316, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  140 LYS  HN          141 ARG  HN          3.50    (#   1481:10  Unique         1.89, 2.32 A)
 &rst
  ixpk= 1481, nxpk= 10, iat=2294,2316, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  140 LYS  HA          141 ARG  HN          5.50    (#   1484:10  Unique         2.67, 2.97 A)
 &rst
  ixpk= 1484, nxpk= 10, iat=2296,2316, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  141 ARG  HA          141 ARG  HN          4.20    (#   1485:10  Unique         2.86, 2.87 A)
 &rst
  ixpk= 1485, nxpk= 10, iat=2318,2316, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  141 ARG  HB+         141 ARG  HN          2.80    (#   1486:10  Unique         2.10, 2.87 A)
 &rst
  ixpk= 1486, nxpk= 10, iat=  -1,2316, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2320,2321,
 &end
#
#    0 AMB  10-2:1487   141 ARG  HN          3.50    (#   1487:10  Single Ambig)
 &rst
  ixpk= 1487, nxpk= 10, iat=  -1,2316, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2323,2324,2320,2321,
 &end
#
#  141 ARG  HG-         141 ARG  HN          3.50    (#   1488:10  Unique         1.93, 3.42 A)
 &rst
  ixpk= 1488, nxpk= 10, iat=  -1,2316, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2323,2324,
 &end
#
#    0 AMB  10-2:1489   141 ARG  HN          4.20    (#   1489:10  Single Ambig)
 &rst
  ixpk= 1489, nxpk= 10, iat=  -1,2316, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=2237,2238,2239,2241,2242,2243,2253,2254,2255,2257,
      2258,2259,
 &end
#
#  155 VAL  MGX         156 MET  HN          3.50    (#   1490:10  Unique         2.02, 4.37 A)
 &rst
  ixpk= 1490, nxpk= 10, iat=  -1,2580, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2570,2571,2572,2574,2575,2576,
 &end
#
#  155 VAL  MGY         156 MET  HN          3.50    (#   1491:10  Unique         2.02, 4.37 A)
 &rst
  ixpk= 1491, nxpk= 10, iat=  -1,2580, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2570,2571,2572,2574,2575,2576,
 &end
#
#    0 AMB  10-2:1492   156 MET  HN          2.80    (#   1492:10  Single Ambig)
 &rst
  ixpk= 1492, nxpk= 10, iat=  -1,2580, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=2568,2612,2613,
 &end
#
#  156 MET  HB+         156 MET  HN          2.80    (#   1493:10  Unique         2.53, 3.09 A)
 &rst
  ixpk= 1493, nxpk= 10, iat=  -1,2580, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2584,2585,
 &end
#
#  156 MET  HG-         156 MET  HN          3.50    (#   1494:10  Unique         1.95, 2.82 A)
 &rst
  ixpk= 1494, nxpk= 10, iat=  -1,2580, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2587,2588,
 &end
#
#  156 MET  HG+         156 MET  HN          3.50    (#   1495:10  Unique         1.95, 2.82 A)
 &rst
  ixpk= 1495, nxpk= 10, iat=  -1,2580, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2587,2588,
 &end
#
#  142 ASP  HB+         142 ASP  HN          2.80    (#   1496:10  Unique         2.25, 3.00 A)
 &rst
  ixpk= 1496, nxpk= 10, iat=  -1,2340, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2344,2345,
 &end
#
#  141 ARG  HA          142 ASP  HN          5.50    (#   1497:10  Unique         3.50, 3.52 A)
 &rst
  ixpk= 1497, nxpk= 10, iat=2318,2340, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1498     0 AMB  10-1:1498   4.20    (#   1498:10  Double Ambig)
 &rst
  ixpk= 1498, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2296,2601,2602,
 igr2=2340,2580,
 &end
#
#  156 MET  HA          156 MET  HN          2.80    (#   1499:10  Unique         2.77, 2.79 A)
 &rst
  ixpk= 1499, nxpk= 10, iat=2582,2580, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  142 ASP  HA          142 ASP  HN          3.50    (#   1500:10  Unique         2.80, 2.82 A)
 &rst
  ixpk= 1500, nxpk= 10, iat=2342,2340, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  141 ARG  HN          142 ASP  HN          3.50    (#   1502:10  Unique         2.42, 2.46 A)
 &rst
  ixpk= 1502, nxpk= 10, iat=2316,2340, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1503     0 AMB  10-1:1503   2.80    (#   1503:10  Double Ambig)
 &rst
  ixpk= 1503, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=2597,2294,
 igr2=2580,2340,
 &end
#
#  143 VAL  HN          142 ASP  HN          2.80    (#   1504:10  Unique         2.56, 2.71 A)
 &rst
  ixpk= 1504, nxpk= 10, iat=2352,2340, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  145 ARG  HN          142 ASP  HN          5.50    (#   1505:10  Unique         4.49, 4.55 A)
 &rst
  ixpk= 1505, nxpk= 10, iat=2389,2340, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  142 ASP  HN          143 VAL  HN          3.50    (#   1506:10  Unique         2.56, 2.71 A)
 &rst
  ixpk= 1506, nxpk= 10, iat=2340,2352, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  144 TYR  HN          143 VAL  HN          4.20    (#   1507:10  Unique         2.62, 2.72 A)
 &rst
  ixpk= 1507, nxpk= 10, iat=2368,2352, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  142 ASP  HA          143 VAL  HN          5.50    (#   1508:10  Unique         3.54, 3.56 A)
 &rst
  ixpk= 1508, nxpk= 10, iat=2342,2352, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  140 LYS  HA          143 VAL  HN          5.50    (#   1509:10  Unique         3.25, 3.42 A)
 &rst
  ixpk= 1509, nxpk= 10, iat=2296,2352, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  143 VAL  HA          143 VAL  HN          3.50    (#   1510:10  Unique         2.80, 2.81 A)
 &rst
  ixpk= 1510, nxpk= 10, iat=2354,2352, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  142 ASP  HB+         143 VAL  HN          3.50    (#   1511:10  Unique         2.37, 3.05 A)
 &rst
  ixpk= 1511, nxpk= 10, iat=  -1,2352, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2344,2345,
 &end
#
#  143 VAL  HB          143 VAL  HN          2.80    (#   1512:10  Unique         2.62, 2.68 A)
 &rst
  ixpk= 1512, nxpk= 10, iat=2356,2352, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  143 VAL  MGY         143 VAL  HN          2.80    (#   1513:10  Unique         1.81, 3.65 A)
 &rst
  ixpk= 1513, nxpk= 10, iat=  -1,2352, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#  143 VAL  MGY         144 TYR  HN          3.50    (#   1514:10  Unique         1.83, 3.43 A)
 &rst
  ixpk= 1514, nxpk= 10, iat=  -1,2368, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2358,2359,2360,2362,2363,2364,
 &end
#
#    0 AMB  10-2:1515   144 TYR  HN          4.20    (#   1515:10  Single Ambig)
 &rst
  ixpk= 1515, nxpk= 10, iat=  -1,2368, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2356,2235,
 &end
#
#  144 TYR  HB-         144 TYR  HN          4.20    (#   1516:10  Unique         2.07, 2.80 A)
 &rst
  ixpk= 1516, nxpk= 10, iat=  -1,2368, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2372,2373,
 &end
#
#  142 ASP  HB+         144 TYR  HN          5.50    (#   1517:10  Unique         4.85, 5.37 A)
 &rst
  ixpk= 1517, nxpk= 10, iat=  -1,2368, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2344,2345,
 &end
#
#  144 TYR  HB+         144 TYR  HN          4.20    (#   1518:10  Unique         2.07, 2.80 A)
 &rst
  ixpk= 1518, nxpk= 10, iat=  -1,2368, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2372,2373,
 &end
#
#  141 ARG  HA          144 TYR  HN          5.50    (#   1519:10  Unique         3.48, 3.65 A)
 &rst
  ixpk= 1519, nxpk= 10, iat=2318,2368, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  144 TYR  HA          144 TYR  HN          4.20    (#   1520:10  Unique         2.80, 2.83 A)
 &rst
  ixpk= 1520, nxpk= 10, iat=2370,2368, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  144 TYR  HD          144 TYR  HN          3.50    (#   1521:10  Unique         2.44, 3.94 A)
 &rst
  ixpk= 1521, nxpk= 10, iat=  -1,2368, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2376,2385,
 &end
#
#  144 TYR  HE          144 TYR  HN          5.50    (#   1522:10  Unique         4.88, 5.92 A)
 &rst
  ixpk= 1522, nxpk= 10, iat=  -1,2368, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2378,2383,
 &end
#
#  143 VAL  HN          144 TYR  HN          4.20    (#   1523:10  Unique         2.62, 2.72 A)
 &rst
  ixpk= 1523, nxpk= 10, iat=2352,2368, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  145 ARG  HN          144 TYR  HN          4.20    (#   1524:10  Unique         2.51, 2.56 A)
 &rst
  ixpk= 1524, nxpk= 10, iat=2389,2368, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  144 TYR  HN          145 ARG  HN          4.20    (#   1525:10  Unique         2.51, 2.56 A)
 &rst
  ixpk= 1525, nxpk= 10, iat=2368,2389, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1526   145 ARG  HN          5.50    (#   1526:10  Single Ambig)
 &rst
  ixpk= 1526, nxpk= 10, iat=  -1,2389, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2340,2453,
 &end
#
#  146 ARG  HN          145 ARG  HN          4.20    (#   1527:10  Unique         2.49, 2.55 A)
 &rst
  ixpk= 1527, nxpk= 10, iat=2413,2389, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  144 TYR  HD          145 ARG  HN          5.50    (#   1528:10  Unique         4.68, 5.25 A)
 &rst
  ixpk= 1528, nxpk= 10, iat=  -1,2389, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2376,2385,
 &end
#
#  142 ASP  HA          145 ARG  HN          5.50    (#   1530:10  Unique         3.43, 3.52 A)
 &rst
  ixpk= 1530, nxpk= 10, iat=2342,2389, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  145 ARG  HA          145 ARG  HN          3.50    (#   1531:10  Unique         2.81, 2.84 A)
 &rst
  ixpk= 1531, nxpk= 10, iat=2391,2389, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  146 ARG  HD+         145 ARG  HN          5.50    (#   1532:10  Unique         4.28, 4.78 A)
 &rst
  ixpk= 1532, nxpk= 10, iat=  -1,2389, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2423,2424,
 &end
#
#    0 AMB  10-2:1533   145 ARG  HN          5.50    (#   1533:10  Single Ambig)
 &rst
  ixpk= 1533, nxpk= 10, iat=  -1,2389, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2344,2345,2439,
 &end
#
#  145 ARG  HB+         145 ARG  HN          2.80    (#   1534:10  Unique         2.15, 2.70 A)
 &rst
  ixpk= 1534, nxpk= 10, iat=  -1,2389, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2393,2394,
 &end
#
#    0 AMB  10-2:1535   145 ARG  HN          4.20    (#   1535:10  Single Ambig)
 &rst
  ixpk= 1535, nxpk= 10, iat=  -1,2389, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=2396,2397,2323,2324,
 &end
#
#  145 ARG  HG-         145 ARG  HN          5.50    (#   1536:10  Unique         2.79, 3.96 A)
 &rst
  ixpk= 1536, nxpk= 10, iat=  -1,2389, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2396,2397,
 &end
#
#    0 AMB  10-2:1537   145 ARG  HN          4.20    (#   1537:10  Single Ambig)
 &rst
  ixpk= 1537, nxpk= 10, iat=  -1,2389, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,2358,2359,2360,2362,2363,2364,
 &end
#
#    0 AMB  10-2:1538   146 ARG  HN          3.50    (#   1538:10  Single Ambig)
 &rst
  ixpk= 1538, nxpk= 10, iat=  -1,2413, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1189,1190,1191,1193,1194,1195,2180,2181,2182,2184,
      2185,2186,2358,2359,2360,2362,2363,2364,
 &end
#
#  147 VAL  HB          146 ARG  HN          5.50    (#   1539:10  Unique         4.60, 4.92 A)
 &rst
  ixpk= 1539, nxpk= 10, iat=2441,2413, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1540     0 AMB  10-1:1540   2.80    (#   1540:10  Double Ambig)
 &rst
  ixpk= 1540, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.44, r4= 5.19,
 igr1=2396,2397,2323,2324,2320,2321,2457,2458,
 igr2=2413,2274,
 &end
#
#  146 ARG  HB+         146 ARG  HN          2.80    (#   1541:10  Unique         2.10, 2.78 A)
 &rst
  ixpk= 1541, nxpk= 10, iat=  -1,2413, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2417,2418,
 &end
#
#  147 VAL  HA          146 ARG  HN          5.50    (#   1542:10  Unique         5.17, 5.21 A)
 &rst
  ixpk= 1542, nxpk= 10, iat=2439,2413, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  146 ARG  HD+         146 ARG  HN          3.50    (#   1543:10  Unique         2.41, 3.04 A)
 &rst
  ixpk= 1543, nxpk= 10, iat=  -1,2413, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2423,2424,
 &end
#
#  143 VAL  HA          146 ARG  HN          5.50    (#   1544:10  Unique         3.42, 3.56 A)
 &rst
  ixpk= 1544, nxpk= 10, iat=2354,2413, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  146 ARG  HA          146 ARG  HN          2.80    (#   1545:10  Unique         2.83, 2.85 A)
 &rst
  ixpk= 1545, nxpk= 10, iat=2415,2413, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  147 VAL  HN          146 ARG  HN          3.50    (#   1546:10  Unique         2.55, 2.60 A)
 &rst
  ixpk= 1546, nxpk= 10, iat=2437,2413, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  138 SER  HN          139 PHE  HN          5.50    (#   1547:10  Unique         2.44, 2.59 A)
 &rst
  ixpk= 1547, nxpk= 10, iat=2263,2274, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  145 ARG  HN          146 ARG  HN          3.50    (#   1548:10  Unique         2.49, 2.55 A)
 &rst
  ixpk= 1548, nxpk= 10, iat=2389,2413, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  146 ARG  HN          147 VAL  HN          3.50    (#   1550:10  Unique         2.55, 2.60 A)
 &rst
  ixpk= 1550, nxpk= 10, iat=2413,2437, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1551   147 VAL  HN          5.50    (#   1551:10  Single Ambig)
 &rst
  ixpk= 1551, nxpk= 10, iat=  -1,2437, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=2376,2385,1629,2515,2523,
 &end
#
#  146 ARG  HA          147 VAL  HN          5.50    (#   1552:10  Unique         3.54, 3.55 A)
 &rst
  ixpk= 1552, nxpk= 10, iat=2415,2437, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  144 TYR  HA          147 VAL  HN          4.20    (#   1553:10  Unique         3.36, 3.59 A)
 &rst
  ixpk= 1553, nxpk= 10, iat=2370,2437, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1554   147 VAL  HN          5.50    (#   1554:10  Single Ambig)
 &rst
  ixpk= 1554, nxpk= 10, iat=  -1,2437, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2423,2424,2511,2512,
 &end
#
#  147 VAL  HA          147 VAL  HN          4.20    (#   1555:10  Unique         2.78, 2.79 A)
 &rst
  ixpk= 1555, nxpk= 10, iat=2439,2437, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1556   147 VAL  HN          5.50    (#   1556:10  Single Ambig)
 &rst
  ixpk= 1556, nxpk= 10, iat=  -1,2437, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2460,2461,2474,2475,
 &end
#
#  146 ARG  HB+         147 VAL  HN          2.80    (#   1557:10  Unique         2.70, 2.92 A)
 &rst
  ixpk= 1557, nxpk= 10, iat=  -1,2437, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2417,2418,
 &end
#
#    0 AMB  10-2:1558   147 VAL  HN          5.50    (#   1558:10  Single Ambig)
 &rst
  ixpk= 1558, nxpk= 10, iat=  -1,2437, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2457,2458,2420,2421,2496,2497,
 &end
#
#  147 VAL  HB          147 VAL  HN          2.80    (#   1559:10  Unique         2.44, 2.56 A)
 &rst
  ixpk= 1559, nxpk= 10, iat=2441,2437, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1560   147 VAL  HN          3.50    (#   1560:10  Single Ambig)
 &rst
  ixpk= 1560, nxpk= 10, iat=  -1,2437, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1189,1190,1191,1193,1194,1195,2358,2359,2360,2362,
      2363,2364,
 &end
#
#  147 VAL  MGX         147 VAL  HN          3.50    (#   1561:10  Unique         1.93, 3.74 A)
 &rst
  ixpk= 1561, nxpk= 10, iat=  -1,2437, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  MGY         147 VAL  HN          2.80    (#   1562:10  Unique         1.93, 3.74 A)
 &rst
  ixpk= 1562, nxpk= 10, iat=  -1,2437, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  MGY         148 MET  HN          4.20    (#   1563:10  Unique         1.94, 3.91 A)
 &rst
  ixpk= 1563, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#  147 VAL  MGX         148 MET  HN          4.20    (#   1564:10  Unique         1.94, 3.91 A)
 &rst
  ixpk= 1564, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  10-2:1565   148 MET  HN          4.20    (#   1565:10  Single Ambig)
 &rst
  ixpk= 1565, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=2180,2181,2182,2184,2185,2186,2180,2181,2182,2184,
      2185,2186,2358,2359,2360,2362,2363,2364,
 &end
#
#  147 VAL  HB          148 MET  HN          3.50    (#   1566:10  Unique         2.52, 3.29 A)
 &rst
  ixpk= 1566, nxpk= 10, iat=2441,2453, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  148 MET  ME          148 MET  HN          4.20    (#   1567:10  Unique         4.46, 5.46 A)
 &rst
  ixpk= 1567, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=2464,2465,2466,
 &end
#
#  148 MET  HB+         148 MET  HN          4.20    (#   1568:10  Unique         2.27, 3.03 A)
 &rst
  ixpk= 1568, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2457,2458,
 &end
#
#    0 AMB  10-2:1569   148 MET  HN          4.20    (#   1569:10  Single Ambig)
 &rst
  ixpk= 1569, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 5.49, r4= 6.24,
 igr1=2496,2497,2420,2421,1187,
 &end
#
#  148 MET  HG-         148 MET  HN          3.50    (#   1570:10  Unique         2.20, 3.04 A)
 &rst
  ixpk= 1570, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2460,2461,
 &end
#
#  148 MET  HG+         148 MET  HN          4.20    (#   1571:10  Unique         2.20, 3.04 A)
 &rst
  ixpk= 1571, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2460,2461,
 &end
#
#  147 VAL  HA          148 MET  HN          5.50    (#   1572:10  Unique         3.54, 3.55 A)
 &rst
  ixpk= 1572, nxpk= 10, iat=2439,2453, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  145 ARG  HA          148 MET  HN          5.50    (#   1573:10  Unique         3.74, 3.81 A)
 &rst
  ixpk= 1573, nxpk= 10, iat=2391,2453, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  148 MET  HA          148 MET  HN          5.50    (#   1574:10  Unique         2.84, 2.87 A)
 &rst
  ixpk= 1574, nxpk= 10, iat=2455,2453, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1575   148 MET  HN          5.50    (#   1575:10  Single Ambig)
 &rst
  ixpk= 1575, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2130,2214,
 &end
#
#    0 AMB  10-2:1576   148 MET  HN          4.20    (#   1576:10  Single Ambig)
 &rst
  ixpk= 1576, nxpk= 10, iat=  -1,2453, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2413,2527,
 &end
#
#  149 LYS  HN          148 MET  HN          2.80    (#   1577:10  Unique         2.36, 2.44 A)
 &rst
  ixpk= 1577, nxpk= 10, iat=2470,2453, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  150 GLU  HN          149 LYS  HN          4.20    (#   1578:10  Unique         2.52, 2.55 A)
 &rst
  ixpk= 1578, nxpk= 10, iat=2492,2470, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  149 LYS  HA          149 LYS  HN          5.50    (#   1579:10  Unique         2.82, 2.84 A)
 &rst
  ixpk= 1579, nxpk= 10, iat=2472,2470, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  149 LYS  HB-         149 LYS  HN          3.50    (#   1581:10  Unique         2.09, 2.55 A)
 &rst
  ixpk= 1581, nxpk= 10, iat=  -1,2470, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2474,2475,
 &end
#
#  149 LYS  HB+         149 LYS  HN          2.80    (#   1582:10  Unique         2.09, 2.55 A)
 &rst
  ixpk= 1582, nxpk= 10, iat=  -1,2470, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2474,2475,
 &end
#
#    0 AMB  10-2:1583   149 LYS  HN          4.20    (#   1583:10  Single Ambig)
 &rst
  ixpk= 1583, nxpk= 10, iat=  -1,2470, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2457,2458,2477,2478,2480,2481,
 &end
#
#    0 AMB  10-2:1584   149 LYS  HN          5.50    (#   1584:10  Single Ambig)
 &rst
  ixpk= 1584, nxpk= 10, iat=  -1,2470, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1=2477,2478,2396,2397,2531,2532,2533,
 &end
#
#  147 VAL  MGX         150 GLU  HN          5.50    (#   1585:10  Unique         4.61, 6.22 A)
 &rst
  ixpk= 1585, nxpk= 10, iat=  -1,2492, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#  150 GLU  HB-         150 GLU  HN          2.80    (#   1586:10  Unique         2.07, 2.74 A)
 &rst
  ixpk= 1586, nxpk= 10, iat=  -1,2492, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2496,2497,
 &end
#
#  150 GLU  HB+         150 GLU  HN          2.80    (#   1587:10  Unique         2.07, 2.74 A)
 &rst
  ixpk= 1587, nxpk= 10, iat=  -1,2492, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2496,2497,
 &end
#
#  150 GLU  HG-         150 GLU  HN          3.80    (#   1588:10  Unique         3.02, 3.98 A)
 &rst
  ixpk= 1588, nxpk= 10, iat=  -1,2492, r1= 0.00, r2= 1.80, r3= 4.27, r4= 5.02,
 igr1=2499,2500,
 &end
#
#  150 GLU  HG+         150 GLU  HN          4.20    (#   1589:10  Unique         3.02, 3.98 A)
 &rst
  ixpk= 1589, nxpk= 10, iat=  -1,2492, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2499,2500,
 &end
#
#  147 VAL  HA          150 GLU  HN          5.50    (#   1590:10  Unique         3.58, 3.82 A)
 &rst
  ixpk= 1590, nxpk= 10, iat=2439,2492, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HB+         150 GLU  HN          5.50    (#   1591:10  Unique         4.59, 5.34 A)
 &rst
  ixpk= 1591, nxpk= 10, iat=  -1,2492, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2511,2512,
 &end
#
#  150 GLU  HA          150 GLU  HN          3.50    (#   1592:10  Unique         2.79, 2.87 A)
 &rst
  ixpk= 1592, nxpk= 10, iat=2494,2492, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  149 LYS  HA          150 GLU  HN          5.50    (#   1593:10  Unique         3.50, 3.52 A)
 &rst
  ixpk= 1593, nxpk= 10, iat=2472,2492, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HD          150 GLU  HN          5.50    (#   1594:10  Unique         4.94, 5.43 A)
 &rst
  ixpk= 1594, nxpk= 10, iat=  -1,2492, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#  149 LYS  HN          150 GLU  HN          3.50    (#   1595:10  Unique         2.52, 2.55 A)
 &rst
  ixpk= 1595, nxpk= 10, iat=2470,2492, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  147 VAL  HN          150 GLU  HN          5.50    (#   1596:10  Unique         4.90, 5.05 A)
 &rst
  ixpk= 1596, nxpk= 10, iat=2437,2492, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  152 ALA  MB          152 ALA  HN          2.80    (#   1597:10  Unique         2.10, 2.88 A)
 &rst
  ixpk= 1597, nxpk= 10, iat=  -1,2527, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=2531,2532,2533,
 &end
#
#  151 PHE  HB+         152 ALA  HN          5.50    (#   1598:10  Unique         2.62, 3.26 A)
 &rst
  ixpk= 1598, nxpk= 10, iat=  -1,2527, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2511,2512,
 &end
#
#  152 ALA  HA          152 ALA  HN          3.50    (#   1599:10  Unique         2.76, 2.80 A)
 &rst
  ixpk= 1599, nxpk= 10, iat=2529,2527, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  150 GLU  HA          152 ALA  HN          5.50    (#   1600:10  Unique         3.97, 4.42 A)
 &rst
  ixpk= 1600, nxpk= 10, iat=2494,2527, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HA          152 ALA  HN          5.50    (#   1602:10  Unique         3.40, 3.51 A)
 &rst
  ixpk= 1602, nxpk= 10, iat=2509,2527, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HD          152 ALA  HN          5.50    (#   1604:10  Unique         4.80, 4.97 A)
 &rst
  ixpk= 1604, nxpk= 10, iat=  -1,2527, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#  151 PHE  HN          152 ALA  HN          2.80    (#   1605:10  Unique         2.23, 2.46 A)
 &rst
  ixpk= 1605, nxpk= 10, iat=2507,2527, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  153 SER  HN          152 ALA  HN          4.20    (#   1606:10  Unique         2.50, 2.66 A)
 &rst
  ixpk= 1606, nxpk= 10, iat=2537,2527, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  152 ALA  HN          153 SER  HN          2.80    (#   1608:10  Unique         2.50, 2.66 A)
 &rst
  ixpk= 1608, nxpk= 10, iat=2527,2537, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  154 VAL  HN          153 SER  HN          2.80    (#   1609:10  Unique         2.46, 2.62 A)
 &rst
  ixpk= 1609, nxpk= 10, iat=2548,2537, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1612   153 SER  HN          2.80    (#   1612:10  Single Ambig)
 &rst
  ixpk= 1612, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2539,2494,
 &end
#
#  153 SER  HB+         153 SER  HN          2.80    (#   1613:10  Unique         2.15, 2.64 A)
 &rst
  ixpk= 1613, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2541,2542,
 &end
#
#  152 ALA  HA          153 SER  HN          4.20    (#   1614:10  Unique         3.41, 3.44 A)
 &rst
  ixpk= 1614, nxpk= 10, iat=2529,2537, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1615   153 SER  HN          5.50    (#   1615:10  Single Ambig)
 &rst
  ixpk= 1615, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2584,2585,2474,2475,
 &end
#
#    0 AMB  10-2:1616   153 SER  HN          5.50    (#   1616:10  Single Ambig)
 &rst
  ixpk= 1616, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2550,2096,
 &end
#
#    0 AMB  10-2:1617   153 SER  HN          2.80    (#   1617:10  Single Ambig)
 &rst
  ixpk= 1617, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=2531,2532,2533,2568,
 &end
#
#    0 AMB  10-2:1618   153 SER  HN          4.20    (#   1618:10  Single Ambig)
 &rst
  ixpk= 1618, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=2554,2555,2556,2558,2559,2560,2570,2571,2572,2574,
      2575,2576,
 &end
#
#  154 VAL  MGY         153 SER  HN          5.50    (#   1619:10  Unique         3.40, 5.91 A)
 &rst
  ixpk= 1619, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2554,2555,2556,2558,2559,2560,
 &end
#
#  101 LEU  MDY         153 SER  HN          5.50    (#   1620:10  Unique         5.01, 7.26 A)
 &rst
  ixpk= 1620, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#  101 LEU  MDY         154 VAL  HN          4.20    (#   1621:10  Unique         3.58, 5.84 A)
 &rst
  ixpk= 1621, nxpk= 10, iat=  -1,2548, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#  154 VAL  MGY         154 VAL  HN          2.80    (#   1622:10  Unique         1.76, 3.61 A)
 &rst
  ixpk= 1622, nxpk= 10, iat=  -1,2548, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2554,2555,2556,2558,2559,2560,
 &end
#
#  154 VAL  MGX         154 VAL  HN          2.80    (#   1623:10  Unique         1.76, 3.61 A)
 &rst
  ixpk= 1623, nxpk= 10, iat=  -1,2548, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2554,2555,2556,2558,2559,2560,
 &end
#
#    0 AMB  10-2:1625   154 VAL  HN          4.20    (#   1625:10  Single Ambig)
 &rst
  ixpk= 1625, nxpk= 10, iat=  -1,2548, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2568,2531,2532,2533,2477,2478,
 &end
#
#    0 AMB  10-2:1626   154 VAL  HN          5.50    (#   1626:10  Single Ambig)
 &rst
  ixpk= 1626, nxpk= 10, iat=  -1,2548, r1= 0.00, r2= 1.80, r3= 7.61, r4= 8.36,
 igr1=2612,2613,2477,2478,2480,2481,2615,
 &end
#
#  154 VAL  HB          154 VAL  HN          2.80    (#   1627:10  Unique         2.39, 2.78 A)
 &rst
  ixpk= 1627, nxpk= 10, iat=2552,2548, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  152 ALA  HA          154 VAL  HN          5.50    (#   1628:10  Unique         3.91, 4.14 A)
 &rst
  ixpk= 1628, nxpk= 10, iat=2529,2548, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  154 VAL  HA          154 VAL  HN          3.50    (#   1629:10  Unique         2.81, 2.84 A)
 &rst
  ixpk= 1629, nxpk= 10, iat=2550,2548, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  153 SER  HB+         154 VAL  HN          3.50    (#   1630:10  Unique         2.47, 3.32 A)
 &rst
  ixpk= 1630, nxpk= 10, iat=  -1,2548, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2541,2542,
 &end
#
#    0 AMB  10-2:1631   154 VAL  HN          4.20    (#   1631:10  Single Ambig)
 &rst
  ixpk= 1631, nxpk= 10, iat=  -1,2548, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2539,2494,
 &end
#
#  151 PHE  HA          154 VAL  HN          5.50    (#   1633:10  Unique         3.30, 3.55 A)
 &rst
  ixpk= 1633, nxpk= 10, iat=2509,2548, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  151 PHE  HD          154 VAL  HN          5.50    (#   1634:10  Unique         5.17, 6.55 A)
 &rst
  ixpk= 1634, nxpk= 10, iat=  -1,2548, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2515,2523,
 &end
#
#  156 MET  HN          154 VAL  HN          5.50    (#   1635:10  Unique         3.98, 4.13 A)
 &rst
  ixpk= 1635, nxpk= 10, iat=2580,2548, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  153 SER  HN          154 VAL  HN          3.50    (#   1636:10  Unique         2.46, 2.62 A)
 &rst
  ixpk= 1636, nxpk= 10, iat=2537,2548, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  153 SER  HN          155 VAL  HN          5.50    (#   1637:10  Unique         3.89, 4.14 A)
 &rst
  ixpk= 1637, nxpk= 10, iat=2537,2564, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  156 MET  HN          155 VAL  HN          3.50    (#   1638:10  Unique         2.66, 2.73 A)
 &rst
  ixpk= 1638, nxpk= 10, iat=2580,2564, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1640   155 VAL  HN          5.50    (#   1640:10  Single Ambig)
 &rst
  ixpk= 1640, nxpk= 10, iat=  -1,2564, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2582,2610,
 &end
#
#    0 AMB  10-2:1641   155 VAL  HN          5.50    (#   1641:10  Single Ambig)
 &rst
  ixpk= 1641, nxpk= 10, iat=  -1,2564, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2541,2542, 301, 302,
 &end
#
#  154 VAL  HA          155 VAL  HN          5.50    (#   1642:10  Unique         3.51, 3.53 A)
 &rst
  ixpk= 1642, nxpk= 10, iat=2550,2564, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  155 VAL  HA          155 VAL  HN          3.50    (#   1643:10  Unique         2.76, 2.78 A)
 &rst
  ixpk= 1643, nxpk= 10, iat=2566,2564, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  154 VAL  HB          155 VAL  HN          2.80    (#   1644:10  Unique         2.36, 2.73 A)
 &rst
  ixpk= 1644, nxpk= 10, iat=2552,2564, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1645   155 VAL  HN          2.80    (#   1645:10  Single Ambig)
 &rst
  ixpk= 1645, nxpk= 10, iat=  -1,2564, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=2568,2612,2613,
 &end
#
#    0 AMB  10-2:1646   155 VAL  HN          2.80    (#   1646:10  Single Ambig)
 &rst
  ixpk= 1646, nxpk= 10, iat=  -1,2564, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=2570,2571,2572,2574,2575,2576,2554,2555,2556,2558,
      2559,2560,
 &end
#
#    0 AMB  10-2:1647   155 VAL  HN          2.80    (#   1647:10  Single Ambig)
 &rst
  ixpk= 1647, nxpk= 10, iat=  -1,2564, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=2570,2571,2572,2574,2575,2576,2554,2555,2556,2558,
      2559,2560,
 &end
#
#  156 MET  HN          157 SER  HN          2.80    (#   1649:10  Unique         2.60, 2.70 A)
 &rst
  ixpk= 1649, nxpk= 10, iat=2580,2597, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  158 LEU  HN          157 SER  HN          2.80    (#   1650:10  Unique         2.48, 2.61 A)
 &rst
  ixpk= 1650, nxpk= 10, iat=2608,2597, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  157 SER  HA          157 SER  HN          2.80    (#   1652:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 1652, nxpk= 10, iat=2599,2597, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1653   157 SER  HN          3.50    (#   1653:10  Single Ambig)
 &rst
  ixpk= 1653, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2582,2610,
 &end
#
#  157 SER  HB+         157 SER  HN          2.80    (#   1654:10  Unique         2.24, 2.95 A)
 &rst
  ixpk= 1654, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2601,2602,
 &end
#
#  154 VAL  HA          157 SER  HN          4.20    (#   1655:10  Unique         3.32, 3.50 A)
 &rst
  ixpk= 1655, nxpk= 10, iat=2550,2597, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  155 VAL  HA          157 SER  HN          5.50    (#   1656:10  Unique         3.75, 4.03 A)
 &rst
  ixpk= 1656, nxpk= 10, iat=2566,2597, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  156 MET  HG+         157 SER  HN          5.50    (#   1657:10  Unique         3.99, 4.64 A)
 &rst
  ixpk= 1657, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2587,2588,
 &end
#
#  156 MET  HG-         157 SER  HN          5.50    (#   1658:10  Unique         3.99, 4.64 A)
 &rst
  ixpk= 1658, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2587,2588,
 &end
#
#  156 MET  HB+         157 SER  HN          2.80    (#   1659:10  Unique         2.60, 3.32 A)
 &rst
  ixpk= 1659, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2584,2585,
 &end
#
#    0 AMB  10-2:1660   157 SER  HN          4.20    (#   1660:10  Single Ambig)
 &rst
  ixpk= 1660, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=2612,2613,2615,
 &end
#
#    0 AMB  10-2:1661   157 SER  HN          5.50    (#   1661:10  Single Ambig)
 &rst
  ixpk= 1661, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2612,2613,2568,
 &end
#
#    0 AMB  10-2:1662   157 SER  HN          5.50    (#   1662:10  Single Ambig)
 &rst
  ixpk= 1662, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2554,2555,2556,2558,2559,2560,2570,2571,2572,2574,
      2575,2576,
 &end
#
#    0 AMB  10-2:1663   157 SER  HN          4.20    (#   1663:10  Single Ambig)
 &rst
  ixpk= 1663, nxpk= 10, iat=  -1,2597, r1= 0.00, r2= 1.80, r3= 7.13, r4= 7.88,
 igr1=2554,2555,2556,2558,2559,2560,2570,2571,2572,2574,
      2575,2576,2617,2618,2619,2621,2622,2623,2617,2618,
      2619,2621,2622,2623,
 &end
#
#    0 AMB  10-2:1665   158 LEU  HN          3.50    (#   1665:10  Single Ambig)
 &rst
  ixpk= 1665, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2570,2571,2572,2574,2575,2576,2617,2618,2619,2621,
      2622,2623,
 &end
#
#    0 AMB  10-2:1666   158 LEU  HN          5.50    (#   1666:10  Single Ambig)
 &rst
  ixpk= 1666, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2570,2571,2572,2574,2575,2576,2554,2555,2556,2558,
      2559,2560,1073,1074,1075,1077,1078,1079,
 &end
#
#  158 LEU  HB-         158 LEU  HN          2.80    (#   1667:10  Unique         2.29, 2.82 A)
 &rst
  ixpk= 1667, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2612,2613,
 &end
#
#  158 LEU  HB+         158 LEU  HN          2.80    (#   1668:10  Unique         2.29, 2.82 A)
 &rst
  ixpk= 1668, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2612,2613,
 &end
#
#  159 GLN  HB-         158 LEU  HN          5.50    (#   1669:10  Unique         4.60, 5.36 A)
 &rst
  ixpk= 1669, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2631,2632,
 &end
#
#    0 AMB  10-2:1670   158 LEU  HN          5.50    (#   1670:10  Single Ambig)
 &rst
  ixpk= 1670, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2651,2652,2634,2635,2634,2635,
 &end
#
#  155 VAL  HA          158 LEU  HN          4.20    (#   1671:10  Unique         3.30, 3.44 A)
 &rst
  ixpk= 1671, nxpk= 10, iat=2566,2608, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:1672   158 LEU  HN          3.50    (#   1672:10  Single Ambig)
 &rst
  ixpk= 1672, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2601,2602, 301, 302,
 &end
#
#    0 AMB  10-2:1673   158 LEU  HN          2.80    (#   1673:10  Single Ambig)
 &rst
  ixpk= 1673, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2610,2582,
 &end
#
#  157 SER  HA          158 LEU  HN          3.50    (#   1674:10  Unique         2.85, 2.97 A)
 &rst
  ixpk= 1674, nxpk= 10, iat=2599,2608, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1676   158 LEU  HN          2.80    (#   1676:10  Single Ambig)
 &rst
  ixpk= 1676, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=2627,2597,2668,2669,
 &end
#
#  160 GLU  HN          158 LEU  HN          5.50    (#   1677:10  Unique         2.62, 2.84 A)
 &rst
  ixpk= 1677, nxpk= 10, iat=2644,2608, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1678   158 LEU  HN          5.50    (#   1678:10  Single Ambig)
 &rst
  ixpk= 1678, nxpk= 10, iat=  -1,2608, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2659,2580,
 &end
#
#  161 ASN  HN          159 GLN  HN          5.50    (#   1679:10  Unique         4.00, 4.26 A)
 &rst
  ixpk= 1679, nxpk= 10, iat=2659,2627, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  160 GLU  HN          159 GLN  HN          2.80    (#   1680:10  Unique         2.42, 2.45 A)
 &rst
  ixpk= 1680, nxpk= 10, iat=2644,2627, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  158 LEU  HN          159 GLN  HN          2.80    (#   1681:10  Unique         2.19, 2.44 A)
 &rst
  ixpk= 1681, nxpk= 10, iat=2608,2627, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1683   159 GLN  HN          2.80    (#   1683:10  Single Ambig)
 &rst
  ixpk= 1683, nxpk= 10, iat=  -1,2627, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=2629,2610,2582,
 &end
#
#    0 AMB  10-2:1685   159 GLN  HN          2.80    (#   1685:10  Single Ambig)
 &rst
  ixpk= 1685, nxpk= 10, iat=  -1,2627, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=2634,2635,2634,2635,
 &end
#
#  159 GLN  HB-         159 GLN  HN          2.80    (#   1686:10  Unique         2.32, 2.99 A)
 &rst
  ixpk= 1686, nxpk= 10, iat=  -1,2627, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2631,2632,
 &end
#
#    0 AMB  10-2:1687   159 GLN  HN          2.80    (#   1687:10  Single Ambig)
 &rst
  ixpk= 1687, nxpk= 10, iat=  -1,2627, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=2612,2613,2615,
 &end
#
#  158 LEU  HB-         159 GLN  HN          3.50    (#   1688:10  Unique         2.05, 3.03 A)
 &rst
  ixpk= 1688, nxpk= 10, iat=  -1,2627, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2612,2613,
 &end
#
#    0 AMB  10-2:1689   159 GLN  HN          3.50    (#   1689:10  Single Ambig)
 &rst
  ixpk= 1689, nxpk= 10, iat=  -1,2627, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2570,2571,2572,2574,2575,2576,2617,2618,2619,2621,
      2622,2623,
 &end
#
#    0 AMB  10-2:1691   160 GLU  HN          5.50    (#   1691:10  Single Ambig)
 &rst
  ixpk= 1691, nxpk= 10, iat=  -1,2644, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 262, 263, 286, 287,1707,1708,
 &end
#
#  160 GLU  HB-         160 GLU  HN          2.80    (#   1692:10  Unique         2.30, 3.00 A)
 &rst
  ixpk= 1692, nxpk= 10, iat=  -1,2644, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2648,2649,
 &end
#
#    0 AMB  10-2:1693   160 GLU  HN          2.80    (#   1693:10  Single Ambig)
 &rst
  ixpk= 1693, nxpk= 10, iat=  -1,2644, r1= 0.00, r2= 1.80, r3= 3.77, r4= 4.52,
 igr1=2651,2652,2634,2635,2634,2635,
 &end
#
#  160 GLU  HB+         160 GLU  HN          2.80    (#   1694:10  Unique         2.30, 3.00 A)
 &rst
  ixpk= 1694, nxpk= 10, iat=  -1,2644, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2648,2649,
 &end
#
#  160 GLU  HG-         160 GLU  HN          2.80    (#   1695:10  Unique         2.22, 3.06 A)
 &rst
  ixpk= 1695, nxpk= 10, iat=  -1,2644, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2651,2652,
 &end
#
#    0 AMB  10-2:1696   160 GLU  HN          2.80    (#   1696:10  Single Ambig)
 &rst
  ixpk= 1696, nxpk= 10, iat=  -1,2644, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2646,2629,
 &end
#
#  158 LEU  HN          160 GLU  HN          5.50    (#   1698:10  Unique         2.62, 2.84 A)
 &rst
  ixpk= 1698, nxpk= 10, iat=2608,2644, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1699   160 GLU  HN          2.80    (#   1699:10  Single Ambig)
 &rst
  ixpk= 1699, nxpk= 10, iat=  -1,2644, r1= 0.00, r2= 1.80, r3= 3.36, r4= 4.11,
 igr1=2627,2668,2669,
 &end
#
#  161 ASN  HN          160 GLU  HN          2.80    (#   1700:10  Unique         2.15, 2.37 A)
 &rst
  ixpk= 1700, nxpk= 10, iat=2659,2644, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  160 GLU  HN          161 ASN  HN          2.80    (#   1701:10  Unique         2.15, 2.37 A)
 &rst
  ixpk= 1701, nxpk= 10, iat=2644,2659, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  162 THR  HN          161 ASN  HN          2.80    (#   1702:10  Unique         2.35, 2.61 A)
 &rst
  ixpk= 1702, nxpk= 10, iat=2673,2659, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  161 ASN  HD2+        161 ASN  HN          4.20    (#   1703:10  Unique         1.89, 2.92 A)
 &rst
  ixpk= 1703, nxpk= 10, iat=  -1,2659, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2668,2669,
 &end
#
#  161 ASN  HD2-        161 ASN  HN          5.50    (#   1705:10  Unique         1.89, 2.92 A)
 &rst
  ixpk= 1705, nxpk= 10, iat=  -1,2659, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2668,2669,
 &end
#
#  163 PRO  HA          161 ASN  HN          5.81    (#   1707:10  Unique         7.44, 7.81 A)
 &rst
  ixpk= 1707, nxpk= 10, iat=2697,2659, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,  &end
#
#  162 THR  HA          161 ASN  HN          5.50    (#   1708:10  Unique         4.61, 5.00 A)
 &rst
  ixpk= 1708, nxpk= 10, iat=2675,2659, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1709   161 ASN  HN          3.50    (#   1709:10  Single Ambig)
 &rst
  ixpk= 1709, nxpk= 10, iat=  -1,2659, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2646,2629,
 &end
#
#  161 ASN  HB+         161 ASN  HN          2.80    (#   1710:10  Unique         2.14, 2.98 A)
 &rst
  ixpk= 1710, nxpk= 10, iat=  -1,2659, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2663,2664,
 &end
#
#  161 ASN  HB-         161 ASN  HN          2.80    (#   1711:10  Unique         2.14, 2.98 A)
 &rst
  ixpk= 1711, nxpk= 10, iat=  -1,2659, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2663,2664,
 &end
#
#  160 GLU  HG+         161 ASN  HN          4.20    (#   1712:10  Unique         2.27, 4.45 A)
 &rst
  ixpk= 1712, nxpk= 10, iat=  -1,2659, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2651,2652,
 &end
#
#    0 AMB  10-2:1713   161 ASN  HN          4.20    (#   1713:10  Single Ambig)
 &rst
  ixpk= 1713, nxpk= 10, iat=  -1,2659, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=2631,2632,2584,2585,2691,2692,
 &end
#
#   18 ARG  HG-         161 ASN  HN          5.50    (#   1714:10  Unique         6.56, 8.32 A)
 &rst
  ixpk= 1714, nxpk= 10, iat=  -1,2659, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 265, 266,
 &end
#
#  162 THR  MG2         162 THR  HN          4.20    (#   1717:10  Unique         2.75, 3.94 A)
 &rst
  ixpk= 1717, nxpk= 10, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=2679,2680,2681,
 &end
#
#    0 AMB  10-2:1718     0 AMB  10-1:1718   4.20    (#   1718:10  Double Ambig)
 &rst
  ixpk= 1718, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1= 817, 818, 829, 830,2648,2649,
 igr2= 765,2673,
 &end
#
#    0 AMB  10-2:1719   162 THR  HN          5.50    (#   1719:10  Single Ambig)
 &rst
  ixpk= 1719, nxpk= 10, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2651,2652,2634,2635,2694,2695,
 &end
#
#    0 AMB  10-2:1720     0 AMB  10-1:1720   3.50    (#   1720:10  Double Ambig)
 &rst
  ixpk= 1720, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 769, 770,2663,2664,
 igr2= 765,2673,
 &end
#
#  163 PRO  HD-         162 THR  HN          5.50    (#   1721:10  Unique         4.47, 4.89 A)
 &rst
  ixpk= 1721, nxpk= 10, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2688,2689,
 &end
#
#  163 PRO  HD+         162 THR  HN          5.50    (#   1722:10  Unique         4.47, 4.89 A)
 &rst
  ixpk= 1722, nxpk= 10, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2688,2689,
 &end
#
#  162 THR  HB          162 THR  HN          3.50    (#   1723:10  Unique         3.53, 3.64 A)
 &rst
  ixpk= 1723, nxpk= 10, iat=2677,2673, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1724     0 AMB  10-1:1724   5.50    (#   1724:10  Double Ambig)
 &rst
  ixpk= 1724, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2697, 604, 605,
 igr2=2673, 765,
 &end
#
#  162 THR  HA          162 THR  HN          3.50    (#   1725:10  Unique         2.28, 2.87 A)
 &rst
  ixpk= 1725, nxpk= 10, iat=2675,2673, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  161 ASN  HN          162 THR  HN          2.80    (#   1728:10  Unique         2.35, 2.61 A)
 &rst
  ixpk= 1728, nxpk= 10, iat=2659,2673, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  164 LYS  HA          164 LYS  HN          3.50    (#   1729:10  Unique         2.77, 2.87 A)
 &rst
  ixpk= 1729, nxpk= 10, iat=2703,2701, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  163 PRO  HA          164 LYS  HN          2.80    (#   1730:10  Unique         2.16, 2.43 A)
 &rst
  ixpk= 1730, nxpk= 10, iat=2697,2701, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  163 PRO  HD+         164 LYS  HN          5.50    (#   1731:10  Unique         5.00, 5.36 A)
 &rst
  ixpk= 1731, nxpk= 10, iat=  -1,2701, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2688,2689,
 &end
#
#  163 PRO  HB+         164 LYS  HN          5.50    (#   1732:10  Unique         2.11, 3.42 A)
 &rst
  ixpk= 1732, nxpk= 10, iat=  -1,2701, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2694,2695,
 &end
#
#  163 PRO  HB-         164 LYS  HN          5.50    (#   1733:10  Unique         2.11, 3.42 A)
 &rst
  ixpk= 1733, nxpk= 10, iat=  -1,2701, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2694,2695,
 &end
#
#  164 LYS  HB+         164 LYS  HN          5.50    (#   1734:10  Unique         2.23, 3.18 A)
 &rst
  ixpk= 1734, nxpk= 10, iat=  -1,2701, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2705,2706,
 &end
#
#    0 AMB  10-2:1735   164 LYS  HN          3.50    (#   1735:10  Single Ambig)
 &rst
  ixpk= 1735, nxpk= 10, iat=  -1,2701, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2711,2712,2705,2706,
 &end
#
#  164 LYS  HG+         164 LYS  HN          4.20    (#   1736:10  Unique         1.95, 3.16 A)
 &rst
  ixpk= 1736, nxpk= 10, iat=  -1,2701, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2708,2709,
 &end
#
#   39 GLY  HN           10 ASN  HD2-        5.50    (#   1739:10  Unique         4.96, 5.43 A)
 &rst
  ixpk= 1739, nxpk= 10, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 151, 152,
 &end
#
#   39 GLY  HN           10 ASN  HD2+        5.50    (#   1740:10  Unique         4.96, 5.43 A)
 &rst
  ixpk= 1740, nxpk= 10, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 151, 152,
 &end
#
#   10 ASN  HA           10 ASN  HD2+        5.50    (#   1741:10  Unique         2.20, 3.07 A)
 &rst
  ixpk= 1741, nxpk= 10, iat= 144,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 151, 152,
 &end
#
#   10 ASN  HA           10 ASN  HD2-        4.20    (#   1742:10  Unique         2.20, 3.07 A)
 &rst
  ixpk= 1742, nxpk= 10, iat= 144,  -1, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr2= 151, 152,
 &end
#
#   39 GLY  HA+          10 ASN  HD2+        5.50    (#   1743:10  Unique         3.17, 4.01 A)
 &rst
  ixpk= 1743, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 611, 612,
 igr2= 151, 152,
 &end
#
#   39 GLY  HA+          10 ASN  HD2-        5.50    (#   1744:10  Unique         3.17, 4.01 A)
 &rst
  ixpk= 1744, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 611, 612,
 igr2= 151, 152,
 &end
#
#   39 GLY  HA-          10 ASN  HD2-        5.50    (#   1745:10  Unique         3.17, 4.01 A)
 &rst
  ixpk= 1745, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 611, 612,
 igr2= 151, 152,
 &end
#
#   39 GLY  HA-          10 ASN  HD2+        5.50    (#   1746:10  Unique         3.17, 4.01 A)
 &rst
  ixpk= 1746, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 611, 612,
 igr2= 151, 152,
 &end
#
#   10 ASN  HB-          10 ASN  HD2+        5.50    (#   1747:10  Unique         2.46, 3.47 A)
 &rst
  ixpk= 1747, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 146, 147,
 igr2= 151, 152,
 &end
#
#   10 ASN  HB+          10 ASN  HD2+        4.20    (#   1748:10  Unique         2.46, 3.47 A)
 &rst
  ixpk= 1748, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 146, 147,
 igr2= 151, 152,
 &end
#
#   10 ASN  HB-          10 ASN  HD2-        5.50    (#   1749:10  Unique         2.46, 3.47 A)
 &rst
  ixpk= 1749, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 146, 147,
 igr2= 151, 152,
 &end
#
#   10 ASN  HB+          10 ASN  HD2-        5.50    (#   1750:10  Unique         2.46, 3.47 A)
 &rst
  ixpk= 1750, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 146, 147,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:1751     0 AMB  10-1:1751   5.50    (#   1751:10  Double Ambig)
 &rst
  ixpk= 1751, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.00, r4=11.75,
 igr1=1550,1551,1589,1590, 592, 593,1586,1587,
 igr2= 151, 152, 151, 152, 151, 152, 151, 152,
 &end
#
#    0 AMB  10-2:1752    10 ASN  HD2-        5.50    (#   1752:10  Single Ambig)
 &rst
  ixpk= 1752, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1550,1551,1589,1590, 592, 593,1586,1587,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:1753    10 ASN  HD2-        4.20    (#   1753:10  Single Ambig)
 &rst
  ixpk= 1753, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 111, 112,1547,1548,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:1754     0 AMB  10-1:1754   4.20    (#   1754:10  Double Ambig)
 &rst
  ixpk= 1754, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 111, 112,1547,1548,
 igr2= 151, 152, 151, 152,
 &end
#
#   95 GLN  HB-          10 ASN  HD2+        5.50    (#   1755:10  Unique         3.26, 4.96 A)
 &rst
  ixpk= 1755, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1547,1548,
 igr2= 151, 152,
 &end
#
#   95 GLN  HB-          10 ASN  HD2-        5.50    (#   1756:10  Unique         3.26, 4.96 A)
 &rst
  ixpk= 1756, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1547,1548,
 igr2= 151, 152,
 &end
#
#   21 GLN  HB+          17 ASN  HD2+        5.50    (#   1758:10  Unique         1.90, 3.89 A)
 &rst
  ixpk= 1758, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 310, 311,
 igr2= 253, 254,
 &end
#
#   21 GLN  HB+          17 ASN  HD2-        5.50    (#   1759:10  Unique         1.90, 3.89 A)
 &rst
  ixpk= 1759, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 310, 311,
 igr2= 253, 254,
 &end
#
#    0 AMB  10-2:1760     0 AMB  10-1:1760   2.90    (#   1760:10  Double Ambig)
 &rst
  ixpk= 1760, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.60, r4= 5.35,
 igr1=2631,2632,2648,2649,
 igr2=2639,2640,2639,2640,
 &end
#
#   21 GLN  HG-          17 ASN  HD2-        2.80    (#   1761:10  Unique         1.95, 3.97 A)
 &rst
  ixpk= 1761, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 313, 314,
 igr2= 253, 254,
 &end
#
#    0 AMB  10-2:1762     0 AMB  10-1:1762   5.50    (#   1762:10  Double Ambig)
 &rst
  ixpk= 1762, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 248, 249,2047,2048,
 igr2= 253, 254, 253, 254,
 &end
#
#    0 AMB  10-2:1763    17 ASN  HD2-        5.50    (#   1763:10  Single Ambig)
 &rst
  ixpk= 1763, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 248, 249,2047,2048,
 igr2= 253, 254,
 &end
#
#   18 ARG  HG-          19 GLN  HE2+        5.50    (#   1764:10  Unique         3.76, 5.45 A)
 &rst
  ixpk= 1764, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 265, 266,
 igr2= 294, 295,
 &end
#
#   18 ARG  HG-          19 GLN  HE2-        5.50    (#   1765:10  Unique         3.76, 5.45 A)
 &rst
  ixpk= 1765, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 265, 266,
 igr2= 294, 295,
 &end
#
#   18 ARG  HB-          19 GLN  HE2+        4.20    (#   1766:10  Unique         1.98, 3.35 A)
 &rst
  ixpk= 1766, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 262, 263,
 igr2= 294, 295,
 &end
#
#   18 ARG  HB-          19 GLN  HE2-        5.50    (#   1767:10  Unique         1.98, 3.35 A)
 &rst
  ixpk= 1767, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 262, 263,
 igr2= 294, 295,
 &end
#
#   18 ARG  HB+          19 GLN  HE2-        5.50    (#   1768:10  Unique         1.98, 3.35 A)
 &rst
  ixpk= 1768, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 262, 263,
 igr2= 294, 295,
 &end
#
#   18 ARG  HB+          19 GLN  HE2+        5.50    (#   1769:10  Unique         1.98, 3.35 A)
 &rst
  ixpk= 1769, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 262, 263,
 igr2= 294, 295,
 &end
#
#   19 GLN  HG-          19 GLN  HE2+        3.50    (#   1770:10  Unique         2.12, 3.24 A)
 &rst
  ixpk= 1770, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 289, 290,
 igr2= 294, 295,
 &end
#
#   19 GLN  HG-          19 GLN  HE2-        4.20    (#   1771:10  Unique         2.12, 3.24 A)
 &rst
  ixpk= 1771, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 289, 290,
 igr2= 294, 295,
 &end
#
#   19 GLN  HA           19 GLN  HE2-        5.50    (#   1772:10  Unique         2.77, 3.43 A)
 &rst
  ixpk= 1772, nxpk= 10, iat= 284,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 294, 295,
 &end
#
#    0 AMB  10-2:1775    30 GLN  HE2-        5.50    (#   1775:10  Single Ambig)
 &rst
  ixpk= 1775, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1= 460, 461, 503, 504, 503, 504,
 igr2= 477, 478,
 &end
#
#   30 GLN  HG+          30 GLN  HE2+        2.80    (#   1776:10  Unique         2.12, 3.20 A)
 &rst
  ixpk= 1776, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 472, 473,
 igr2= 477, 478,
 &end
#
#   30 GLN  HG+          30 GLN  HE2-        3.50    (#   1777:10  Unique         2.12, 3.20 A)
 &rst
  ixpk= 1777, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 472, 473,
 igr2= 477, 478,
 &end
#
#   30 GLN  HB-          30 GLN  HE2+        5.50    (#   1778:10  Unique         2.02, 4.25 A)
 &rst
  ixpk= 1778, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 469, 470,
 igr2= 477, 478,
 &end
#
#   30 GLN  HB-          30 GLN  HE2-        5.50    (#   1779:10  Unique         2.02, 4.25 A)
 &rst
  ixpk= 1779, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 469, 470,
 igr2= 477, 478,
 &end
#
#    0 AMB  10-2:1780     0 AMB  10-1:1780   2.80    (#   1780:10  Double Ambig)
 &rst
  ixpk= 1780, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.44, r4= 5.19,
 igr1=2634,2635,2634,2635,
 igr2=2639,2640,2639,2640,
 &end
#
#   18 ARG  HD+         103 GLN  HE2+        5.50    (#   1781:10  Unique         1.93, 3.53 A)
 &rst
  ixpk= 1781, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 268, 269,
 igr2=1715,1716,
 &end
#
#   18 ARG  HD+         103 GLN  HE2-        5.50    (#   1782:10  Unique         1.93, 3.53 A)
 &rst
  ixpk= 1782, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 268, 269,
 igr2=1715,1716,
 &end
#
#  103 GLN  HG+         103 GLN  HE2+        2.80    (#   1783:10  Unique         2.12, 3.35 A)
 &rst
  ixpk= 1783, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1710,1711,
 igr2=1715,1716,
 &end
#
#  103 GLN  HG+         103 GLN  HE2-        3.50    (#   1784:10  Unique         2.12, 3.35 A)
 &rst
  ixpk= 1784, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1710,1711,
 igr2=1715,1716,
 &end
#
#  103 GLN  HB-         103 GLN  HE2+        4.20    (#   1785:10  Unique         1.93, 3.70 A)
 &rst
  ixpk= 1785, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1707,1708,
 igr2=1715,1716,
 &end
#
#  103 GLN  HB-         103 GLN  HE2-        4.20    (#   1786:10  Unique         1.93, 3.70 A)
 &rst
  ixpk= 1786, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1707,1708,
 igr2=1715,1716,
 &end
#
#  158 LEU  MDX         103 GLN  HE2+        3.50    (#   1787:10  Unique         1.93, 3.51 A)
 &rst
  ixpk= 1787, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2617,2618,2619,2621,2622,2623,
 igr2=1715,1716,
 &end
#
#  158 LEU  MDX         103 GLN  HE2-        3.50    (#   1788:10  Unique         1.93, 3.51 A)
 &rst
  ixpk= 1788, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2617,2618,2619,2621,2622,2623,
 igr2=1715,1716,
 &end
#
#    0 AMB  10-2:1789     0 AMB  10-1:1789   5.50    (#   1789:10  Double Ambig)
 &rst
  ixpk= 1789, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1= 677, 678, 653, 654,
 igr2= 644, 645, 644, 645,
 &end
#
#   41 ASN  HB-          41 ASN  HD2+        3.50    (#   1790:10  Unique         2.12, 3.15 A)
 &rst
  ixpk= 1790, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 639, 640,
 igr2= 644, 645,
 &end
#
#   41 ASN  HB-          41 ASN  HD2-        3.50    (#   1791:10  Unique         2.12, 3.15 A)
 &rst
  ixpk= 1791, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 639, 640,
 igr2= 644, 645,
 &end
#
#   41 ASN  HB+          41 ASN  HD2+        4.20    (#   1792:10  Unique         2.12, 3.15 A)
 &rst
  ixpk= 1792, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 639, 640,
 igr2= 644, 645,
 &end
#
#   41 ASN  HB+          41 ASN  HD2-        4.20    (#   1793:10  Unique         2.12, 3.15 A)
 &rst
  ixpk= 1793, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 639, 640,
 igr2= 644, 645,
 &end
#
#   41 ASN  HN           41 ASN  HD2-        5.50    (#   1794:10  Unique         4.87, 5.11 A)
 &rst
  ixpk= 1794, nxpk= 10, iat= 635,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 644, 645,
 &end
#
#   41 ASN  HN           41 ASN  HD2+        5.50    (#   1795:10  Unique         4.87, 5.11 A)
 &rst
  ixpk= 1795, nxpk= 10, iat= 635,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 644, 645,
 &end
#
#   52 ARG  HE           41 ASN  HD2-        5.50    (#   1796:10  Unique         3.10, 4.76 A)
 &rst
  ixpk= 1796, nxpk= 10, iat= 799,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2= 644, 645,
 &end
#
#   48 GLN  HG+          48 GLN  HE2+        2.80    (#   1798:10  Unique         2.12, 3.26 A)
 &rst
  ixpk= 1798, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 728, 729,
 igr2= 733, 734,
 &end
#
#   48 GLN  HB+          48 GLN  HE2-        5.50    (#   1799:10  Unique         3.70, 4.46 A)
 &rst
  ixpk= 1799, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 725, 726,
 igr2= 733, 734,
 &end
#
#    0 AMB  10-2:1800     0 AMB  10-1:1800   2.80    (#   1800:10  Double Ambig)
 &rst
  ixpk= 1800, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.44, r4= 5.19,
 igr1=1864,1865,1867,1868,
 igr2=1872,1873,1872,1873,
 &end
#
#   48 GLN  HG+          48 GLN  HE2-        2.80    (#   1801:10  Unique         2.12, 3.26 A)
 &rst
  ixpk= 1801, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 728, 729,
 igr2= 733, 734,
 &end
#
#  114 GLN  HB-         114 GLN  HE2+        5.50    (#   1802:10  Unique         2.05, 3.50 A)
 &rst
  ixpk= 1802, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1864,1865,
 igr2=1872,1873,
 &end
#
#    0 AMB  10-2:1803     0 AMB  10-1:1803   5.50    (#   1803:10  Double Ambig)
 &rst
  ixpk= 1803, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=1931,1932, 790, 791, 793, 794,
 igr2=1872,1873, 733, 734, 733, 734,
 &end
#
#    0 AMB  10-2:1804     0 AMB  10-1:1804   5.50    (#   1804:10  Double Ambig)
 &rst
  ixpk= 1804, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1= 752, 753, 755, 756, 793, 794,
 igr2= 733, 734, 733, 734, 733, 734,
 &end
#
#   72 ARG  HB+          73 ASN  HD2+        4.20    (#   1805:10  Unique         2.26, 3.81 A)
 &rst
  ixpk= 1805, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1122,1123,
 igr2=1151,1152,
 &end
#
#   72 ARG  HB+          73 ASN  HD2-        4.20    (#   1806:10  Unique         2.26, 3.81 A)
 &rst
  ixpk= 1806, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1122,1123,
 igr2=1151,1152,
 &end
#
#   73 ASN  HB-          73 ASN  HD2+        3.50    (#   1807:10  Unique         2.21, 3.39 A)
 &rst
  ixpk= 1807, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1146,1147,
 igr2=1151,1152,
 &end
#
#   73 ASN  HB+          73 ASN  HD2+        3.50    (#   1808:10  Unique         2.21, 3.39 A)
 &rst
  ixpk= 1808, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1146,1147,
 igr2=1151,1152,
 &end
#
#   73 ASN  HB-          73 ASN  HD2-        4.20    (#   1809:10  Unique         2.21, 3.39 A)
 &rst
  ixpk= 1809, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1146,1147,
 igr2=1151,1152,
 &end
#
#   73 ASN  HB+          73 ASN  HD2-        5.50    (#   1810:10  Unique         2.21, 3.39 A)
 &rst
  ixpk= 1810, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1146,1147,
 igr2=1151,1152,
 &end
#
#   73 ASN  HA           73 ASN  HD2+        5.50    (#   1811:10  Unique         2.93, 3.84 A)
 &rst
  ixpk= 1811, nxpk= 10, iat=1144,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1151,1152,
 &end
#
#   73 ASN  HA           73 ASN  HD2-        5.50    (#   1812:10  Unique         2.93, 3.84 A)
 &rst
  ixpk= 1812, nxpk= 10, iat=1144,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1151,1152,
 &end
#
#   73 ASN  HN           73 ASN  HD2+        4.20    (#   1813:10  Unique         2.18, 3.13 A)
 &rst
  ixpk= 1813, nxpk= 10, iat=1142,  -1, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr2=1151,1152,
 &end
#
#   73 ASN  HN           73 ASN  HD2-        5.50    (#   1814:10  Unique         2.18, 3.13 A)
 &rst
  ixpk= 1814, nxpk= 10, iat=1142,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1151,1152,
 &end
#
#    8 ARG  HD-          95 GLN  HE2-        5.50    (#   1815:10  Unique         3.72, 6.33 A)
 &rst
  ixpk= 1815, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 114, 115,
 igr2=1555,1556,
 &end
#
#   77 TYR  HB-          95 GLN  HE2+        5.50    (#   1816:10  Unique         2.70, 7.84 A)
 &rst
  ixpk= 1816, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1227,1228,
 igr2=1555,1556,
 &end
#
#    0 AMB  10-2:1817     0 AMB  10-1:1817   5.50    (#   1817:10  Double Ambig)
 &rst
  ixpk= 1817, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=  87,  88,1160,1161,
 igr2=1555,1556,1555,1556,
 &end
#
#    0 AMB  10-2:1818     0 AMB  10-1:1818   3.50    (#   1818:10  Double Ambig)
 &rst
  ixpk= 1818, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1550,1551,1209,1210,
 igr2=1555,1556,1555,1556,
 &end
#
#   95 GLN  HG+          95 GLN  HE2+        3.50    (#   1819:10  Unique         2.31, 3.47 A)
 &rst
  ixpk= 1819, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1550,1551,
 igr2=1555,1556,
 &end
#
#    0 AMB  10-2:1820    95 GLN  HE2-        3.50    (#   1820:10  Single Ambig)
 &rst
  ixpk= 1820, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1550,1551,1209,1210,
 igr2=1555,1556,
 &end
#
#   95 GLN  HG+          95 GLN  HE2-        3.50    (#   1821:10  Unique         2.31, 3.47 A)
 &rst
  ixpk= 1821, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1550,1551,
 igr2=1555,1556,
 &end
#
#   95 GLN  HB+          95 GLN  HE2+        5.50    (#   1822:10  Unique         1.95, 3.43 A)
 &rst
  ixpk= 1822, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1547,1548,
 igr2=1555,1556,
 &end
#
#   95 GLN  HB+          95 GLN  HE2-        4.20    (#   1823:10  Unique         1.95, 3.43 A)
 &rst
  ixpk= 1823, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1547,1548,
 igr2=1555,1556,
 &end
#
#   95 GLN  HB-          95 GLN  HE2+        4.20    (#   1824:10  Unique         1.95, 3.43 A)
 &rst
  ixpk= 1824, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1547,1548,
 igr2=1555,1556,
 &end
#
#    0 AMB  10-2:1825     0 AMB  10-1:1825   5.50    (#   1825:10  Double Ambig)
 &rst
  ixpk= 1825, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1206,1207,2304,2305,
 igr2=1555,1556,1555,1556,
 &end
#
#   79 LEU  MDY          95 GLN  HE2+        5.50    (#   1826:10  Unique         2.50, 5.13 A)
 &rst
  ixpk= 1826, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1555,1556,
 &end
#
#    0 AMB  10-2:1827    97 GLN  HE2-        5.50    (#   1827:10  Single Ambig)
 &rst
  ixpk= 1827, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1586,1587,1589,1590,1550,1551,
 igr2=1594,1595,
 &end
#
#    0 AMB  10-2:1828     0 AMB  10-1:1828   5.50    (#   1828:10  Double Ambig)
 &rst
  ixpk= 1828, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=1586,1587,1589,1590,1550,1551,
 igr2=1594,1595,1594,1595,1594,1595,
 &end
#
#   37 GLN  HB-          97 GLN  HE2+        5.50    (#   1829:10  Unique         7.25, 9.90 A)
 &rst
  ixpk= 1829, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 589, 590,
 igr2=1594,1595,
 &end
#
#    0 AMB  10-2:1830   114 GLN  HE2-        3.50    (#   1830:10  Single Ambig)
 &rst
  ixpk= 1830, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1864,1865,1867,1868,
 igr2=1872,1873,
 &end
#
#  119 PRO  HD+         114 GLN  HE2+        5.50    (#   1832:10  Unique         5.78, 8.38 A)
 &rst
  ixpk= 1832, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1928,1929,
 igr2=1872,1873,
 &end
#
#    0 AMB  10-2:1833     0 AMB  10-1:1833   5.50    (#   1833:10  Double Ambig)
 &rst
  ixpk= 1833, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1904, 788,
 igr2=1872,1873, 733, 734,
 &end
#
#  115 THR  MG2         112 ASN  HD2+        5.50    (#   1834:10  Unique         2.13, 4.30 A)
 &rst
  ixpk= 1834, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1883,1884,1885,
 igr2=1838,1839,
 &end
#
#  115 THR  MG2         112 ASN  HD2-        5.50    (#   1835:10  Unique         2.13, 4.30 A)
 &rst
  ixpk= 1835, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1883,1884,1885,
 igr2=1838,1839,
 &end
#
#  112 ASN  HB+         112 ASN  HD2-        3.50    (#   1836:10  Unique         2.14, 3.30 A)
 &rst
  ixpk= 1836, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1833,1834,
 igr2=1838,1839,
 &end
#
#  112 ASN  HB+         112 ASN  HD2+        2.80    (#   1837:10  Unique         2.14, 3.30 A)
 &rst
  ixpk= 1837, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1833,1834,
 igr2=1838,1839,
 &end
#
#  115 THR  HB          112 ASN  HD2-        5.50    (#   1838:10  Unique         4.57, 5.37 A)
 &rst
  ixpk= 1838, nxpk= 10, iat=1881,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1838,1839,
 &end
#
#  135 GLN  HG-         135 GLN  HE2+        4.20    (#   1839:10  Unique         2.13, 3.19 A)
 &rst
  ixpk= 1839, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=2221,2222,
 igr2=2226,2227,
 &end
#
#  135 GLN  HG-         135 GLN  HE2-        5.50    (#   1840:10  Unique         2.13, 3.19 A)
 &rst
  ixpk= 1840, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2221,2222,
 igr2=2226,2227,
 &end
#
#  135 GLN  HG+         135 GLN  HE2-        3.50    (#   1841:10  Unique         2.13, 3.19 A)
 &rst
  ixpk= 1841, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2221,2222,
 igr2=2226,2227,
 &end
#
#  135 GLN  HG+         135 GLN  HE2+        3.50    (#   1842:10  Unique         2.13, 3.19 A)
 &rst
  ixpk= 1842, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2221,2222,
 igr2=2226,2227,
 &end
#
#  135 GLN  HB+         135 GLN  HE2-        5.50    (#   1844:10  Unique         3.86, 4.62 A)
 &rst
  ixpk= 1844, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2218,2219,
 igr2=2226,2227,
 &end
#
#    0 AMB  10-2:1845     0 AMB  10-1:1845   5.50    (#   1845:10  Double Ambig)
 &rst
  ixpk= 1845, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2216,2192,
 igr2=2226,2227,2226,2227,
 &end
#
#    0 AMB  10-2:1846   135 GLN  HE2-        5.50    (#   1846:10  Single Ambig)
 &rst
  ixpk= 1846, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2216,2192,
 igr2=2226,2227,
 &end
#
#  135 GLN  HN          135 GLN  HE2+        5.50    (#   1849:10  Unique         2.37, 3.88 A)
 &rst
  ixpk= 1849, nxpk= 10, iat=2214,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2226,2227,
 &end
#
#  135 GLN  HN          135 GLN  HE2-        5.50    (#   1850:10  Unique         2.37, 3.88 A)
 &rst
  ixpk= 1850, nxpk= 10, iat=2214,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2226,2227,
 &end
#
#  134 ARG  HN          135 GLN  HE2-        5.50    (#   1851:10  Unique         3.17, 4.62 A)
 &rst
  ixpk= 1851, nxpk= 10, iat=2190,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2226,2227,
 &end
#
#  134 ARG  HN          135 GLN  HE2+        5.50    (#   1852:10  Unique         3.17, 4.62 A)
 &rst
  ixpk= 1852, nxpk= 10, iat=2190,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2226,2227,
 &end
#
#    0 AMB  10-2:1856     0 AMB  10-1:1856   5.50    (#   1856:10  Double Ambig)
 &rst
  ixpk= 1856, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.07, r4= 8.82,
 igr1=2582,2629,
 igr2=2639,2640, 271,2639,2640,
 &end
#
#    0 AMB  10-2:1857   159 GLN  HE2-        5.50    (#   1857:10  Single Ambig)
 &rst
  ixpk= 1857, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2582,2629,
 igr2=2639,2640,
 &end
#
#    0 AMB  10-2:1858   159 GLN  HE2-        3.50    (#   1858:10  Single Ambig)
 &rst
  ixpk= 1858, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2634,2635,2634,2635,
 igr2=2639,2640,
 &end
#
#   19 GLN  HG+         159 GLN  HE2-        5.50    (#   1859:10  Unique         7.68, 8.82 A)
 &rst
  ixpk= 1859, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 289, 290,
 igr2=2639,2640,
 &end
#
#  159 GLN  HB-         159 GLN  HE2-        5.50    (#   1860:10  Unique         2.75, 3.94 A)
 &rst
  ixpk= 1860, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2631,2632,
 igr2=2639,2640,
 &end
#
#  155 VAL  MGX         159 GLN  HE2+        5.50    (#   1861:10  Unique         1.95, 4.57 A)
 &rst
  ixpk= 1861, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2570,2571,2572,2574,2575,2576,
 igr2=2639,2640,
 &end
#
#  155 VAL  MGX         159 GLN  HE2-        5.50    (#   1862:10  Unique         1.95, 4.57 A)
 &rst
  ixpk= 1862, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2570,2571,2572,2574,2575,2576,
 igr2=2639,2640,
 &end
#
#   18 ARG  HD+          18 ARG  HE          2.80    (#   1863:10  Unique         2.27, 2.67 A)
 &rst
  ixpk= 1863, nxpk= 10, iat=  -1, 271, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 268, 269,
 &end
#
#  161 ASN  HN          161 ASN  HD2+        5.50    (#   1865:10  Unique         1.89, 2.92 A)
 &rst
  ixpk= 1865, nxpk= 10, iat=2659,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2668,2669,
 &end
#
#  161 ASN  HN          161 ASN  HD2-        5.50    (#   1866:10  Unique         1.89, 2.92 A)
 &rst
  ixpk= 1866, nxpk= 10, iat=2659,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=2668,2669,
 &end
#
#  161 ASN  HB-         161 ASN  HD2-        3.50    (#   1870:10  Unique         2.11, 3.39 A)
 &rst
  ixpk= 1870, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2663,2664,
 igr2=2668,2669,
 &end
#
#  161 ASN  HB+         161 ASN  HD2-        5.50    (#   1871:10  Unique         2.11, 3.39 A)
 &rst
  ixpk= 1871, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2663,2664,
 igr2=2668,2669,
 &end
#
#  161 ASN  HB+         161 ASN  HD2+        3.50    (#   1872:10  Unique         2.11, 3.39 A)
 &rst
  ixpk= 1872, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2663,2664,
 igr2=2668,2669,
 &end
#
#  161 ASN  HB-         161 ASN  HD2+        2.80    (#   1873:10  Unique         2.11, 3.39 A)
 &rst
  ixpk= 1873, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=2663,2664,
 igr2=2668,2669,
 &end
#
#  160 GLU  HB+         161 ASN  HD2-        5.50    (#   1874:10  Unique         2.23, 3.83 A)
 &rst
  ixpk= 1874, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2648,2649,
 igr2=2668,2669,
 &end
#
#    0 AMB  10-2:1875   161 ASN  HD2-        5.50    (#   1875:10  Single Ambig)
 &rst
  ixpk= 1875, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.99, r4=10.74,
 igr1=2617,2618,2619,2621,2622,2623,2554,2555,2556,2558,
      2559,2560,2570,2571,2572,2574,2575,2576,
 igr2=2668,2669,
 &end
#
#   98 LYS  HE-          74 TRP  HE1         5.50    (#   1876:10  Unique         3.23, 4.63 A)
 &rst
  ixpk= 1876, nxpk= 10, iat=  -1,1166, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1612,1613,
 &end
#
#   98 LYS  HE+          74 TRP  HE1         5.50    (#   1877:10  Unique         3.23, 4.63 A)
 &rst
  ixpk= 1877, nxpk= 10, iat=  -1,1166, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1612,1613,
 &end
#
#    0 AMB  10-2:1879    74 TRP  HE1         5.50    (#   1879:10  Single Ambig)
 &rst
  ixpk= 1879, nxpk= 10, iat=  -1,1166, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1160,1161,1146,1147,
 &end
#
#   74 TRP  HD1          74 TRP  HE1         2.80    (#   1882:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 1882, nxpk= 10, iat=1164,1166, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   74 TRP  HH2          74 TRP  HE1         5.50    (#   1883:10  Unique         4.96, 4.97 A)
 &rst
  ixpk= 1883, nxpk= 10, iat=1171,1166, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   33 TRP  HH2          33 TRP  HE1         5.50    (#   1884:10  Unique         4.96, 4.97 A)
 &rst
  ixpk= 1884, nxpk= 10, iat= 525, 520, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   33 TRP  HD1          33 TRP  HE1         2.80    (#   1885:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 1885, nxpk= 10, iat= 518, 520, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   33 TRP  HZ2          33 TRP  HE1         3.50    (#   1886:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 1886, nxpk= 10, iat= 523, 520, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1887    74 TRP  HE1         5.50    (#   1887:10  Single Ambig)
 &rst
  ixpk= 1887, nxpk= 10, iat=  -1,1166, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1156,1142,
 &end
#
#   33 TRP  HN           33 TRP  HE1         5.50    (#   1888:10  Unique         4.09, 4.92 A)
 &rst
  ixpk= 1888, nxpk= 10, iat= 510, 520, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1889   130 TRP  HE1         5.50    (#   1889:10  Single Ambig)
 &rst
  ixpk= 1889, nxpk= 10, iat=  -1,2125, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2098,2099,2119,2120,
 &end
#
#  130 TRP  HD1         130 TRP  HE1         2.80    (#   1891:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 1891, nxpk= 10, iat=2123,2125, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:1892   130 TRP  HE1         2.80    (#   1892:10  Single Ambig)
 &rst
  ixpk= 1892, nxpk= 10, iat=  -1,2125, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2128,2115,
 &end
#
#   84 VAL  MGX          86 TRP  HE1         3.50    (#   1893:10  Unique         3.98, 5.29 A)
 &rst
  ixpk= 1893, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#   84 VAL  MGY          86 TRP  HE1         3.50    (#   1894:10  Unique         3.98, 5.29 A)
 &rst
  ixpk= 1894, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1370,1371,1372,1374,1375,1376,
 &end
#
#    0 AMB  10-2:1895    86 TRP  HE1         3.50    (#   1895:10  Single Ambig)
 &rst
  ixpk= 1895, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1368,1306,1307,
 &end
#
#    0 AMB  10-2:1896    86 TRP  HE1         5.50    (#   1896:10  Single Ambig)
 &rst
  ixpk= 1896, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1303,1304,1303,1304,
 &end
#
#    0 AMB  10-2:1897    86 TRP  HE1         4.20    (#   1897:10  Single Ambig)
 &rst
  ixpk= 1897, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1312,1313,1408,1409,
 &end
#
#    0 AMB  10-2:1898    86 TRP  HE1         5.50    (#   1898:10  Single Ambig)
 &rst
  ixpk= 1898, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1408,1409,1366,
 &end
#
#   81 LYS  HA           86 TRP  HE1         5.50    (#   1899:10  Unique         2.74, 3.36 A)
 &rst
  ixpk= 1899, nxpk= 10, iat=1301,1414, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1900    86 TRP  HE1         5.50    (#   1900:10  Single Ambig)
 &rst
  ixpk= 1900, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1323,1406,
 &end
#
#    0 AMB  10-2:1901    86 TRP  HE1         5.50    (#   1901:10  Single Ambig)
 &rst
  ixpk= 1901, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1364,1419,
 &end
#
#   86 TRP  HD1          86 TRP  HE1         2.80    (#   1902:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 1902, nxpk= 10, iat=1412,1414, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#   86 TRP  HN           86 TRP  HE1         5.50    (#   1903:10  Unique         3.95, 4.01 A)
 &rst
  ixpk= 1903, nxpk= 10, iat=1404,1414, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HZ2          99 TRP  HE1         5.50    (#   1904:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 1904, nxpk= 10, iat=1634,1631, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   99 TRP  HD1          99 TRP  HE1         3.50    (#   1905:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 1905, nxpk= 10, iat=1629,1631, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:1906    99 TRP  HE1         3.50    (#   1906:10  Single Ambig)
 &rst
  ixpk= 1906, nxpk= 10, iat=  -1,1631, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1586,1587,1589,1590,
 &end
#
#    0 AMB  10-2:1907    99 TRP  HE1         4.20    (#   1907:10  Single Ambig)
 &rst
  ixpk= 1907, nxpk= 10, iat=  -1,1631, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1586,1587,1187,
 &end
#
#    0 AMB  10-2:1908     0 AMB  10-1:1908   3.50    (#   1908:10  Double Ambig)
 &rst
  ixpk= 1908, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2167,2168,2358,2359,2360,2362,2363,2364,
 igr2= 366,1631,
 &end
#
#  147 VAL  MGY          99 TRP  HE1         5.50    (#   1909:10  Unique         2.45, 4.51 A)
 &rst
  ixpk= 1909, nxpk= 10, iat=  -1,1631, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  10-2:1911    24 TRP  HE1         3.50    (#   1911:10  Single Ambig)
 &rst
  ixpk= 1911, nxpk= 10, iat=  -1, 366, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 364,2147,2156,
 &end
#
#   88 THR  MG2          85 ARG  HE          5.50    (#   1913:10  Unique         4.23, 6.17 A)
 &rst
  ixpk= 1913, nxpk= 10, iat=  -1,1393, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1446,1447,1448,
 &end
#
#   85 ARG  HG-          85 ARG  HE          5.50    (#   1914:10  Unique         2.12, 3.36 A)
 &rst
  ixpk= 1914, nxpk= 10, iat=  -1,1393, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1387,1388,
 &end
#
#    0 AMB  10-2:1915    85 ARG  HE          4.20    (#   1915:10  Single Ambig)
 &rst
  ixpk= 1915, nxpk= 10, iat=  -1,1393, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1387,1388,1384,1385,
 &end
#
#   85 ARG  HB+          85 ARG  HE          4.20    (#   1916:10  Unique         3.43, 4.30 A)
 &rst
  ixpk= 1916, nxpk= 10, iat=  -1,1393, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1384,1385,
 &end
#
#   85 ARG  HD+          85 ARG  HE          2.80    (#   1917:10  Unique         2.27, 2.59 A)
 &rst
  ixpk= 1917, nxpk= 10, iat=  -1,1393, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1390,1391,
 &end
#
#   85 ARG  HH2+         85 ARG  HE          4.20    (#   1919:10  Unique         2.28, 2.88 A)
 &rst
  ixpk= 1919, nxpk= 10, iat=  -1,1393, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1399,1400,
 &end
#
#    0 AMB  10-2:1920    62 ARG  HE          2.80    (#   1920:10  Single Ambig)
 &rst
  ixpk= 1920, nxpk= 10, iat=  -1, 960, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1= 957, 958, 769, 770,
 &end
#
#   51 TYR  HE           62 ARG  HE          4.20    (#   1921:10  Unique         2.79, 5.72 A)
 &rst
  ixpk= 1921, nxpk= 10, iat=  -1, 960, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 775, 780,
 &end
#
#   82 ARG  HD+          82 ARG  HE          4.20    (#   1924:10  Unique         2.28, 2.75 A)
 &rst
  ixpk= 1924, nxpk= 10, iat=  -1,1334, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1331,1332,
 &end
#
#   72 ARG  HD+          72 ARG  HE          3.50    (#   1925:10  Unique         2.28, 2.76 A)
 &rst
  ixpk= 1925, nxpk= 10, iat=  -1,1131, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1128,1129,
 &end
#
#  105 VAL  MGX          66 ARG  HE          4.20    (#   1926:10  Unique         1.94, 3.61 A)
 &rst
  ixpk= 1926, nxpk= 10, iat=  -1,1034, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#   66 ARG  HG+          66 ARG  HE          3.50    (#   1927:10  Unique         2.68, 3.55 A)
 &rst
  ixpk= 1927, nxpk= 10, iat=  -1,1034, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1028,1029,
 &end
#
#    0 AMB  10-2:1928    66 ARG  HE          3.50    (#   1928:10  Single Ambig)
 &rst
  ixpk= 1928, nxpk= 10, iat=  -1,1034, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1025,1026,1025,1026,
 &end
#
#   71 THR  MG2          72 ARG  HE          5.50    (#   1931:10  Unique         6.63, 9.74 A)
 &rst
  ixpk= 1931, nxpk= 10, iat=  -1,1131, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1110,1111,1112,
 &end
#
#   72 ARG  HG+          72 ARG  HE          3.50    (#   1932:10  Unique         2.21, 2.87 A)
 &rst
  ixpk= 1932, nxpk= 10, iat=  -1,1131, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1125,1126,
 &end
#
#   66 ARG  HD+          66 ARG  HE          2.80    (#   1933:10  Unique         2.27, 2.57 A)
 &rst
  ixpk= 1933, nxpk= 10, iat=  -1,1034, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1031,1032,
 &end
#
#   62 ARG  HG-          62 ARG  HE          5.50    (#   1934:10  Unique         2.18, 3.32 A)
 &rst
  ixpk= 1934, nxpk= 10, iat=  -1, 960, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 954, 955,
 &end
#
#   62 ARG  HG+          62 ARG  HE          5.50    (#   1935:10  Unique         2.18, 3.32 A)
 &rst
  ixpk= 1935, nxpk= 10, iat=  -1, 960, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 954, 955,
 &end
#
#   62 ARG  HB-          62 ARG  HE          5.50    (#   1936:10  Unique         2.00, 3.16 A)
 &rst
  ixpk= 1936, nxpk= 10, iat=  -1, 960, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 951, 952,
 &end
#
#    0 AMB  10-2:1937    12 GLY  HN          5.50    (#   1937:10  Single Ambig)
 &rst
  ixpk= 1937, nxpk= 10, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 174, 175, 174, 175,
 &end
#
#   68 LEU  HB+          68 LEU  HN          3.50    (#   1952:10  Unique         2.64, 3.23 A)
 &rst
  ixpk= 1952, nxpk= 10, iat=  -1,1064, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1068,1069,
 &end
#
#    0 AMB  10-2:1953     0 AMB  10-1:1953   3.10    (#   1953:10  Double Ambig)
 &rst
  ixpk= 1953, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.38, r4= 5.13,
 igr1=1547,1548, 713, 714,
 igr2=1543, 706,
 &end
#
#   74 TRP  HZ2          74 TRP  HE1         2.80    (#   1954:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 1954, nxpk= 10, iat=1169,1166, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  124 TRP  HZ2         124 TRP  HE1         4.20    (#   1955:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 1955, nxpk= 10, iat=2008,2005, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  127 VAL  HB          127 VAL  HN          5.50    (#   1957:10  Unique         3.32, 3.73 A)
 &rst
  ixpk= 1957, nxpk= 10, iat=2071,2067, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   26 ARG  HB+          26 ARG  HN          5.50    (#   1958:10  Unique         2.07, 2.73 A)
 &rst
  ixpk= 1958, nxpk= 10, iat=  -1, 390, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 394, 395,
 &end
#
#  158 LEU  MDX          18 ARG  HE          5.50    (#   1959:10  Unique         1.93, 6.68 A)
 &rst
  ixpk= 1959, nxpk= 10, iat=  -1, 271, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2617,2618,2619,2621,2622,2623,
 &end
#
#    0 AMB  10-2:1960     0 AMB  10-1:1960   5.50    (#   1960:10  Double Ambig)
 &rst
  ixpk= 1960, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2197,2198, 265, 266,
 igr2=2203, 271,
 &end
#
#    0 AMB  10-2:1961     0 AMB  10-1:1961   4.20    (#   1961:10  Double Ambig)
 &rst
  ixpk= 1961, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 262, 263,2194,2195,
 igr2= 271,2203,
 &end
#
#   18 ARG  HB+          18 ARG  HE          5.50    (#   1962:10  Unique         1.95, 3.71 A)
 &rst
  ixpk= 1962, nxpk= 10, iat=  -1, 271, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 262, 263,
 &end
#
#    0 AMB  10-2:1963    18 ARG  HE          5.50    (#   1963:10  Single Ambig)
 &rst
  ixpk= 1963, nxpk= 10, iat=  -1, 271, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2629,2610,
 &end
#
#   66 ARG  HH2+         66 ARG  HE          4.20    (#   1965:10  Unique         2.28, 2.88 A)
 &rst
  ixpk= 1965, nxpk= 10, iat=  -1,1034, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1040,1041,
 &end
#
#    0 AMB  10-2:1966    66 ARG  HE          5.50    (#   1966:10  Single Ambig)
 &rst
  ixpk= 1966, nxpk= 10, iat=  -1,1034, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1703,1045,
 &end
#
#   85 ARG  HA           85 ARG  HE          5.50    (#   1971:10  Unique         2.01, 3.99 A)
 &rst
  ixpk= 1971, nxpk= 10, iat=1382,1393, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  125 ARG  HD+         125 ARG  HE          5.50    (#   1972:10  Unique         2.27, 2.64 A)
 &rst
  ixpk= 1972, nxpk= 10, iat=  -1,2032, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2029,2030,
 &end
#
#  125 ARG  HG+         125 ARG  HE          5.50    (#   1973:10  Unique         2.23, 3.08 A)
 &rst
  ixpk= 1973, nxpk= 10, iat=  -1,2032, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2026,2027,
 &end
#
#  125 ARG  HD-         125 ARG  HE          5.50    (#   1974:10  Unique         2.27, 2.64 A)
 &rst
  ixpk= 1974, nxpk= 10, iat=  -1,2032, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2029,2030,
 &end
#
#  126 TRP  HZ2         126 TRP  HE1         5.50    (#   1976:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 1976, nxpk= 10, iat=2056,2053, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:1977   126 TRP  HE1         5.50    (#   1977:10  Single Ambig)
 &rst
  ixpk= 1977, nxpk= 10, iat=  -1,2053, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2058,1966,1970,
 &end
#
#  111 ILE  QD1         126 TRP  HE1         5.50    (#   1978:10  Unique         3.43, 4.35 A)
 &rst
  ixpk= 1978, nxpk= 10, iat=  -1,2053, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1823,1824,1825,
 &end
#
#  108 ASP  HB+         126 TRP  HE1         5.50    (#   1979:10  Unique         3.99, 5.03 A)
 &rst
  ixpk= 1979, nxpk= 10, iat=  -1,2053, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1777,1778,
 &end
#
#  129 TYR  HA          129 TYR  HN          4.20    (#   1980:10  Unique         2.80, 2.87 A)
 &rst
  ixpk= 1980, nxpk= 10, iat=2096,2094, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    2 ILE  HG1-          3 ASP  HN          5.50    (#   1981:10  Unique         3.70, 4.30 A)
 &rst
  ixpk= 1981, nxpk= 10, iat=  -1,  40, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  31,  32,
 &end
#
#    2 ILE  HB            3 ASP  HN          5.50    (#   1982:10  Unique         4.21, 4.39 A)
 &rst
  ixpk= 1982, nxpk= 10, iat=  25,  40, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    1 MET  HG-           3 ASP  HN          5.50    (#   1983:10  Unique         4.19, 5.47 A)
 &rst
  ixpk= 1983, nxpk= 10, iat=  -1,  40, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  11,  12,
 &end
#
#    0 AMB  10-2:1984     4 ASP  HN          5.80    (#   1984:10  Single Ambig)
 &rst
  ixpk= 1984, nxpk= 10, iat=  -1,  52, r1= 0.00, r2= 1.80, r3= 6.97, r4= 7.72,
 igr1=  23, 665, 666,
 &end
#
#    4 ASP  HN            5 ASP  HN          3.50    (#   1985:10  Unique         1.77, 2.47 A)
 &rst
  ixpk= 1985, nxpk= 10, iat=  52,  64, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    6 GLY  HA+           5 ASP  HN          5.50    (#   1986:10  Unique         4.34, 4.67 A)
 &rst
  ixpk= 1986, nxpk= 10, iat=  -1,  64, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  78,  79,
 &end
#
#    7 TYR  HD            6 GLY  HN          5.50    (#   1988:10  Unique         4.15, 6.00 A)
 &rst
  ixpk= 1988, nxpk= 10, iat=  -1,  76, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  91, 100,
 &end
#
#    6 GLY  HA+           7 TYR  HN          5.50    (#   1989:10  Unique         2.95, 3.25 A)
 &rst
  ixpk= 1989, nxpk= 10, iat=  -1,  83, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  78,  79,
 &end
#
#    0 AMB  10-2:1990     0 AMB  10-1:1990   3.50    (#   1990:10  Double Ambig)
 &rst
  ixpk= 1990, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 738,  40,
 igr2= 748,  83,
 &end
#
#    2 ILE  QG2           5 ASP  HN          5.50    (#   1991:10  Unique         3.71, 4.92 A)
 &rst
  ixpk= 1991, nxpk= 10, iat=  -1,  64, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=  27,  28,  29,
 &end
#
#    0 AMB  10-2:1992     6 GLY  HN          5.50    (#   1992:10  Single Ambig)
 &rst
  ixpk= 1992, nxpk= 10, iat=  -1,  76, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1=1530,1531,1532,1527,1528,
 &end
#
#   95 GLN  HB-           8 ARG  HN          5.50    (#   1993:10  Unique         2.80, 3.68 A)
 &rst
  ixpk= 1993, nxpk= 10, iat=  -1, 104, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1547,1548,
 &end
#
#    7 TYR  HB+           8 ARG  HN          5.50    (#   1994:10  Unique         3.03, 3.78 A)
 &rst
  ixpk= 1994, nxpk= 10, iat=  -1, 104, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=  87,  88,
 &end
#
#   95 GLN  HN            8 ARG  HN          5.50    (#   1995:10  Unique         4.64, 4.80 A)
 &rst
  ixpk= 1995, nxpk= 10, iat=1543, 104, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   98 LYS  HN           10 ASN  HN          5.50    (#   1996:10  Unique         3.79, 4.08 A)
 &rst
  ixpk= 1996, nxpk= 10, iat=1599, 142, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   10 ASN  HB-          10 ASN  HN          5.50    (#   1997:10  Unique         2.43, 3.06 A)
 &rst
  ixpk= 1997, nxpk= 10, iat=  -1, 142, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 146, 147,
 &end
#
#   10 ASN  HB+          11 VAL  HN          4.20    (#   1998:10  Unique         2.67, 3.49 A)
 &rst
  ixpk= 1998, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 146, 147,
 &end
#
#   10 ASN  HN           11 VAL  HN          5.50    (#   1999:10  Unique         4.38, 4.44 A)
 &rst
  ixpk= 1999, nxpk= 10, iat= 142, 156, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   12 GLY  HA+          12 GLY  HN          5.50    (#   2000:10  Unique         2.44, 2.73 A)
 &rst
  ixpk= 2000, nxpk= 10, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 174, 175,
 &end
#
#   98 LYS  HN           12 GLY  HN          5.50    (#   2002:10  Unique         3.41, 3.84 A)
 &rst
  ixpk= 2002, nxpk= 10, iat=1599, 172, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   14 VAL  HN           13 ILE  HN          5.50    (#   2003:10  Unique         4.20, 4.29 A)
 &rst
  ixpk= 2003, nxpk= 10, iat= 198, 179, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   15 ILE  HA           14 VAL  HN          5.50    (#   2004:10  Unique         4.69, 4.75 A)
 &rst
  ixpk= 2004, nxpk= 10, iat= 216, 198, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   14 VAL  MGX          15 ILE  HN          5.50    (#   2005:10  Unique         3.07, 4.76 A)
 &rst
  ixpk= 2005, nxpk= 10, iat=  -1, 214, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   16 CYS  HN           15 ILE  HN          5.50    (#   2006:10  Unique         4.42, 4.52 A)
 &rst
  ixpk= 2006, nxpk= 10, iat= 233, 214, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  MDX          16 CYS  HN          4.20    (#   2007:10  Unique         2.90, 4.98 A)
 &rst
  ixpk= 2007, nxpk= 10, iat=  -1, 233, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#  103 GLN  HG+          16 CYS  HN          5.50    (#   2008:10  Unique         4.65, 5.50 A)
 &rst
  ixpk= 2008, nxpk= 10, iat=  -1, 233, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1710,1711,
 &end
#
#   17 ASN  HB-          17 ASN  HN          5.50    (#   2009:10  Unique         2.53, 3.22 A)
 &rst
  ixpk= 2009, nxpk= 10, iat=  -1, 244, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 248, 249,
 &end
#
#   16 CYS  HB+          17 ASN  HN          3.50    (#   2010:10  Unique         2.50, 3.29 A)
 &rst
  ixpk= 2010, nxpk= 10, iat=  -1, 244, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 237, 238,
 &end
#
#   51 TYR  HB+          48 GLN  HN          5.50    (#   2011:10  Unique         4.73, 5.78 A)
 &rst
  ixpk= 2011, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 769, 770,
 &end
#
#   16 CYS  HB-          17 ASN  HN          5.50    (#   2012:10  Unique         2.50, 3.29 A)
 &rst
  ixpk= 2012, nxpk= 10, iat=  -1, 244, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 237, 238,
 &end
#
#   47 GLU  HG-          48 GLN  HN          4.20    (#   2013:10  Unique         3.69, 4.44 A)
 &rst
  ixpk= 2013, nxpk= 10, iat=  -1, 721, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 713, 714,
 &end
#
#    0 AMB  10-2:2014    17 ASN  HN          5.51    (#   2014:10  Single Ambig)
 &rst
  ixpk= 2014, nxpk= 10, iat=  -1, 244, r1= 0.00, r2= 1.80, r3= 6.94, r4= 7.69,
 igr1=1707,1708, 262, 263,
 &end
#
#   18 ARG  HA           18 ARG  HN          3.50    (#   2015:10  Unique         2.82, 2.87 A)
 &rst
  ixpk= 2015, nxpk= 10, iat= 260, 258, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   17 ASN  HB-          18 ARG  HN          4.20    (#   2016:10  Unique         2.10, 2.97 A)
 &rst
  ixpk= 2016, nxpk= 10, iat=  -1, 258, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 248, 249,
 &end
#
#    0 AMB  10-2:2017    18 ARG  HN          4.20    (#   2017:10  Single Ambig)
 &rst
  ixpk= 2017, nxpk= 10, iat=  -1, 258, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 289, 290, 286, 287,1724,1725, 313, 314,
 &end
#
#   19 GLN  HG+          19 GLN  HN          3.50    (#   2018:10  Unique         2.27, 3.27 A)
 &rst
  ixpk= 2018, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 289, 290,
 &end
#
#   19 GLN  HG+          20 GLY  HN          5.50    (#   2019:10  Unique         4.08, 4.91 A)
 &rst
  ixpk= 2019, nxpk= 10, iat=  -1, 299, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 289, 290,
 &end
#
#   21 GLN  HN           20 GLY  HN          3.50    (#   2020:10  Unique         2.18, 2.38 A)
 &rst
  ixpk= 2020, nxpk= 10, iat= 306, 299, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   19 GLN  HG+          21 GLN  HN          4.20    (#   2021:10  Unique         4.96, 5.58 A)
 &rst
  ixpk= 2021, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 289, 290,
 &end
#
#   17 ASN  HD2+         21 GLN  HN          3.50    (#   2022:10  Unique         1.84, 3.70 A)
 &rst
  ixpk= 2022, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 253, 254,
 &end
#
#   22 VAL  HA           22 VAL  HN          5.50    (#   2023:10  Unique         2.91, 2.94 A)
 &rst
  ixpk= 2023, nxpk= 10, iat= 325, 323, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   23 MET  HA           23 MET  HN          5.50    (#   2024:10  Unique         2.80, 2.91 A)
 &rst
  ixpk= 2024, nxpk= 10, iat= 341, 339, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   32 SER  HA           32 SER  HN          5.50    (#   2025:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 2025, nxpk= 10, iat= 501, 499, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2026    32 SER  HN          5.50    (#   2026:10  Single Ambig)
 &rst
  ixpk= 2026, nxpk= 10, iat=  -1, 499, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 486, 487, 392,
 &end
#
#   44 GLU  HA           43 GLY  HN          5.50    (#   2027:10  Unique         4.62, 4.73 A)
 &rst
  ixpk= 2027, nxpk= 10, iat= 672, 663, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   45 SER  HB-          46 ALA  HN          4.20    (#   2029:10  Unique         2.04, 2.86 A)
 &rst
  ixpk= 2029, nxpk= 10, iat=  -1, 696, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 689, 690,
 &end
#
#   95 GLN  HG+          95 GLN  HN          4.20    (#   2030:10  Unique         2.35, 3.45 A)
 &rst
  ixpk= 2030, nxpk= 10, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1550,1551,
 &end
#
#   95 GLN  HB-          95 GLN  HN          4.20    (#   2031:10  Unique         2.70, 3.36 A)
 &rst
  ixpk= 2031, nxpk= 10, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1547,1548,
 &end
#
#    0 AMB  10-2:2032     0 AMB  10-1:2032   5.50    (#   2032:10  Double Ambig)
 &rst
  ixpk= 2032, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.07, r4= 8.82,
 igr1= 525,2378,2383,1655,1659,
 igr2= 510, 738,
 &end
#
#   50 MET  HB+          50 MET  HN          3.50    (#   2033:10  Unique         2.28, 2.53 A)
 &rst
  ixpk= 2033, nxpk= 10, iat=  -1, 748, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 752, 753,
 &end
#
#    0 AMB  10-2:2034     0 AMB  10-1:2034   5.50    (#   2034:10  Double Ambig)
 &rst
  ixpk= 2034, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.34, r4=10.09,
 igr1=  56,  57,1510,1511, 769, 770,1850,1851,
 igr2=  83, 748,1860,
 &end
#
#   52 ARG  HA           53 GLU  HN          5.50    (#   2035:10  Unique         3.52, 3.54 A)
 &rst
  ixpk= 2035, nxpk= 10, iat= 788, 810, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   52 ARG  HB-          53 GLU  HN          4.20    (#   2036:10  Unique         2.38, 3.33 A)
 &rst
  ixpk= 2036, nxpk= 10, iat=  -1, 810, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 790, 791,
 &end
#
#   53 GLU  HA           54 LEU  HN          5.50    (#   2037:10  Unique         3.48, 3.50 A)
 &rst
  ixpk= 2037, nxpk= 10, iat= 812, 825, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   55 PHE  HN           54 LEU  HN          4.20    (#   2039:10  Unique         2.69, 2.73 A)
 &rst
  ixpk= 2039, nxpk= 10, iat= 844, 825, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   53 GLU  HN           54 LEU  HN          3.50    (#   2040:10  Unique         2.48, 2.53 A)
 &rst
  ixpk= 2040, nxpk= 10, iat= 810, 825, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:2041    54 LEU  HN          5.50    (#   2041:10  Single Ambig)
 &rst
  ixpk= 2041, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 864, 879,
 &end
#
#   56 GLU  HB-          56 GLU  HN          4.20    (#   2042:10  Unique         2.42, 3.09 A)
 &rst
  ixpk= 2042, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 868, 869,
 &end
#
#    0 AMB  10-2:2043    56 GLU  HN          5.50    (#   2043:10  Single Ambig)
 &rst
  ixpk= 2043, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 886, 887, 898,
 &end
#
#   57 GLU  HB-          57 GLU  HN          2.80    (#   2044:10  Unique         2.31, 3.11 A)
 &rst
  ixpk= 2044, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1= 883, 884,
 &end
#
#    0 AMB  10-2:2045    57 GLU  HN          5.50    (#   2045:10  Single Ambig)
 &rst
  ixpk= 2045, nxpk= 10, iat=  -1, 879, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 868, 869, 817, 818,
 &end
#
#   61 SER  HA           61 SER  HN          5.50    (#   2046:10  Unique         2.88, 2.89 A)
 &rst
  ixpk= 2046, nxpk= 10, iat= 938, 936, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   60 LEU  HB-          61 SER  HN          4.20    (#   2047:10  Unique         2.65, 3.52 A)
 &rst
  ixpk= 2047, nxpk= 10, iat=  -1, 936, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 921, 922,
 &end
#
#   60 LEU  HN           61 SER  HN          5.50    (#   2048:10  Unique         4.55, 4.58 A)
 &rst
  ixpk= 2048, nxpk= 10, iat= 917, 936, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   62 ARG  HN           61 SER  HN          5.50    (#   2049:10  Unique         4.53, 4.58 A)
 &rst
  ixpk= 2049, nxpk= 10, iat= 947, 936, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   64 ASP  HN           61 SER  HN          5.50    (#   2050:10  Unique         3.78, 4.06 A)
 &rst
  ixpk= 2050, nxpk= 10, iat= 993, 936, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   64 ASP  HN           63 LYS  HN          2.80    (#   2051:10  Unique         2.32, 2.49 A)
 &rst
  ixpk= 2051, nxpk= 10, iat= 993, 971, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:2052    65 VAL  HN          5.50    (#   2052:10  Single Ambig)
 &rst
  ixpk= 2052, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 951, 952, 924,1028,1029,
 &end
#
#    0 AMB  10-2:2053    65 VAL  HN          5.50    (#   2053:10  Single Ambig)
 &rst
  ixpk= 2053, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 981, 982,1028,1029, 829, 830,
 &end
#
#    0 AMB  10-2:2054    65 VAL  HN          2.80    (#   2054:10  Single Ambig)
 &rst
  ixpk= 2054, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=1745,1746,1747,1749,1750,1751, 834, 835, 836, 838,
       839, 840,
 &end
#
#    0 AMB  10-2:2055    67 ILE  HN          4.20    (#   2055:10  Single Ambig)
 &rst
  ixpk= 2055, nxpk= 10, iat=  -1,1045, r1= 0.00, r2= 1.80, r3= 5.04, r4= 5.79,
 igr1=1028,1029,1691,
 &end
#
#    0 AMB  10-2:2056    68 LEU  HN          2.80    (#   2056:10  Single Ambig)
 &rst
  ixpk= 2056, nxpk= 10, iat=  -1,1064, r1= 0.00, r2= 1.80, r3= 3.87, r4= 4.62,
 igr1=1071,1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  10-2:2057    68 LEU  HN          5.50    (#   2057:10  Single Ambig)
 &rst
  ixpk= 2057, nxpk= 10, iat=  -1,1064, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1688,1689,1055,1056,1025,1026,
 &end
#
#   71 THR  MG2          70 SER  HN          5.50    (#   2058:10  Unique         5.23, 6.22 A)
 &rst
  ixpk= 2058, nxpk= 10, iat=  -1,1093, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1110,1111,1112,
 &end
#
#    0 AMB  10-2:2059    79 LEU  HN          5.50    (#   2059:10  Single Ambig)
 &rst
  ixpk= 2059, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1295,1347,
 &end
#
#    0 AMB  10-2:2061    82 ARG  HN          4.20    (#   2061:10  Single Ambig)
 &rst
  ixpk= 2061, nxpk= 10, iat=  -1,1321, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1295,1347,
 &end
#
#   83 LEU  HG           83 LEU  HN          4.20    (#   2062:10  Unique         2.13, 2.96 A)
 &rst
  ixpk= 2062, nxpk= 10, iat=1352,1345, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   83 LEU  HG           84 VAL  HN          5.50    (#   2063:10  Unique         3.77, 4.38 A)
 &rst
  ixpk= 2063, nxpk= 10, iat=1352,1364, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2064    84 VAL  HN          4.20    (#   2064:10  Single Ambig)
 &rst
  ixpk= 2064, nxpk= 10, iat=  -1,1364, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1349,1350,1306,1307,1292,1293,1387,1388,
 &end
#
#   79 LEU  MDX           0 AMB  10-1:2066   5.50    (#   2066:10  Single Ambig)
 &rst
  ixpk= 2066, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1506,1380,
 &end
#
#   86 TRP  HE1          86 TRP  HN          5.50    (#   2067:10  Unique         3.95, 4.01 A)
 &rst
  ixpk= 2067, nxpk= 10, iat=1414,1404, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   88 THR  HA           89 LYS  HN          2.80    (#   2069:10  Unique         2.89, 2.90 A)
 &rst
  ixpk= 2069, nxpk= 10, iat=1442,1454, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:2070    89 LYS  HN          5.50    (#   2070:10  Single Ambig)
 &rst
  ixpk= 2070, nxpk= 10, iat=  -1,1454, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1494,1480,1481,
 &end
#
#   93 ILE  HA           94 GLY  HN          4.20    (#   2072:10  Unique         3.03, 3.10 A)
 &rst
  ixpk= 2072, nxpk= 10, iat=1519,1536, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:2073    47 GLU  HN          5.50    (#   2073:10  Single Ambig)
 &rst
  ixpk= 2073, nxpk= 10, iat=  -1, 706, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=1058,1059,1060,1693,1694,1695,1697,1698,1699,
 &end
#
#  102 LEU  MDY         101 LEU  HN          4.20    (#   2075:10  Unique         3.09, 5.42 A)
 &rst
  ixpk= 2075, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1693,1694,1695,1697,1698,1699,
 &end
#
#    0 AMB  10-2:2076   103 GLN  HN          4.20    (#   2076:10  Single Ambig)
 &rst
  ixpk= 2076, nxpk= 10, iat=  -1,1703, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=1011,1012,1013,1015,1016,1017,1693,1694,1695,1697,
      1698,1699,1745,1746,1747,1749,1750,1751,
 &end
#
#  105 VAL  HN          104 LEU  HN          5.50    (#   2077:10  Unique         4.38, 4.51 A)
 &rst
  ixpk= 2077, nxpk= 10, iat=1739,1720, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  105 VAL  MGY         106 SER  HN          3.50    (#   2078:10  Unique         1.97, 4.04 A)
 &rst
  ixpk= 2078, nxpk= 10, iat=  -1,1755, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1745,1746,1747,1749,1750,1751,
 &end
#
#  107 GLY  HA+         109 ALA  HN          4.20    (#   2080:10  Unique         2.98, 3.64 A)
 &rst
  ixpk= 2080, nxpk= 10, iat=  -1,1785, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1768,1769,
 &end
#
#  110 GLU  HG+         110 GLU  HN          5.50    (#   2081:10  Unique         1.97, 3.36 A)
 &rst
  ixpk= 2081, nxpk= 10, iat=  -1,1795, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1802,1803,
 &end
#
#  113 MET  HB+         113 MET  HN          4.20    (#   2082:10  Unique         2.33, 3.33 A)
 &rst
  ixpk= 2082, nxpk= 10, iat=  -1,1843, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1847,1848,
 &end
#
#  114 GLN  HN          115 THR  HN          4.20    (#   2084:10  Unique         1.94, 2.24 A)
 &rst
  ixpk= 2084, nxpk= 10, iat=1860,1877, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  116 SER  HN          117 SER  HN          5.50    (#   2085:10  Unique         4.48, 4.59 A)
 &rst
  ixpk= 2085, nxpk= 10, iat=1891,1902, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  120 GLU  HA          120 GLU  HN          4.20    (#   2086:10  Unique         2.86, 2.92 A)
 &rst
  ixpk= 2086, nxpk= 10, iat=1943,1941, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:2087   120 GLU  HN          3.50    (#   2087:10  Single Ambig)
 &rst
  ixpk= 2087, nxpk= 10, iat=  -1,1941, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1862, 881,1893,
 &end
#
#  119 PRO  HB-         120 GLU  HN          4.20    (#   2090:10  Unique         2.72, 3.55 A)
 &rst
  ixpk= 2090, nxpk= 10, iat=  -1,1941, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1934,1935,
 &end
#
#    0 AMB  10-2:2091   122 ASP  HN          5.50    (#   2091:10  Single Ambig)
 &rst
  ixpk= 2091, nxpk= 10, iat=  -1,1976, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1990,1991, 416,
 &end
#
#  122 ASP  HA          122 ASP  HN          5.50    (#   2092:10  Unique         2.27, 2.58 A)
 &rst
  ixpk= 2092, nxpk= 10, iat=1978,1976, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2093     0 AMB  10-1:2093   5.50    (#   2093:10  Double Ambig)
 &rst
  ixpk= 2093, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 446, 454,1364,1419,
 igr2=1976,1428,
 &end
#
#  124 TRP  HN          123 GLY  HN          5.50    (#   2094:10  Unique         3.76, 4.31 A)
 &rst
  ixpk= 2094, nxpk= 10, iat=1995,1988, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  121 PHE  HB-         123 GLY  HN          5.50    (#   2095:10  Unique         2.57, 3.60 A)
 &rst
  ixpk= 2095, nxpk= 10, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1960,1961,
 &end
#
#  127 VAL  MGY         126 TRP  HN          5.50    (#   2096:10  Unique         4.21, 6.00 A)
 &rst
  ixpk= 2096, nxpk= 10, iat=  -1,2043, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2073,2074,2075,2077,2078,2079,
 &end
#
#  128 SER  HN          127 VAL  HN          5.50    (#   2097:10  Unique         2.76, 4.17 A)
 &rst
  ixpk= 2097, nxpk= 10, iat=2083,2067, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  130 TRP  HA          130 TRP  HN          5.50    (#   2098:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 2098, nxpk= 10, iat=2117,2115, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2099   138 SER  HN          5.50    (#   2099:10  Single Ambig)
 &rst
  ixpk= 2099, nxpk= 10, iat=  -1,2263, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2323,2324,2304,2305,
 &end
#
#  138 SER  HB+         139 PHE  HN          3.50    (#   2100:10  Unique         2.75, 3.67 A)
 &rst
  ixpk= 2100, nxpk= 10, iat=  -1,2274, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2267,2268,
 &end
#
#    0 AMB  10-2:2101     0 AMB  10-1:2101   5.50    (#   2101:10  Double Ambig)
 &rst
  ixpk= 2101, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2265,2391,
 igr2=2274,2413,
 &end
#
#  139 PHE  HB+         140 LYS  HN          5.50    (#   2102:10  Unique         2.80, 3.59 A)
 &rst
  ixpk= 2102, nxpk= 10, iat=  -1,2294, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2278,2279,
 &end
#
#    0 AMB  10-2:2103   141 ARG  HN          5.50    (#   2103:10  Single Ambig)
 &rst
  ixpk= 2103, nxpk= 10, iat=  -1,2316, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2326,2327,2372,2373,
 &end
#
#  140 LYS  HB-         141 ARG  HN          5.50    (#   2104:10  Unique         3.59, 4.21 A)
 &rst
  ixpk= 2104, nxpk= 10, iat=  -1,2316, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2298,2299,
 &end
#
#  141 ARG  HB+         142 ASP  HN          4.20    (#   2105:10  Unique         2.57, 3.52 A)
 &rst
  ixpk= 2105, nxpk= 10, iat=  -1,2340, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2320,2321,
 &end
#
#    0 AMB  10-2:2106   143 VAL  HN          5.50    (#   2106:10  Single Ambig)
 &rst
  ixpk= 2106, nxpk= 10, iat=  -1,2352, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2372,2373,2423,2424,2326,2327,
 &end
#
#  144 TYR  HA          145 ARG  HN          5.50    (#   2107:10  Unique         3.49, 3.50 A)
 &rst
  ixpk= 2107, nxpk= 10, iat=2370,2389, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  147 VAL  MGY         146 ARG  HN          5.50    (#   2108:10  Unique         3.60, 5.97 A)
 &rst
  ixpk= 2108, nxpk= 10, iat=  -1,2413, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2443,2444,2445,2447,2448,2449,
 &end
#
#    0 AMB  10-2:2109     0 AMB  10-1:2109   3.50    (#   2109:10  Double Ambig)
 &rst
  ixpk= 2109, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2265,2391,
 igr2=2274,2413,
 &end
#
#    0 AMB  10-2:2110   149 LYS  HN          4.20    (#   2110:10  Single Ambig)
 &rst
  ixpk= 2110, nxpk= 10, iat=  -1,2470, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2453,2437,
 &end
#
#  151 PHE  HN          150 GLU  HN          2.80    (#   2111:10  Unique         2.37, 2.44 A)
 &rst
  ixpk= 2111, nxpk= 10, iat=2507,2492, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  110 GLU  HA          110 GLU  HN          2.80    (#   2112:10  Unique         2.82, 2.88 A)
 &rst
  ixpk= 2112, nxpk= 10, iat=1797,1795, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:2113   151 PHE  HN          2.80    (#   2113:10  Single Ambig)
 &rst
  ixpk= 2113, nxpk= 10, iat=  -1,2507, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=2527,2492,
 &end
#
#    0 AMB  10-2:2114   153 SER  HN          5.50    (#   2114:10  Single Ambig)
 &rst
  ixpk= 2114, nxpk= 10, iat=  -1,2537, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2591,2592,2593,2552,
 &end
#
#  155 VAL  HN          154 VAL  HN          2.80    (#   2115:10  Unique         2.48, 2.59 A)
 &rst
  ixpk= 2115, nxpk= 10, iat=2564,2548, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#  154 VAL  HN          155 VAL  HN          2.80    (#   2116:10  Unique         2.48, 2.59 A)
 &rst
  ixpk= 2116, nxpk= 10, iat=2548,2564, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:2117   155 VAL  HN          5.50    (#   2117:10  Single Ambig)
 &rst
  ixpk= 2117, nxpk= 10, iat=  -1,2564, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=2584,2585,2631,2632,2499,2500,2648,2649,
 &end
#
#  155 VAL  HA          156 MET  HN          4.20    (#   2118:10  Unique         3.51, 3.52 A)
 &rst
  ixpk= 2118, nxpk= 10, iat=2566,2580, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#  155 VAL  HN          156 MET  HN          3.50    (#   2119:10  Unique         2.66, 2.73 A)
 &rst
  ixpk= 2119, nxpk= 10, iat=2564,2580, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  159 GLN  HB+         159 GLN  HN          3.50    (#   2120:10  Unique         2.32, 2.99 A)
 &rst
  ixpk= 2120, nxpk= 10, iat=  -1,2627, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2631,2632,
 &end
#
#  157 SER  HA          159 GLN  HN          4.20    (#   2121:10  Unique         4.72, 5.04 A)
 &rst
  ixpk= 2121, nxpk= 10, iat=2599,2627, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:2122   160 GLU  HN          5.50    (#   2122:10  Single Ambig)
 &rst
  ixpk= 2122, nxpk= 10, iat=  -1,2644, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2617,2618,2619,2621,2622,2623,2617,2618,2619,2621,
      2622,2623,2570,2571,2572,2574,2575,2576,
 &end
#
#  157 SER  HA          160 GLU  HN          3.50    (#   2123:10  Unique         3.71, 3.87 A)
 &rst
  ixpk= 2123, nxpk= 10, iat=2599,2644, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  161 ASN  HB+         162 THR  HN          5.50    (#   2124:10  Unique         2.84, 3.87 A)
 &rst
  ixpk= 2124, nxpk= 10, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2663,2664,
 &end
#
#    0 AMB  10-2:2125   162 THR  HN          4.20    (#   2125:10  Single Ambig)
 &rst
  ixpk= 2125, nxpk= 10, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=2629,2646,
 &end
#
#  126 TRP  HB+          22 VAL  HN          5.50    (#   2128:10  Unique         3.05, 4.66 A)
 &rst
  ixpk= 2128, nxpk= 10, iat=  -1, 323, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2047,2048,
 &end
#
#  104 LEU  HN          107 GLY  HN          5.50    (#   2129:10  Unique         6.39, 6.90 A)
 &rst
  ixpk= 2129, nxpk= 10, iat=1720,1766, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  121 PHE  HA          123 GLY  HN          5.50    (#   2132:10  Unique         3.26, 3.95 A)
 &rst
  ixpk= 2132, nxpk= 10, iat=1958,1988, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  121 PHE  HN          123 GLY  HN          5.50    (#   2133:10  Unique         3.59, 5.05 A)
 &rst
  ixpk= 2133, nxpk= 10, iat=1956,1988, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   35 PHE  HN           34 GLN  HN          5.50    (#   2134:10  Unique         2.17, 3.73 A)
 &rst
  ixpk= 2134, nxpk= 10, iat= 551, 534, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2135    56 GLU  HN          5.50    (#   2135:10  Single Ambig)
 &rst
  ixpk= 2135, nxpk= 10, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 894, 854, 858,
 &end
#
#  122 ASP  HB+         122 ASP  HN          5.50    (#   2136:10  Unique         2.24, 3.07 A)
 &rst
  ixpk= 2136, nxpk= 10, iat=  -1,1976, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1980,1981,
 &end
#
#   31 HIS  HA           33 TRP  HE1         5.50    (#   2137:10  Unique         5.27, 6.59 A)
 &rst
  ixpk= 2137, nxpk= 10, iat= 484, 520, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  125 ARG  HD-          33 TRP  HE1         5.50    (#   2138:10  Unique         4.65, 7.14 A)
 &rst
  ixpk= 2138, nxpk= 10, iat=  -1, 520, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2029,2030,
 &end
#
#    0 AMB  10-2:2140    33 TRP  HE1         5.50    (#   2140:10  Single Ambig)
 &rst
  ixpk= 2140, nxpk= 10, iat=  -1, 520, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 514, 515, 486, 487, 392,
 &end
#
#  140 LYS  HG-         140 LYS  HN          5.50    (#   2141:10  Unique         2.53, 4.25 A)
 &rst
  ixpk= 2141, nxpk= 10, iat=  -1,2294, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2301,2302,
 &end
#
#    0 AMB  10-2:2142   140 LYS  HN          5.50    (#   2142:10  Single Ambig)
 &rst
  ixpk= 2142, nxpk= 10, iat=  -1,2294, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2304,2305,2323,2324,
 &end
#
#   27 ARG  HN           28 PHE  HN          5.50    (#   2143:10  Unique         4.40, 4.50 A)
 &rst
  ixpk= 2143, nxpk= 10, iat= 414, 438, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2145    24 TRP  HE1         5.50    (#   2145:10  Single Ambig)
 &rst
  ixpk= 2145, nxpk= 10, iat=  -1, 366, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 369,2149,2154,
 &end
#
#  124 TRP  HB-         124 TRP  HN          5.50    (#   2150:10  Unique         2.26, 3.25 A)
 &rst
  ixpk= 2150, nxpk= 10, iat=  -1,1995, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1999,2000,
 &end
#
#    0 AMB  10-2:2152    99 TRP  HE1         5.50    (#   2152:10  Single Ambig)
 &rst
  ixpk= 2152, nxpk= 10, iat=  -1,1631, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1621,2352,
 &end
#
#   82 ARG  HG+          82 ARG  HE          5.50    (#   2155:10  Unique         2.09, 3.12 A)
 &rst
  ixpk= 2155, nxpk= 10, iat=  -1,1334, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1328,1329,
 &end
#
#   82 ARG  HG-          82 ARG  HE          5.50    (#   2156:10  Unique         2.09, 3.12 A)
 &rst
  ixpk= 2156, nxpk= 10, iat=  -1,1334, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1328,1329,
 &end
#
#   72 ARG  HB+          72 ARG  HE          4.20    (#   2157:10  Unique         2.04, 3.77 A)
 &rst
  ixpk= 2157, nxpk= 10, iat=  -1,1131, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1122,1123,
 &end
#
#    0 AMB  10-2:2159    79 LEU  HN          5.50    (#   2159:10  Single Ambig)
 &rst
  ixpk= 2159, nxpk= 10, iat=  -1,1266, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1251,1252,1349,1350,1547,1548,
 &end
#
#    0 AMB  10-2:2160    83 LEU  HN          4.20    (#   2160:10  Single Ambig)
 &rst
  ixpk= 2160, nxpk= 10, iat=  -1,1345, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1=1289,1290,1325,1326,
 &end
#
#   89 LYS  HG-          89 LYS  HN          5.50    (#   2161:10  Unique         3.17, 3.62 A)
 &rst
  ixpk= 2161, nxpk= 10, iat=  -1,1454, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1461,1462,
 &end
#
#   21 GLN  HG-          21 GLN  HN          4.20    (#   2162:10  Unique         1.94, 3.20 A)
 &rst
  ixpk= 2162, nxpk= 10, iat=  -1, 306, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 313, 314,
 &end
#
#    0 AMB  10-2:2163     0 AMB  10-1:2163   4.20    (#   2163:10  Double Ambig)
 &rst
  ixpk= 2163, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 472, 473, 592, 593,
 igr2= 465, 585,
 &end
#
#   37 GLN  HB+          37 GLN  HN          5.50    (#   2164:10  Unique         2.30, 3.19 A)
 &rst
  ixpk= 2164, nxpk= 10, iat=  -1, 585, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 589, 590,
 &end
#
#    0 AMB  10-2:2165    16 CYS  HN          5.50    (#   2165:10  Single Ambig)
 &rst
  ixpk= 2165, nxpk= 10, iat=  -1, 233, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 224, 225,2612,2613,
 &end
#
#  124 TRP  HB+         125 ARG  HN          5.50    (#   2166:10  Unique         2.47, 3.68 A)
 &rst
  ixpk= 2166, nxpk= 10, iat=  -1,2019, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1999,2000,
 &end
#
#  108 ASP  HA          107 GLY  HN          5.50    (#   2167:10  Unique         4.75, 4.87 A)
 &rst
  ixpk= 2167, nxpk= 10, iat=1775,1766, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   92 CYS  HB+          93 ILE  HN          5.50    (#   2168:10  Unique         2.93, 3.57 A)
 &rst
  ixpk= 2168, nxpk= 10, iat=  -1,1517, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1510,1511,
 &end
#
#    0 AMB  10-2:2169    64 ASP  HN          5.50    (#   2169:10  Single Ambig)
 &rst
  ixpk= 2169, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 921, 922, 951, 952,1727,
 &end
#
#   63 LYS  HD-          63 LYS  HN          5.50    (#   2170:10  Unique         4.23, 4.53 A)
 &rst
  ixpk= 2170, nxpk= 10, iat=  -1, 971, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 981, 982,
 &end
#
#    0 AMB  10-2:2171    65 VAL  HN          5.50    (#   2171:10  Single Ambig)
 &rst
  ixpk= 2171, nxpk= 10, iat=  -1,1005, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 981, 982, 832, 224, 225,
 &end
#
#   19 GLN  HG+          19 GLN  HE2-        5.50    (#   2172:10  Unique         2.12, 3.24 A)
 &rst
  ixpk= 2172, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 289, 290,
 igr2= 294, 295,
 &end
#
#   19 GLN  HG+          19 GLN  HE2+        5.50    (#   2173:10  Unique         2.12, 3.24 A)
 &rst
  ixpk= 2173, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 289, 290,
 igr2= 294, 295,
 &end
#
#   72 ARG  HD+          73 ASN  HD2+        5.50    (#   2174:10  Unique         3.37, 5.25 A)
 &rst
  ixpk= 2174, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1128,1129,
 igr2=1151,1152,
 &end
#
#   72 ARG  HD+          73 ASN  HD2-        5.50    (#   2175:10  Unique         3.37, 5.25 A)
 &rst
  ixpk= 2175, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1128,1129,
 igr2=1151,1152,
 &end
#
#    0 AMB  10-2:2176    54 LEU  HN          4.20    (#   2176:10  Single Ambig)
 &rst
  ixpk= 2176, nxpk= 10, iat=  -1, 825, r1= 0.00, r2= 1.80, r3= 5.49, r4= 6.24,
 igr1= 192, 193, 194, 189, 190,
 &end
#
#   97 GLN  HG+          97 GLN  HE2-        5.50    (#   2177:10  Unique         2.12, 3.42 A)
 &rst
  ixpk= 2177, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1589,1590,
 igr2=1594,1595,
 &end
#
#   79 LEU  MDX          84 VAL  HN          4.20    (#   2178:10  Unique         3.90, 5.70 A)
 &rst
  ixpk= 2178, nxpk= 10, iat=  -1,1364, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1275,1276,1277,1279,1280,1281,
 &end
#
#   18 ARG  HG-         103 GLN  HE2+        5.50    (#   2179:10  Unique         1.95, 3.96 A)
 &rst
  ixpk= 2179, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 265, 266,
 igr2=1715,1716,
 &end
#
#  103 GLN  HB+         103 GLN  HE2+        5.50    (#   2180:10  Unique         1.93, 3.70 A)
 &rst
  ixpk= 2180, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1707,1708,
 igr2=1715,1716,
 &end
#
#    0 AMB  10-2:2181     0 AMB  10-1:2181   5.50    (#   2181:10  Double Ambig)
 &rst
  ixpk= 2181, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.73, r4= 9.48,
 igr1=1864,1865,1867,1868,
 igr2=1872,1873,1872,1873,
 &end
#
#   47 GLU  HB+          48 GLN  HE2+        5.50    (#   2182:10  Unique         1.98, 4.16 A)
 &rst
  ixpk= 2182, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 710, 711,
 igr2= 733, 734,
 &end
#
#   72 ARG  HG-          73 ASN  HD2-        5.50    (#   2183:10  Unique         1.95, 5.20 A)
 &rst
  ixpk= 2183, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1125,1126,
 igr2=1151,1152,
 &end
#
#   72 ARG  HG-          73 ASN  HD2+        5.50    (#   2184:10  Unique         1.95, 5.20 A)
 &rst
  ixpk= 2184, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1125,1126,
 igr2=1151,1152,
 &end
#
#   79 LEU  MDY          95 GLN  HE2-        5.50    (#   2185:10  Unique         2.50, 5.13 A)
 &rst
  ixpk= 2185, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1275,1276,1277,1279,1280,1281,
 igr2=1555,1556,
 &end
#
#   97 GLN  HG+          97 GLN  HE2+        5.50    (#   2186:10  Unique         2.12, 3.42 A)
 &rst
  ixpk= 2186, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1589,1590,
 igr2=1594,1595,
 &end
#
#   97 GLN  HG-          97 GLN  HE2+        5.50    (#   2187:10  Unique         2.12, 3.42 A)
 &rst
  ixpk= 2187, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1589,1590,
 igr2=1594,1595,
 &end
#
#  119 PRO  HG+         114 GLN  HE2-        5.50    (#   2188:10  Unique         6.02, 8.61 A)
 &rst
  ixpk= 2188, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1931,1932,
 igr2=1872,1873,
 &end
#
#  112 ASN  HN          112 ASN  HD2+        5.50    (#   2189:10  Unique         4.13, 5.14 A)
 &rst
  ixpk= 2189, nxpk= 10, iat=1829,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1838,1839,
 &end
#
#  112 ASN  HN          112 ASN  HD2-        5.50    (#   2190:10  Unique         4.13, 5.14 A)
 &rst
  ixpk= 2190, nxpk= 10, iat=1829,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr2=1838,1839,
 &end
#
#    0 AMB  10-2:2191     0 AMB  10-1:2191   5.50    (#   2191:10  Double Ambig)
 &rst
  ixpk= 2191, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1860, 786,
 igr2=1872,1873, 733, 734,
 &end
#
#    0 AMB  10-2:2192   114 GLN  HE2-        5.50    (#   2192:10  Single Ambig)
 &rst
  ixpk= 2192, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1862,1893,
 igr2=1872,1873,
 &end
#
#  135 GLN  HB+         135 GLN  HE2+        5.50    (#   2193:10  Unique         3.86, 4.62 A)
 &rst
  ixpk= 2193, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2218,2219,
 igr2=2226,2227,
 &end
#
#  157 SER  HB+         161 ASN  HD2+        5.50    (#   2194:10  Unique         2.17, 4.06 A)
 &rst
  ixpk= 2194, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2601,2602,
 igr2=2668,2669,
 &end
#
#  157 SER  HB+         161 ASN  HD2-        5.50    (#   2195:10  Unique         2.17, 4.06 A)
 &rst
  ixpk= 2195, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2601,2602,
 igr2=2668,2669,
 &end
#
#   48 GLN  HB-          48 GLN  HE2-        5.50    (#   2196:10  Unique         3.70, 4.46 A)
 &rst
  ixpk= 2196, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 725, 726,
 igr2= 733, 734,
 &end
#
#    0 AMB  10-2:2197   114 GLN  HE2-        5.50    (#   2197:10  Single Ambig)
 &rst
  ixpk= 2197, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1864,1865,1867,1868,
 igr2=1872,1873,
 &end
#
#  114 GLN  HB-         114 GLN  HE2-        5.50    (#   2198:10  Unique         2.05, 3.50 A)
 &rst
  ixpk= 2198, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1864,1865,
 igr2=1872,1873,
 &end
#
#  114 GLN  HB-         114 GLN  HE2-        5.50    (#   2199:10  Unique         2.05, 3.50 A)
 &rst
  ixpk= 2199, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1864,1865,
 igr2=1872,1873,
 &end
#
#    0 AMB  10-2:2200    52 ARG  HN          4.20    (#   2200:10  Single Ambig)
 &rst
  ixpk= 2200, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 5.29, r4= 6.04,
 igr1= 793, 794, 752, 753,
 &end
#
#    0 AMB  10-2:2201    52 ARG  HN          4.20    (#   2201:10  Single Ambig)
 &rst
  ixpk= 2201, nxpk= 10, iat=  -1, 786, r1= 0.00, r2= 1.80, r3= 5.49, r4= 6.24,
 igr1= 829, 830, 742, 743, 744,
 &end
#
#   60 LEU  HB-          60 LEU  HN          4.20    (#   2202:10  Unique         2.12, 2.74 A)
 &rst
  ixpk= 2202, nxpk= 10, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1= 921, 922,
 &end
#
#   87 ASP  HN           85 ARG  HE          5.50    (#   2203:10  Unique         3.76, 4.97 A)
 &rst
  ixpk= 2203, nxpk= 10, iat=1428,1393, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   15 ILE  HA           15 ILE  HN          5.50    (#   2207:10  Unique         2.90, 2.92 A)
 &rst
  ixpk= 2207, nxpk= 10, iat= 216, 214, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    2 ILE  QD1           2 ILE  HN          5.50    (#   2208:10  Unique         2.52, 4.38 A)
 &rst
  ixpk= 2208, nxpk= 10, iat=  -1,  21, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=  34,  35,  36,
 &end
#
#    0 AMB  10-2:2209     0 AMB  10-1:2209   3.50    (#   2209:10  Double Ambig)
 &rst
  ixpk= 2209, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  25,2023,2024,
 igr2=  21,2043,
 &end
#
#    7 TYR  HN            3 ASP  HN          5.50    (#   2210:10  Unique         2.91, 3.43 A)
 &rst
  ixpk= 2210, nxpk= 10, iat=  83,  40, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   23 MET  HB+          23 MET  HN          5.50    (#   2211:10  Unique         2.13, 2.86 A)
 &rst
  ixpk= 2211, nxpk= 10, iat=  -1, 339, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 343, 344,
 &end
#
#    0 AMB  10-2:2212     0 AMB  10-1:2212   5.50    (#   2212:10  Double Ambig)
 &rst
  ixpk= 2212, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1547,1548, 713, 714,
 igr2=1543, 706,
 &end
#
#    8 ARG  HD-          95 GLN  HN          5.50    (#   2213:10  Unique         6.74, 7.65 A)
 &rst
  ixpk= 2213, nxpk= 10, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 114, 115,
 &end
#
#   18 ARG  HA           20 GLY  HN          4.20    (#   2214:10  Unique         3.46, 3.72 A)
 &rst
  ixpk= 2214, nxpk= 10, iat= 260, 299, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   74 TRP  HB-          74 TRP  HN          2.80    (#   2215:10  Unique         2.45, 3.07 A)
 &rst
  ixpk= 2215, nxpk= 10, iat=  -1,1156, r1= 0.00, r2= 1.80, r3= 3.14, r4= 3.89,
 igr1=1160,1161,
 &end
#
#    0 AMB  10-2:2216    19 GLN  HN          5.50    (#   2216:10  Single Ambig)
 &rst
  ixpk= 2216, nxpk= 10, iat=  -1, 282, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 237, 238,2098,2099,
 &end
#
#   61 SER  HB+          61 SER  HN          3.50    (#   2218:10  Unique         2.13, 3.09 A)
 &rst
  ixpk= 2218, nxpk= 10, iat=  -1, 936, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 940, 941,
 &end
#
#    0 AMB  10-2:2219    67 ILE  HN          5.50    (#   2219:10  Single Ambig)
 &rst
  ixpk= 2219, nxpk= 10, iat=  -1,1045, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1028,1029,1691,
 &end
#
#   99 TRP  HE3          13 ILE  HN          5.50    (#   2220:10  Unique         4.57, 4.87 A)
 &rst
  ixpk= 2220, nxpk= 10, iat=1640, 179, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   34 GLN  HN           35 PHE  HN          5.50    (#   2221:10  Unique         2.17, 3.73 A)
 &rst
  ixpk= 2221, nxpk= 10, iat= 534, 551, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   96 LYS  HN           97 GLN  HN          5.50    (#   2222:10  Unique         4.39, 4.46 A)
 &rst
  ixpk= 2222, nxpk= 10, iat=1560,1582, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2223    64 ASP  HN          4.20    (#   2223:10  Single Ambig)
 &rst
  ixpk= 2223, nxpk= 10, iat=  -1, 993, r1= 0.00, r2= 1.80, r3= 6.35, r4= 7.10,
 igr1=1745,1746,1747,1749,1750,1751, 834, 835, 836, 838,
       839, 840,
 &end
#
#   13 ILE  HN           37 GLN  HN          5.50    (#   2225:10  Unique         4.75, 5.23 A)
 &rst
  ixpk= 2225, nxpk= 10, iat= 179, 585, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2226    69 ALA  HN          5.50    (#   2226:10  Single Ambig)
 &rst
  ixpk= 2226, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1=1688,1689,1055,1056,1025,1026,2612,2613,
 &end
#
#  101 LEU  HG           69 ALA  HN          5.50    (#   2227:10  Unique         2.88, 3.81 A)
 &rst
  ixpk= 2227, nxpk= 10, iat=1672,1083, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2228    69 ALA  HN          4.20    (#   2228:10  Single Ambig)
 &rst
  ixpk= 2228, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1693,1694,1695,1697,1698,1699,1058,1059,1060,
 &end
#
#   68 LEU  HB-          69 ALA  HN          5.50    (#   2229:10  Unique         2.46, 3.30 A)
 &rst
  ixpk= 2229, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1068,1069,
 &end
#
#    0 AMB  10-2:2231     0 AMB  10-1:2231   3.50    (#   2231:10  Double Ambig)
 &rst
  ixpk= 2231, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2197,2198,2396,2397,
 igr2=2226,2227,2226,2227,
 &end
#
#  134 ARG  HG+         135 GLN  HE2-        5.50    (#   2232:10  Unique         4.17, 4.96 A)
 &rst
  ixpk= 2232, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2197,2198,
 igr2=2226,2227,
 &end
#
#   33 TRP  HE1          33 TRP  HN          5.50    (#   2233:10  Unique         4.09, 4.92 A)
 &rst
  ixpk= 2233, nxpk= 10, iat= 520, 510, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   82 ARG  HN           81 LYS  HN          2.80    (#   2234:10  Unique         2.49, 2.62 A)
 &rst
  ixpk= 2234, nxpk= 10, iat=1321,1299, r1= 0.00, r2= 1.80, r3= 2.80, r4= 3.55,  &end
#
#    0 AMB  10-2:2235    13 ILE  HN          5.50    (#   2235:10  Single Ambig)
 &rst
  ixpk= 2235, nxpk= 10, iat=  -1, 179, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 602, 879,
 &end
#
#   99 TRP  HA           14 VAL  HN          5.50    (#   2236:10  Unique         5.28, 5.43 A)
 &rst
  ixpk= 2236, nxpk= 10, iat=1623, 198, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  102 LEU  HN           16 CYS  HN          4.20    (#   2237:10  Unique         3.75, 3.96 A)
 &rst
  ixpk= 2237, nxpk= 10, iat=1684, 233, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#   26 ARG  HN          123 GLY  HN          5.50    (#   2239:10  Unique         3.98, 5.66 A)
 &rst
  ixpk= 2239, nxpk= 10, iat= 390,1988, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  101 LEU  HN           68 LEU  HN          5.50    (#   2240:10  Unique         4.16, 4.46 A)
 &rst
  ixpk= 2240, nxpk= 10, iat=1665,1064, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   14 VAL  HN          102 LEU  HN          5.50    (#   2241:10  Unique         3.58, 4.07 A)
 &rst
  ixpk= 2241, nxpk= 10, iat= 198,1684, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  149 LYS  HN          147 VAL  HN          5.50    (#   2242:10  Unique         3.77, 3.82 A)
 &rst
  ixpk= 2242, nxpk= 10, iat=2470,2437, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  154 VAL  HN          152 ALA  HN          5.50    (#   2243:10  Unique         4.23, 4.44 A)
 &rst
  ixpk= 2243, nxpk= 10, iat=2548,2527, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#   21 GLN  HG+          22 VAL  HN          5.50    (#   2244:10  Unique         3.90, 4.76 A)
 &rst
  ixpk= 2244, nxpk= 10, iat=  -1, 323, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 313, 314,
 &end
#
#   24 TRP  HE1          33 TRP  HN          5.50    (#   2246:10  Unique         8.60,10.17 A)
 &rst
  ixpk= 2246, nxpk= 10, iat= 366, 510, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#    0 AMB  10-2:2247   122 ASP  HN          5.50    (#   2247:10  Single Ambig)
 &rst
  ixpk= 2247, nxpk= 10, iat=  -1,1976, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1941, 438,
 &end
#
#  101 LEU  MDY         155 VAL  HN          3.50    (#   2248:10  Unique         3.95, 5.70 A)
 &rst
  ixpk= 2248, nxpk= 10, iat=  -1,2564, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#  101 LEU  MDX         155 VAL  HN          5.50    (#   2249:10  Unique         3.95, 5.70 A)
 &rst
  ixpk= 2249, nxpk= 10, iat=  -1,2564, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1674,1675,1676,1678,1679,1680,
 &end
#
#    0 AMB  10-2:2250    86 TRP  HE1         4.20    (#   2250:10  Single Ambig)
 &rst
  ixpk= 2250, nxpk= 10, iat=  -1,1414, r1= 0.00, r2= 1.80, r3= 5.49, r4= 6.24,
 igr1=1309,1310,1384,1385,1494,
 &end
#
#  102 LEU  HG          102 LEU  HN          4.20    (#   2251:10  Unique         2.08, 2.37 A)
 &rst
  ixpk= 2251, nxpk= 10, iat=1691,1684, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    0 AMB  10-2:2252   136 VAL  HN          5.50    (#   2252:10  Single Ambig)
 &rst
  ixpk= 2252, nxpk= 10, iat=  -1,2231, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2167,2168,2304,2305,
 &end
#
#    0 AMB  10-2:2253     0 AMB  10-1:2253   5.50    (#   2253:10  Double Ambig)
 &rst
  ixpk= 2253, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1206,1207,1570,1571,1609,1610,
 igr2=1543, 706,
 &end
#
#    0 AMB  10-2:2254    69 ALA  HN          3.50    (#   2254:10  Single Ambig)
 &rst
  ixpk= 2254, nxpk= 10, iat=  -1,1083, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=1693,1694,1695,1697,1698,1699,1073,1074,1075,1077,
      1078,1079,1055,1056,
 &end
#
#   66 ARG  HG-          66 ARG  HN          4.20    (#   2255:10  Unique         2.68, 3.70 A)
 &rst
  ixpk= 2255, nxpk= 10, iat=  -1,1021, r1= 0.00, r2= 1.80, r3= 4.71, r4= 5.46,
 igr1=1028,1029,
 &end
#
#  134 ARG  HD+         134 ARG  HE          3.50    (#   2257:10  Unique         2.28, 2.74 A)
 &rst
  ixpk= 2257, nxpk= 10, iat=  -1,2203, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2200,2201,
 &end
#
#    0 AMB  10-2:2258     0 AMB  10-1:2258   5.50    (#   2258:10  Double Ambig)
 &rst
  ixpk= 2258, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.78, r4= 8.53,
 igr1= 262, 263,2194,2195,
 igr2= 271,2203,
 &end
#
#   40 ILE  QD1          11 VAL  HN          5.50    (#   2259:10  Unique         4.04, 5.59 A)
 &rst
  ixpk= 2259, nxpk= 10, iat=  -1, 156, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 629, 630, 631,
 &end
#
#    9 PRO  HG+          40 ILE  HN          5.50    (#   2261:10  Unique         2.63, 4.15 A)
 &rst
  ixpk= 2261, nxpk= 10, iat=  -1, 616, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 132, 133,
 &end
#
#  132 PRO  HB-          24 TRP  HE1         5.50    (#   2262:10  Unique         2.00, 6.36 A)
 &rst
  ixpk= 2262, nxpk= 10, iat=  -1, 366, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2167,2168,
 &end
#
#    0 AMB  10-2:2264    74 TRP  HE1         5.50    (#   2264:10  Single Ambig)
 &rst
  ixpk= 2264, nxpk= 10, iat=  -1,1166, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 700, 701, 702,1203,1204,
 &end
#
#  161 ASN  HD2+        162 THR  HN          5.50    (#   2267:10  Unique)
 &rst
  ixpk= 2267, nxpk= 10, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2668,2669,
 &end
#
#  154 VAL  HA          155 VAL  HN          5.50    (#   2269:10  Unique         3.51, 3.53 A)
 &rst
  ixpk= 2269, nxpk= 10, iat=2550,2564, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,  &end
#
#  152 ALA  HA          155 VAL  HN          4.20    (#   2270:10  Unique         3.10, 3.33 A)
 &rst
  ixpk= 2270, nxpk= 10, iat=2529,2564, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,  &end
#
#    8 ARG  HD-          95 GLN  HE2+        5.50    (#   2271:10  Unique         3.72, 6.33 A)
 &rst
  ixpk= 2271, nxpk= 10, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 114, 115,
 igr2=1555,1556,
 &end
#
#  100 PHE  HD          101 LEU  HN          5.50    (#   2272:10  Unique         3.56, 4.55 A)
 &rst
  ixpk= 2272, nxpk= 10, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1653,1661,
 &end
#
#    0 AMB  10-2:2273   126 TRP  HN          2.80    (#   2273:10  Single Ambig)
 &rst
  ixpk= 2273, nxpk= 10, iat=  -1,2043, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=2023,2024, 310, 311,
 &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  -1.213   0.168  -2.365
    2    H2   MET   1           H2       MET   1  -0.568  -0.664  -1.104
    3    H3   MET   1           H3       MET   1  -0.018   0.861  -1.424
    4    HA   MET   1           HA       MET   1   0.756  -0.016  -3.597
    5    HB2  MET   1           HB2      MET   1   2.625   0.184  -2.480
    6    HB3  MET   1           HB3      MET   1   1.827  -0.042  -0.955
    7    HG2  MET   1           HG2      MET   1   3.916  -1.383  -1.596
    8    HG3  MET   1           HG3      MET   1   2.668  -2.061  -0.572
    9    HE1  MET   1           HE1      MET   1   5.158  -3.215  -3.036
   10    HE2  MET   1           HE2      MET   1   4.706  -3.917  -1.448
   11    HE3  MET   1           HE3      MET   1   4.423  -4.836  -2.958
   12    H    ILE   2           H        ILE   2   0.983  -1.964  -4.918
   13    HA   ILE   2           HA       ILE   2   0.059  -4.474  -3.851
   14    HB   ILE   2           HB       ILE   2  -0.943  -3.242  -6.432
   15   HG12  ILE   2          HG12      ILE   2  -2.147  -3.618  -3.764
   16   HG13  ILE   2          HG13      ILE   2  -2.554  -2.486  -5.049
   17   HG21  ILE   2          HG21      ILE   2  -0.343  -5.578  -6.874
   18   HG22  ILE   2          HG22      ILE   2  -1.355  -6.107  -5.506
   19   HG23  ILE   2          HG23      ILE   2  -2.084  -5.363  -6.947
   20   HD11  ILE   2          HD11      ILE   2  -3.934  -4.301  -6.088
   21   HD12  ILE   2          HD12      ILE   2  -3.478  -5.362  -4.726
   22   HD13  ILE   2          HD13      ILE   2  -4.396  -3.864  -4.433
   23    H    ASP   3           H        ASP   3   1.373  -6.160  -4.865
   24    HA   ASP   3           HA       ASP   3   4.018  -5.153  -5.355
   25    HB2  ASP   3           HB2      ASP   3   3.575  -7.251  -4.145
   26    HB3  ASP   3           HB3      ASP   3   2.858  -7.961  -5.591
   27    H    ASP   4           H        ASP   4   2.033  -7.328  -7.448
   28    HA   ASP   4           HA       ASP   4   2.448  -5.653  -9.811
   29    HB2  ASP   4           HB2      ASP   4   4.644  -6.731  -9.719
   30    HB3  ASP   4           HB3      ASP   4   3.900  -8.320  -9.532
   31    H    ASP   5           H        ASP   5   1.879  -9.035  -8.782
   32    HA   ASP   5           HA       ASP   5   0.045  -9.417 -10.995
   33    HB2  ASP   5           HB2      ASP   5   1.891 -10.976 -10.368
   34    HB3  ASP   5           HB3      ASP   5   1.000 -11.397  -8.904
   35    H    GLY   6           H        GLY   6  -0.688  -7.863  -8.480
   36    HA2  GLY   6           HA2      GLY   6  -2.847  -7.370  -7.718
   37    HA3  GLY   6           HA3      GLY   6  -3.411  -8.964  -8.231
   38    H    TYR   7           H        TYR   7  -0.569  -9.465  -6.463
   39    HA   TYR   7           HA       TYR   7  -2.083  -9.762  -3.900
   40    HB2  TYR   7           HB2      TYR   7   0.645 -10.835  -4.641
   41    HB3  TYR   7           HB3      TYR   7  -0.181 -11.108  -3.111
   42    HD1  TYR   7           HD1      TYR   7  -2.250 -12.690  -3.090
   43    HD2  TYR   7           HD2      TYR   7   0.067 -11.898  -6.656
   44    HE1  TYR   7           HE1      TYR   7  -3.335 -14.620  -4.251
   45    HE2  TYR   7           HE2      TYR   7  -0.934 -13.766  -7.774
   46    HH   TYR   7           HH       TYR   7  -2.375 -15.154  -7.755
   47    H    ARG   8           H        ARG   8  -1.008  -8.964  -1.949
   48    HA   ARG   8           HA       ARG   8   1.121  -6.987  -2.441
   49    HB2  ARG   8           HB2      ARG   8  -0.014  -5.222  -1.248
   50    HB3  ARG   8           HB3      ARG   8  -0.951  -5.756  -2.652
   51    HG2  ARG   8           HG2      ARG   8  -1.817  -7.302  -0.402
   52    HG3  ARG   8           HG3      ARG   8  -1.676  -5.632   0.083
   53    HD2  ARG   8           HD2      ARG   8  -3.124  -5.223  -2.183
   54    HD3  ARG   8           HD3      ARG   8  -3.506  -6.961  -1.919
   55    HE   ARG   8           HE       ARG   8  -3.671  -6.352   0.445
   56   HH11  ARG   8          HH11      ARG   8  -5.285  -3.888  -1.657
   57   HH12  ARG   8          HH12      ARG   8  -6.003  -3.182  -0.252
   58   HH21  ARG   8          HH21      ARG   8  -4.447  -5.506   1.957
   59   HH22  ARG   8          HH22      ARG   8  -5.495  -4.153   1.929
   60    HA   PRO   9           HA       PRO   9   2.352  -9.028   1.304
   61    HB2  PRO   9           HB2      PRO   9   4.571  -7.345   1.825
   62    HB3  PRO   9           HB3      PRO   9   4.564  -8.825   0.836
   63    HG2  PRO   9           HG2      PRO   9   4.847  -6.023   0.071
   64    HG3  PRO   9           HG3      PRO   9   4.975  -7.485  -0.958
   65    HD2  PRO   9           HD2      PRO   9   2.741  -5.610  -0.685
   66    HD3  PRO   9           HD3      PRO   9   3.013  -6.929  -1.866
   67    H    ASN  10           H        ASN  10   2.006  -8.839   3.529
   68    HA   ASN  10           HA       ASN  10   1.266  -6.189   4.664
   69    HB2  ASN  10           HB2      ASN  10  -0.645  -7.405   3.433
   70    HB3  ASN  10           HB3      ASN  10  -0.411  -8.712   4.561
   71   HD21  ASN  10          HD22      ASN  10  -1.781  -5.325   4.355
   72   HD22  ASN  10          HD21      ASN  10  -2.571  -5.567   5.904
   73    H    VAL  11           H        VAL  11   1.173  -6.266   7.077
   74    HA   VAL  11           HA       VAL  11   2.238  -8.709   8.260
   75    HB   VAL  11           HB       VAL  11   3.725  -7.386   9.784
   76   HG11  VAL  11          HG11      VAL  11   4.661  -8.554   7.849
   77   HG12  VAL  11          HG12      VAL  11   4.323  -7.150   6.856
   78   HG13  VAL  11          HG13      VAL  11   5.527  -7.041   8.136
   79   HG21  VAL  11          HG21      VAL  11   3.211  -5.097   7.812
   80   HG22  VAL  11          HG22      VAL  11   2.775  -5.115   9.534
   81   HG23  VAL  11          HG23      VAL  11   4.469  -5.148   9.051
   82    H    GLY  12           H        GLY  12   1.732  -8.865  10.575
   83    HA2  GLY  12           HA2      GLY  12  -0.236  -6.896  11.574
   84    HA3  GLY  12           HA3      GLY  12  -0.674  -8.594  11.497
   85    H    ILE  13           H        ILE  13  -0.624  -7.145  13.868
   86    HA   ILE  13           HA       ILE  13   1.817  -8.098  15.290
   87    HB   ILE  13           HB       ILE  13   0.246  -5.511  15.669
   88   HG12  ILE  13          HG12      ILE  13   2.993  -4.919  15.296
   89   HG13  ILE  13          HG13      ILE  13   2.647  -6.145  14.081
   90   HG21  ILE  13          HG21      ILE  13   1.006  -6.454  17.813
   91   HG22  ILE  13          HG22      ILE  13   2.662  -6.624  17.162
   92   HG23  ILE  13          HG23      ILE  13   1.882  -5.049  17.413
   93   HD11  ILE  13          HD11      ILE  13   0.786  -4.749  13.206
   94   HD12  ILE  13          HD12      ILE  13   1.135  -3.527  14.456
   95   HD13  ILE  13          HD13      ILE  13   2.332  -3.878  13.195
   96    H    VAL  14           H        VAL  14   1.439  -9.056  17.227
   97    HA   VAL  14           HA       VAL  14  -1.293  -9.044  18.401
   98    HB   VAL  14           HB       VAL  14   0.749 -11.324  18.485
   99   HG11  VAL  14          HG11      VAL  14  -0.806 -11.226  20.402
  100   HG12  VAL  14          HG12      VAL  14  -2.184 -11.176  19.280
  101   HG13  VAL  14          HG13      VAL  14  -1.134 -12.621  19.374
  102   HG21  VAL  14          HG21      VAL  14  -1.723 -11.135  16.713
  103   HG22  VAL  14          HG22      VAL  14  -0.029 -11.183  16.170
  104   HG23  VAL  14          HG23      VAL  14  -0.705 -12.582  16.981
  105    H    ILE  15           H        ILE  15  -1.166  -8.419  20.621
  106    HA   ILE  15           HA       ILE  15   1.545  -8.450  21.814
  107    HB   ILE  15           HB       ILE  15  -0.649  -6.570  22.690
  108   HG12  ILE  15          HG12      ILE  15  -0.028  -5.831  20.414
  109   HG13  ILE  15          HG13      ILE  15   0.437  -4.687  21.656
  110   HG21  ILE  15          HG21      ILE  15   1.027  -7.183  24.381
  111   HG22  ILE  15          HG22      ILE  15   2.330  -6.683  23.290
  112   HG23  ILE  15          HG23      ILE  15   1.140  -5.506  23.886
  113   HD11  ILE  15          HD11      ILE  15   2.784  -5.410  21.511
  114   HD12  ILE  15          HD12      ILE  15   2.334  -6.639  20.302
  115   HD13  ILE  15          HD13      ILE  15   2.179  -4.916  19.929
  116    H    CYS  16           H        CYS  16   1.615  -9.727  23.758
  117    HA   CYS  16           HA       CYS  16  -1.024 -10.135  24.994
  118    HB2  CYS  16           HB2      CYS  16  -0.043 -12.309  26.123
  119    HB3  CYS  16           HB3      CYS  16  -0.940 -12.376  24.601
  120    HG   CYS  16           HG       CYS  16   0.930 -13.859  24.321
  121    H    ASN  17           H        ASN  17  -0.960 -10.702  27.185
  122    HA   ASN  17           HA       ASN  17   1.251  -9.423  28.700
  123    HB2  ASN  17           HB2      ASN  17  -0.348  -8.744  30.321
  124    HB3  ASN  17           HB3      ASN  17  -1.003  -8.301  28.750
  125   HD21  ASN  17          HD22      ASN  17  -3.015  -8.169  30.300
  126   HD22  ASN  17          HD21      ASN  17  -3.948  -9.626  30.415
  127    H    ARG  18           H        ARG  18   1.284 -10.495  31.034
  128    HA   ARG  18           HA       ARG  18   1.864 -13.327  30.559
  129    HB2  ARG  18           HB2      ARG  18   2.071 -11.648  33.107
  130    HB3  ARG  18           HB3      ARG  18   2.563 -13.329  32.976
  131    HG2  ARG  18           HG2      ARG  18   4.534 -12.485  32.464
  132    HG3  ARG  18           HG3      ARG  18   3.908 -12.484  30.825
  133    HD2  ARG  18           HD2      ARG  18   3.841 -10.182  30.701
  134    HD3  ARG  18           HD3      ARG  18   3.216 -10.005  32.372
  135    HE   ARG  18           HE       ARG  18   5.865 -11.067  32.097
  136   HH11  ARG  18          HH11      ARG  18   4.484  -7.711  32.281
  137   HH12  ARG  18          HH12      ARG  18   6.018  -7.185  32.923
  138   HH21  ARG  18          HH21      ARG  18   7.323 -10.354  33.149
  139   HH22  ARG  18          HH22      ARG  18   7.741  -8.720  33.170
  140    H    GLN  19           H        GLN  19  -1.078 -12.052  30.955
  141    HA   GLN  19           HA       GLN  19  -2.075 -14.185  32.763
  142    HB2  GLN  19           HB2      GLN  19  -3.679 -12.047  31.397
  143    HB3  GLN  19           HB3      GLN  19  -4.139 -13.004  32.788
  144    HG2  GLN  19           HG2      GLN  19  -2.117 -10.724  32.652
  145    HG3  GLN  19           HG3      GLN  19  -3.702 -10.682  33.407
  146   HE21  GLN  19          HE22      GLN  19  -1.208 -10.059  34.744
  147   HE22  GLN  19          HE21      GLN  19  -1.024 -11.267  36.009
  148    H    GLY  20           H        GLY  20  -1.198 -13.813  29.525
  149    HA2  GLY  20           HA2      GLY  20  -1.615 -15.175  27.729
  150    HA3  GLY  20           HA3      GLY  20  -2.811 -16.091  28.675
  151    H    GLN  21           H        GLN  21  -3.082 -12.577  28.529
  152    HA   GLN  21           HA       GLN  21  -5.447 -12.848  26.748
  153    HB2  GLN  21           HB2      GLN  21  -4.505 -10.373  28.239
  154    HB3  GLN  21           HB3      GLN  21  -6.065 -10.664  27.468
  155    HG2  GLN  21           HG2      GLN  21  -5.781 -12.843  29.272
  156    HG3  GLN  21           HG3      GLN  21  -5.097 -11.446  30.112
  157   HE21  GLN  21          HE22      GLN  21  -7.954 -12.961  28.921
  158   HE22  GLN  21          HE21      GLN  21  -9.043 -11.830  29.709
  159    H    VAL  22           H        VAL  22  -5.546 -11.676  24.842
  160    HA   VAL  22           HA       VAL  22  -3.019 -10.519  23.878
  161    HB   VAL  22           HB       VAL  22  -3.556 -11.245  21.664
  162   HG11  VAL  22          HG11      VAL  22  -2.373 -12.852  23.070
  163   HG12  VAL  22          HG12      VAL  22  -3.910 -13.556  23.639
  164   HG13  VAL  22          HG13      VAL  22  -3.426 -13.697  21.940
  165   HG21  VAL  22          HG21      VAL  22  -6.122 -12.484  22.747
  166   HG22  VAL  22          HG22      VAL  22  -6.003 -11.103  21.633
  167   HG23  VAL  22          HG23      VAL  22  -5.465 -12.702  21.110
  168    H    MET  23           H        MET  23  -3.175  -8.654  22.765
  169    HA   MET  23           HA       MET  23  -5.418  -6.901  23.358
  170    HB2  MET  23           HB2      MET  23  -3.483  -5.657  23.195
  171    HB3  MET  23           HB3      MET  23  -2.727  -6.766  22.030
  172    HG2  MET  23           HG2      MET  23  -4.139  -6.078  20.253
  173    HG3  MET  23           HG3      MET  23  -5.062  -4.987  21.322
  174    HE1  MET  23           HE1      MET  23  -4.013  -3.071  22.412
  175    HE2  MET  23           HE2      MET  23  -2.235  -3.305  22.490
  176    HE3  MET  23           HE3      MET  23  -2.953  -1.977  21.546
  177    H    TRP  24           H        TRP  24  -7.032  -6.281  22.019
  178    HA   TRP  24           HA       TRP  24  -7.109  -7.189  19.212
  179    HB2  TRP  24           HB2      TRP  24  -8.214  -8.912  20.651
  180    HB3  TRP  24           HB3      TRP  24  -9.253  -7.650  21.331
  181    HD1  TRP  24           HD1      TRP  24 -10.164  -6.084  19.066
  182    HE1  TRP  24           HE1      TRP  24 -11.953  -6.937  17.909
  183    HE3  TRP  24           HE3      TRP  24  -9.967 -10.642  19.580
  184    HZ2  TRP  24           HZ2      TRP  24 -13.010 -10.082  17.900
  185    HZ3  TRP  24           HZ3      TRP  24 -11.380 -11.961  17.784
  186    HH2  TRP  24           HH2      TRP  24 -11.161 -10.052  15.665
  187    H    ALA  25           H        ALA  25  -8.250  -5.555  17.927
  188    HA   ALA  25           HA       ALA  25  -9.472  -3.340  19.417
  189    HB1  ALA  25           HB1      ALA  25  -7.136  -2.725  19.127
  190    HB2  ALA  25           HB2      ALA  25  -7.270  -3.029  17.376
  191    HB3  ALA  25           HB3      ALA  25  -8.185  -1.685  18.131
  192    H    ARG  26           H        ARG  26 -10.633  -1.839  18.113
  193    HA   ARG  26           HA       ARG  26 -11.942  -3.192  15.781
  194    HB2  ARG  26           HB2      ARG  26 -13.233  -3.246  17.786
  195    HB3  ARG  26           HB3      ARG  26 -13.006  -1.514  18.084
  196    HG2  ARG  26           HG2      ARG  26 -14.238  -0.954  16.041
  197    HG3  ARG  26           HG3      ARG  26 -14.243  -2.635  15.514
  198    HD2  ARG  26           HD2      ARG  26 -16.331  -2.445  16.532
  199    HD3  ARG  26           HD3      ARG  26 -15.349  -3.138  17.831
  200    HE   ARG  26           HE       ARG  26 -15.054  -0.308  17.715
  201   HH11  ARG  26          HH11      ARG  26 -17.456  -2.719  18.637
  202   HH12  ARG  26          HH12      ARG  26 -18.321  -1.609  19.677
  203   HH21  ARG  26          HH21      ARG  26 -16.045   1.071  18.942
  204   HH22  ARG  26          HH22      ARG  26 -17.475   0.777  19.749
  205    H    ARG  27           H        ARG  27 -11.950  -2.034  13.959
  206    HA   ARG  27           HA       ARG  27 -10.376   0.420  14.033
  207    HB2  ARG  27           HB2      ARG  27 -10.114  -1.421  12.439
  208    HB3  ARG  27           HB3      ARG  27 -11.651  -0.980  11.713
  209    HG2  ARG  27           HG2      ARG  27 -10.827   1.229  11.094
  210    HG3  ARG  27           HG3      ARG  27  -9.374   0.981  12.102
  211    HD2  ARG  27           HD2      ARG  27  -9.081  -1.197  10.585
  212    HD3  ARG  27           HD3      ARG  27 -10.118  -0.249   9.490
  213    HE   ARG  27           HE       ARG  27  -8.475   1.179   9.082
  214   HH11  ARG  27          HH11      ARG  27  -7.157  -0.349  12.144
  215   HH12  ARG  27          HH12      ARG  27  -5.563  -0.028  11.599
  216   HH21  ARG  27          HH21      ARG  27  -6.555   1.723   8.736
  217   HH22  ARG  27          HH22      ARG  27  -5.250   1.357   9.754
  218    H    PHE  28           H        PHE  28 -10.841   2.391  13.332
  219    HA   PHE  28           HA       PHE  28 -13.157   3.484  14.398
  220    HB2  PHE  28           HB2      PHE  28 -11.031   4.600  14.034
  221    HB3  PHE  28           HB3      PHE  28 -11.246   4.527  12.287
  222    HD1  PHE  28           HD1      PHE  28 -12.561   5.978  15.461
  223    HD2  PHE  28           HD2      PHE  28 -12.552   6.196  11.155
  224    HE1  PHE  28           HE1      PHE  28 -13.622   8.216  15.572
  225    HE2  PHE  28           HE2      PHE  28 -13.616   8.434  11.264
  226    HZ   PHE  28           HZ       PHE  28 -14.143   9.454  13.475
  227    H    GLY  29           H        GLY  29 -15.186   3.841  13.684
  228    HA2  GLY  29           HA2      GLY  29 -16.983   4.022  12.302
  229    HA3  GLY  29           HA3      GLY  29 -15.874   4.077  10.916
  230    H    GLN  30           H        GLN  30 -15.078   1.236  12.444
  231    HA   GLN  30           HA       GLN  30 -16.960  -0.370  10.791
  232    HB2  GLN  30           HB2      GLN  30 -14.704  -1.575  12.418
  233    HB3  GLN  30           HB3      GLN  30 -15.507  -2.189  10.974
  234    HG2  GLN  30           HG2      GLN  30 -13.521   0.113  11.044
  235    HG3  GLN  30           HG3      GLN  30 -13.211  -1.556  10.515
  236   HE21  GLN  30          HE22      GLN  30 -13.780   1.451   9.308
  237   HE22  GLN  30          HE21      GLN  30 -14.567   0.953   7.811
  238    H    HIS  31           H        HIS  31 -17.549  -2.396  12.279
  239    HA   HIS  31           HA       HIS  31 -17.514  -1.674  15.144
  240    HB2  HIS  31           HB2      HIS  31 -19.902  -2.664  13.594
  241    HB3  HIS  31           HB3      HIS  31 -19.824  -2.608  15.364
  242    HD1  HIS  31           HD1      HIS  31 -20.949  -0.595  12.572
  243    HD2  HIS  31           HD2      HIS  31 -18.969   0.210  16.183
  244    HE1  HIS  31           HE1      HIS  31 -21.429   1.845  13.134
  245    H    SER  32           H        SER  32 -16.177  -3.414  13.016
  246    HA   SER  32           HA       SER  32 -16.554  -6.113  14.152
  247    HB2  SER  32           HB2      SER  32 -14.832  -5.629  11.757
  248    HB3  SER  32           HB3      SER  32 -15.988  -6.927  12.078
  249    HG   SER  32           HG       SER  32 -16.699  -5.569  10.390
  250    H    TRP  33           H        TRP  33 -14.639  -7.231  14.608
  251    HA   TRP  33           HA       TRP  33 -12.556  -5.284  15.421
  252    HB2  TRP  33           HB2      TRP  33 -13.605  -7.784  16.700
  253    HB3  TRP  33           HB3      TRP  33 -12.654  -6.182  17.047
  254    HD1  TRP  33           HD1      TRP  33 -16.231  -6.846  17.137
  255    HE1  TRP  33           HE1      TRP  33 -17.036  -5.521  19.153
  256    HE3  TRP  33           HE3      TRP  33 -11.763  -5.205  18.868
  257    HZ2  TRP  33           HZ2      TRP  33 -15.763  -3.710  21.205
  258    HZ3  TRP  33           HZ3      TRP  33 -11.477  -3.961  20.934
  259    HH2  TRP  33           HH2      TRP  33 -13.501  -3.049  22.045
  260    H    GLN  34           H        GLN  34 -10.327  -6.120  15.611
  261    HA   GLN  34           HA       GLN  34  -9.545  -8.418  13.975
  262    HB2  GLN  34           HB2      GLN  34  -7.987  -6.181  13.047
  263    HB3  GLN  34           HB3      GLN  34  -8.965  -7.261  12.099
  264    HG2  GLN  34           HG2      GLN  34 -10.878  -5.832  12.301
  265    HG3  GLN  34           HG3      GLN  34  -9.983  -4.728  13.380
  266   HE21  GLN  34          HE22      GLN  34 -10.987  -4.877  10.255
  267   HE22  GLN  34          HE21      GLN  34  -9.644  -4.002   9.524
  268    H    PHE  35           H        PHE  35  -7.146  -8.569  13.887
  269    HA   PHE  35           HA       PHE  35  -5.800  -7.491  16.272
  270    HB2  PHE  35           HB2      PHE  35  -4.888  -9.240  13.979
  271    HB3  PHE  35           HB3      PHE  35  -3.873  -8.794  15.363
  272    HD1  PHE  35           HD2      PHE  35  -5.481  -9.233  17.718
  273    HD2  PHE  35           HD1      PHE  35  -5.003 -11.598  14.169
  274    HE1  PHE  35           HE2      PHE  35  -6.273 -11.218  18.947
  275    HE2  PHE  35           HE1      PHE  35  -5.754 -13.613  15.425
  276    HZ   PHE  35           HZ       PHE  35  -6.559 -13.394  17.766
  277    HA   PRO  36           HA       PRO  36  -4.340  -3.875  14.103
  278    HB2  PRO  36           HB2      PRO  36  -1.650  -4.106  15.306
  279    HB3  PRO  36           HB3      PRO  36  -2.888  -2.854  15.547
  280    HG2  PRO  36           HG2      PRO  36  -2.184  -4.884  17.386
  281    HG3  PRO  36           HG3      PRO  36  -3.637  -3.842  17.450
  282    HD2  PRO  36           HD2      PRO  36  -3.447  -6.684  16.756
  283    HD3  PRO  36           HD3      PRO  36  -4.883  -5.688  17.115
  284    H    GLN  37           H        GLN  37  -3.332  -3.539  12.046
  285    HA   GLN  37           HA       GLN  37  -1.121  -5.202  11.209
  286    HB2  GLN  37           HB2      GLN  37  -2.351  -6.381   9.376
  287    HB3  GLN  37           HB3      GLN  37  -2.896  -6.882  10.969
  288    HG2  GLN  37           HG2      GLN  37  -4.812  -5.170  10.687
  289    HG3  GLN  37           HG3      GLN  37  -4.315  -5.045   9.000
  290   HE21  GLN  37          HE22      GLN  37  -6.215  -6.718  11.225
  291   HE22  GLN  37          HE21      GLN  37  -6.686  -8.041  10.113
  292    H    GLY  38           H        GLY  38  -0.622  -4.869   8.821
  293    HA2  GLY  38           HA2      GLY  38  -1.783  -2.597   7.485
  294    HA3  GLY  38           HA3      GLY  38  -0.317  -2.186   8.360
  295    H    GLY  39           H        GLY  39  -0.065  -1.754   5.776
  296    HA2  GLY  39           HA2      GLY  39   0.695  -4.219   4.271
  297    HA3  GLY  39           HA3      GLY  39   0.565  -2.595   3.610
  298    H    ILE  40           H        ILE  40   2.784  -4.578   3.522
  299    HA   ILE  40           HA       ILE  40   5.029  -3.190   4.811
  300    HB   ILE  40           HB       ILE  40   4.883  -5.354   2.664
  301   HG12  ILE  40          HG12      ILE  40   5.689  -5.636   5.588
  302   HG13  ILE  40          HG13      ILE  40   4.069  -5.990   5.009
  303   HG21  ILE  40          HG21      ILE  40   7.014  -4.114   2.504
  304   HG22  ILE  40          HG22      ILE  40   7.301  -4.346   4.236
  305   HG23  ILE  40          HG23      ILE  40   7.318  -5.721   3.121
  306   HD11  ILE  40          HD11      ILE  40   4.861  -7.869   3.715
  307   HD12  ILE  40          HD12      ILE  40   6.564  -7.496   4.106
  308   HD13  ILE  40          HD13      ILE  40   5.425  -8.041   5.323
  309    H    ASN  41           H        ASN  41   5.861  -1.300   3.951
  310    HA   ASN  41           HA       ASN  41   4.803  -0.316   1.408
  311    HB2  ASN  41           HB2      ASN  41   6.911   0.798   3.303
  312    HB3  ASN  41           HB3      ASN  41   6.511   1.549   1.798
  313   HD21  ASN  41          HD22      ASN  41   5.005   0.505   4.895
  314   HD22  ASN  41          HD21      ASN  41   3.670   1.637   4.810
  315    HA   PRO  42           HA       PRO  42   7.713  -2.202  -1.197
  316    HB2  PRO  42           HB2      PRO  42   8.571  -0.146  -2.925
  317    HB3  PRO  42           HB3      PRO  42   7.115  -1.164  -3.114
  318    HG2  PRO  42           HG2      PRO  42   7.345   1.640  -2.092
  319    HG3  PRO  42           HG3      PRO  42   5.978   0.860  -2.948
  320    HD2  PRO  42           HD2      PRO  42   6.074   1.373  -0.232
  321    HD3  PRO  42           HD3      PRO  42   5.073   0.103  -0.950
  322    H    GLY  43           H        GLY  43   9.693  -2.869  -0.605
  323    HA2  GLY  43           HA2      GLY  43  12.004  -2.707  -0.359
  324    HA3  GLY  43           HA3      GLY  43  11.888  -0.952  -0.179
  325    H    GLU  44           H        GLU  44   9.548  -1.884   1.967
  326    HA   GLU  44           HA       GLU  44  11.343  -1.852   4.252
  327    HB2  GLU  44           HB2      GLU  44   8.397  -1.856   3.790
  328    HB3  GLU  44           HB3      GLU  44   8.902  -2.729   5.234
  329    HG2  GLU  44           HG2      GLU  44  10.102  -0.874   6.102
  330    HG3  GLU  44           HG3      GLU  44   9.974   0.031   4.597
  331    H    SER  45           H        SER  45  11.707  -3.548   5.746
  332    HA   SER  45           HA       SER  45  11.217  -6.288   4.742
  333    HB2  SER  45           HB2      SER  45  12.323  -6.660   7.191
  334    HB3  SER  45           HB3      SER  45  13.216  -6.575   5.666
  335    HG   SER  45           HG       SER  45  14.175  -5.279   7.187
  336    H    ALA  46           H        ALA  46  10.147  -7.818   6.233
  337    HA   ALA  46           HA       ALA  46   7.583  -6.906   6.885
  338    HB1  ALA  46           HB1      ALA  46   8.146  -9.265   6.409
  339    HB2  ALA  46           HB2      ALA  46   9.076  -9.366   7.924
  340    HB3  ALA  46           HB3      ALA  46   7.316  -9.118   7.971
  341    H    GLU  47           H        GLU  47  10.453  -7.307   9.007
  342    HA   GLU  47           HA       GLU  47   9.044  -6.813  11.452
  343    HB2  GLU  47           HB2      GLU  47  11.167  -8.046  11.164
  344    HB3  GLU  47           HB3      GLU  47  11.980  -6.546  10.692
  345    HG2  GLU  47           HG2      GLU  47  11.336  -5.602  12.966
  346    HG3  GLU  47           HG3      GLU  47  10.697  -7.207  13.372
  347    H    GLN  48           H        GLN  48  10.656  -4.669   9.067
  348    HA   GLN  48           HA       GLN  48  10.556  -2.296  10.731
  349    HB2  GLN  48           HB2      GLN  48  10.685  -2.591   7.697
  350    HB3  GLN  48           HB3      GLN  48  10.985  -1.092   8.586
  351    HG2  GLN  48           HG2      GLN  48  12.528  -3.640   9.156
  352    HG3  GLN  48           HG3      GLN  48  12.976  -2.621   7.802
  353   HE21  GLN  48          HE22      GLN  48  14.404  -3.493   9.944
  354   HE22  GLN  48          HE21      GLN  48  15.072  -2.104  10.784
  355    H    ALA  49           H        ALA  49   8.510  -3.705   8.142
  356    HA   ALA  49           HA       ALA  49   6.530  -1.658   8.187
  357    HB1  ALA  49           HB1      ALA  49   6.721  -3.334   6.396
  358    HB2  ALA  49           HB2      ALA  49   6.285  -4.626   7.546
  359    HB3  ALA  49           HB3      ALA  49   5.103  -3.363   7.136
  360    H    MET  50           H        MET  50   7.054  -4.620  10.222
  361    HA   MET  50           HA       MET  50   4.555  -4.423  11.555
  362    HB2  MET  50           HB2      MET  50   5.800  -6.440  11.676
  363    HB3  MET  50           HB3      MET  50   7.239  -5.642  12.291
  364    HG2  MET  50           HG2      MET  50   4.648  -5.655  13.804
  365    HG3  MET  50           HG3      MET  50   5.844  -6.934  13.978
  366    HE1  MET  50           HE1      MET  50   8.160  -6.727  14.998
  367    HE2  MET  50           HE2      MET  50   8.731  -5.355  14.005
  368    HE3  MET  50           HE3      MET  50   8.795  -5.271  15.770
  369    H    TYR  51           H        TYR  51   7.794  -2.986  12.415
  370    HA   TYR  51           HA       TYR  51   6.705  -1.739  14.748
  371    HB2  TYR  51           HB2      TYR  51   9.153  -1.113  13.051
  372    HB3  TYR  51           HB3      TYR  51   8.755  -0.234  14.518
  373    HD1  TYR  51           HD2      TYR  51   8.026  -1.988  16.570
  374    HD2  TYR  51           HD1      TYR  51  10.833  -2.732  13.378
  375    HE1  TYR  51           HE2      TYR  51   9.394  -3.400  18.091
  376    HE2  TYR  51           HE1      TYR  51  12.160  -4.199  14.872
  377    HH   TYR  51           HH       TYR  51  12.373  -5.049  17.045
  378    H    ARG  52           H        ARG  52   7.035  -0.578  11.379
  379    HA   ARG  52           HA       ARG  52   6.211   2.100  11.877
  380    HB2  ARG  52           HB2      ARG  52   7.207   1.324   9.741
  381    HB3  ARG  52           HB3      ARG  52   5.817   0.257   9.476
  382    HG2  ARG  52           HG2      ARG  52   4.344   2.447   9.722
  383    HG3  ARG  52           HG3      ARG  52   5.879   3.292   9.575
  384    HD2  ARG  52           HD2      ARG  52   5.116   1.103   7.596
  385    HD3  ARG  52           HD3      ARG  52   4.243   2.642   7.539
  386    HE   ARG  52           HE       ARG  52   6.996   2.122   6.796
  387   HH11  ARG  52          HH11      ARG  52   4.776   4.552   8.114
  388   HH12  ARG  52          HH12      ARG  52   5.467   5.932   7.351
  389   HH21  ARG  52          HH21      ARG  52   7.902   3.764   5.724
  390   HH22  ARG  52          HH22      ARG  52   7.405   5.445   5.793
  391    H    GLU  53           H        GLU  53   4.278  -0.811  10.869
  392    HA   GLU  53           HA       GLU  53   1.884   0.769  10.898
  393    HB2  GLU  53           HB2      GLU  53   2.327  -2.233  10.800
  394    HB3  GLU  53           HB3      GLU  53   0.749  -1.471  10.609
  395    HG2  GLU  53           HG2      GLU  53   3.179  -0.930   8.825
  396    HG3  GLU  53           HG3      GLU  53   1.887  -2.041   8.436
  397    H    LEU  54           H        LEU  54   3.527  -1.218  13.369
  398    HA   LEU  54           HA       LEU  54   1.487  -1.249  15.310
  399    HB2  LEU  54           HB2      LEU  54   3.726  -2.368  15.491
  400    HB3  LEU  54           HB3      LEU  54   4.489  -0.785  15.613
  401    HG   LEU  54           HG       LEU  54   3.038  -0.422  17.736
  402   HD11  LEU  54          HD11      LEU  54   1.541  -2.438  17.179
  403   HD12  LEU  54          HD12      LEU  54   2.984  -3.414  17.403
  404   HD13  LEU  54          HD13      LEU  54   2.295  -2.558  18.785
  405   HD21  LEU  54          HD21      LEU  54   5.154  -2.634  17.693
  406   HD22  LEU  54          HD22      LEU  54   5.474  -0.887  17.800
  407   HD23  LEU  54          HD23      LEU  54   4.630  -1.712  19.121
  408    H    PHE  55           H        PHE  55   3.876   1.377  14.487
  409    HA   PHE  55           HA       PHE  55   2.857   3.123  16.521
  410    HB2  PHE  55           HB2      PHE  55   5.028   3.447  15.405
  411    HB3  PHE  55           HB3      PHE  55   4.204   3.844  13.898
  412    HD1  PHE  55           HD1      PHE  55   2.663   5.920  13.828
  413    HD2  PHE  55           HD2      PHE  55   5.284   5.074  17.153
  414    HE1  PHE  55           HE1      PHE  55   2.479   8.274  14.574
  415    HE2  PHE  55           HE2      PHE  55   5.107   7.434  17.885
  416    HZ   PHE  55           HZ       PHE  55   3.718   9.048  16.589
  417    H    GLU  56           H        GLU  56   1.881   2.616  13.051
  418    HA   GLU  56           HA       GLU  56   0.061   4.821  13.066
  419    HB2  GLU  56           HB2      GLU  56   0.250   2.348  11.325
  420    HB3  GLU  56           HB3      GLU  56  -0.832   3.700  10.988
  421    HG2  GLU  56           HG2      GLU  56   1.956   4.581  11.510
  422    HG3  GLU  56           HG3      GLU  56   1.877   3.437  10.196
  423    H    GLU  57           H        GLU  57  -0.333   1.447  14.117
  424    HA   GLU  57           HA       GLU  57  -3.260   1.674  14.162
  425    HB2  GLU  57           HB2      GLU  57  -1.322  -0.489  15.096
  426    HB3  GLU  57           HB3      GLU  57  -3.061  -0.660  15.102
  427    HG2  GLU  57           HG2      GLU  57  -1.513  -0.201  12.529
  428    HG3  GLU  57           HG3      GLU  57  -1.750  -1.791  13.254
  429    H    VAL  58           H        VAL  58  -0.607   1.231  16.543
  430    HA   VAL  58           HA       VAL  58  -2.552   1.576  18.775
  431    HB   VAL  58           HB       VAL  58  -0.147   0.520  19.824
  432   HG11  VAL  58          HG11      VAL  58  -2.452  -0.079  20.479
  433   HG12  VAL  58          HG12      VAL  58  -2.648  -1.000  19.003
  434   HG13  VAL  58          HG13      VAL  58  -1.422  -1.476  20.226
  435   HG21  VAL  58          HG21      VAL  58  -0.887  -1.150  17.394
  436   HG22  VAL  58          HG22      VAL  58   0.677  -0.375  17.762
  437   HG23  VAL  58          HG23      VAL  58   0.131  -1.641  18.772
  438    H    GLY  59           H        GLY  59  -0.024   3.265  17.228
  439    HA2  GLY  59           HA2      GLY  59   1.087   5.175  17.797
  440    HA3  GLY  59           HA3      GLY  59   0.136   5.264  19.298
  441    H    LEU  60           H        LEU  60   1.565   2.266  19.089
  442    HA   LEU  60           HA       LEU  60   3.461   2.876  21.225
  443    HB2  LEU  60           HB2      LEU  60   1.811   1.031  21.207
  444    HB3  LEU  60           HB3      LEU  60   2.560   0.374  19.747
  445    HG   LEU  60           HG       LEU  60   4.612  -0.170  21.031
  446   HD11  LEU  60          HD11      LEU  60   4.494   1.585  22.825
  447   HD12  LEU  60          HD12      LEU  60   3.008   0.856  23.436
  448   HD13  LEU  60          HD13      LEU  60   4.514  -0.048  23.513
  449   HD21  LEU  60          HD21      LEU  60   1.904  -1.037  22.122
  450   HD22  LEU  60          HD22      LEU  60   2.665  -1.694  20.671
  451   HD23  LEU  60          HD23      LEU  60   3.428  -1.980  22.193
  452    H    SER  61           H        SER  61   5.728   2.384  21.043
  453    HA   SER  61           HA       SER  61   6.772   2.142  18.263
  454    HB2  SER  61           HB2      SER  61   8.620   3.630  19.839
  455    HB3  SER  61           HB3      SER  61   7.716   4.161  18.419
  456    HG   SER  61           HG       SER  61   7.299   5.529  20.164
  457    H    ARG  62           H        ARG  62   9.076   1.585  18.294
  458    HA   ARG  62           HA       ARG  62   9.511  -0.945  19.183
  459    HB2  ARG  62           HB2      ARG  62  11.597   1.266  18.916
  460    HB3  ARG  62           HB3      ARG  62  11.867  -0.471  19.003
  461    HG2  ARG  62           HG2      ARG  62  10.258  -0.535  16.876
  462    HG3  ARG  62           HG3      ARG  62  10.651   1.196  16.737
  463    HD2  ARG  62           HD2      ARG  62  13.041   0.649  17.125
  464    HD3  ARG  62           HD3      ARG  62  12.645  -1.071  17.278
  465    HE   ARG  62           HE       ARG  62  12.467  -1.418  15.168
  466   HH11  ARG  62          HH11      ARG  62  13.057   2.053  15.471
  467   HH12  ARG  62          HH12      ARG  62  14.489   2.058  14.502
  468   HH21  ARG  62          HH21      ARG  62  14.411  -1.551  14.203
  469   HH22  ARG  62          HH22      ARG  62  15.291  -0.149  13.692
  470    H    LYS  63           H        LYS  63  10.105   1.940  21.112
  471    HA   LYS  63           HA       LYS  63  11.980   0.777  22.912
  472    HB2  LYS  63           HB2      LYS  63   9.890   2.924  23.662
  473    HB3  LYS  63           HB3      LYS  63  11.459   2.657  24.362
  474    HG2  LYS  63           HG2      LYS  63  10.962   3.601  21.464
  475    HG3  LYS  63           HG3      LYS  63  11.361   4.658  22.809
  476    HD2  LYS  63           HD2      LYS  63  13.172   2.258  22.182
  477    HD3  LYS  63           HD3      LYS  63  13.361   3.792  21.337
  478    HE2  LYS  63           HE2      LYS  63  13.339   4.965  23.567
  479    HE3  LYS  63           HE3      LYS  63  13.148   3.413  24.388
  480    HZ1  LYS  63           HZ1      LYS  63  15.205   2.688  23.567
  481    HZ2  LYS  63           HZ2      LYS  63  15.456   4.119  22.766
  482    HZ3  LYS  63           HZ3      LYS  63  15.377   4.091  24.424
  483    H    ASP  64           H        ASP  64   8.510   0.616  22.812
  484    HA   ASP  64           HA       ASP  64   8.640  -0.447  25.563
  485    HB2  ASP  64           HB2      ASP  64   7.504   1.809  25.043
  486    HB3  ASP  64           HB3      ASP  64   6.199   0.836  24.398
  487    H    VAL  65           H        VAL  65   9.066  -1.835  22.890
  488    HA   VAL  65           HA       VAL  65   7.282  -4.066  23.581
  489    HB   VAL  65           HB       VAL  65   7.055  -4.604  21.130
  490   HG11  VAL  65          HG11      VAL  65   5.205  -3.762  22.484
  491   HG12  VAL  65          HG12      VAL  65   5.695  -2.096  22.128
  492   HG13  VAL  65          HG13      VAL  65   5.112  -3.153  20.821
  493   HG21  VAL  65          HG21      VAL  65   7.822  -1.698  20.733
  494   HG22  VAL  65          HG22      VAL  65   8.764  -3.098  20.208
  495   HG23  VAL  65          HG23      VAL  65   7.163  -2.770  19.497
  496    H    ARG  66           H        ARG  66   8.059  -6.139  22.773
  497    HA   ARG  66           HA       ARG  66  10.802  -6.156  21.699
  498    HB2  ARG  66           HB2      ARG  66  11.529  -7.951  23.163
  499    HB3  ARG  66           HB3      ARG  66  11.153  -6.506  24.074
  500    HG2  ARG  66           HG2      ARG  66   8.848  -8.433  23.938
  501    HG3  ARG  66           HG3      ARG  66  10.299  -9.119  24.629
  502    HD2  ARG  66           HD2      ARG  66   8.937  -6.558  25.544
  503    HD3  ARG  66           HD3      ARG  66   8.756  -8.153  26.300
  504    HE   ARG  66           HE       ARG  66  11.400  -6.848  25.938
  505   HH11  ARG  66          HH11      ARG  66   9.104  -8.351  28.322
  506   HH12  ARG  66          HH12      ARG  66  10.245  -8.398  29.563
  507   HH21  ARG  66          HH21      ARG  66  12.830  -6.865  27.562
  508   HH22  ARG  66          HH22      ARG  66  12.415  -7.462  29.138
  509    H    ILE  67           H        ILE  67  10.983  -7.800  20.054
  510    HA   ILE  67           HA       ILE  67   8.495  -9.144  19.354
  511    HB   ILE  67           HB       ILE  67  11.273  -9.513  18.167
  512   HG12  ILE  67          HG12      ILE  67   9.052  -7.827  16.953
  513   HG13  ILE  67          HG13      ILE  67  10.288  -7.110  17.989
  514   HG21  ILE  67          HG21      ILE  67   9.723 -11.379  17.674
  515   HG22  ILE  67          HG22      ILE  67   8.479 -10.236  17.121
  516   HG23  ILE  67          HG23      ILE  67   9.995 -10.444  16.218
  517   HD11  ILE  67          HD11      ILE  67  12.042  -7.913  16.447
  518   HD12  ILE  67          HD12      ILE  67  10.783  -8.566  15.371
  519   HD13  ILE  67          HD13      ILE  67  10.876  -6.824  15.675
  520    H    LEU  68           H        LEU  68   7.862 -10.926  20.328
  521    HA   LEU  68           HA       LEU  68   9.835 -12.669  21.739
  522    HB2  LEU  68           HB2      LEU  68   6.843 -12.466  21.659
  523    HB3  LEU  68           HB3      LEU  68   7.726 -13.706  22.592
  524    HG   LEU  68           HG       LEU  68   7.645 -10.684  23.026
  525   HD11  LEU  68          HD11      LEU  68   5.636 -11.665  23.762
  526   HD12  LEU  68          HD12      LEU  68   6.471 -13.110  24.365
  527   HD13  LEU  68          HD13      LEU  68   6.634 -11.560  25.214
  528   HD21  LEU  68          HD21      LEU  68   9.070 -12.825  24.668
  529   HD22  LEU  68          HD22      LEU  68   9.881 -11.574  23.688
  530   HD23  LEU  68          HD23      LEU  68   8.905 -11.110  25.097
  531    H    ALA  69           H        ALA  69   7.519 -12.576  18.999
  532    HA   ALA  69           HA       ALA  69   8.660 -15.025  17.936
  533    HB1  ALA  69           HB1      ALA  69   6.980 -15.920  19.501
  534    HB2  ALA  69           HB2      ALA  69   5.706 -14.972  18.743
  535    HB3  ALA  69           HB3      ALA  69   6.501 -16.254  17.823
  536    H    SER  70           H        SER  70   7.707 -15.509  15.765
  537    HA   SER  70           HA       SER  70   5.925 -13.627  14.550
  538    HB2  SER  70           HB2      SER  70   7.598 -13.066  12.695
  539    HB3  SER  70           HB3      SER  70   7.830 -12.248  14.248
  540    HG   SER  70           HG       SER  70   9.828 -12.996  13.572
  541    H    THR  71           H        THR  71   5.302 -14.378  12.351
  542    HA   THR  71           HA       THR  71   4.983 -17.217  12.508
  543    HB   THR  71           HB       THR  71   4.063 -16.840  10.130
  544    HG1  THR  71           HG1      THR  71   3.354 -14.838   9.749
  545   HG21  THR  71          HG21      THR  71   2.496 -17.316  11.680
  546   HG22  THR  71          HG22      THR  71   2.683 -15.764  12.535
  547   HG23  THR  71          HG23      THR  71   1.907 -15.863  10.943
  548    H    ARG  72           H        ARG  72   5.844 -18.853  11.458
  549    HA   ARG  72           HA       ARG  72   8.504 -18.422  10.220
  550    HB2  ARG  72           HB2      ARG  72   6.858 -20.926  10.595
  551    HB3  ARG  72           HB3      ARG  72   8.575 -20.903  10.217
  552    HG2  ARG  72           HG2      ARG  72   9.227 -20.430  12.372
  553    HG3  ARG  72           HG3      ARG  72   7.887 -19.343  12.689
  554    HD2  ARG  72           HD2      ARG  72   6.475 -21.698  12.379
  555    HD3  ARG  72           HD3      ARG  72   8.026 -22.307  12.943
  556    HE   ARG  72           HE       ARG  72   6.125 -20.386  14.208
  557   HH11  ARG  72          HH11      ARG  72   8.911 -22.482  14.442
  558   HH12  ARG  72          HH12      ARG  72   8.948 -22.605  16.166
  559   HH21  ARG  72          HH21      ARG  72   6.049 -20.419  16.481
  560   HH22  ARG  72          HH22      ARG  72   7.208 -21.323  17.392
  561    H    ASN  73           H        ASN  73   5.229 -19.399   9.337
  562    HA   ASN  73           HA       ASN  73   5.965 -19.518   6.458
  563    HB2  ASN  73           HB2      ASN  73   4.035 -20.868   6.122
  564    HB3  ASN  73           HB3      ASN  73   4.892 -21.587   7.485
  565   HD21  ASN  73          HD22      ASN  73   3.885 -21.081   9.810
  566   HD22  ASN  73          HD21      ASN  73   2.186 -20.740   9.774
  567    H    TRP  74           H        TRP  74   4.380 -18.347   5.027
  568    HA   TRP  74           HA       TRP  74   3.377 -15.867   6.341
  569    HB2  TRP  74           HB2      TRP  74   3.699 -16.699   3.432
  570    HB3  TRP  74           HB3      TRP  74   2.834 -15.263   3.947
  571    HD1  TRP  74           HD1      TRP  74   6.408 -16.689   3.955
  572    HE1  TRP  74           HE1      TRP  74   8.094 -14.782   3.995
  573    HE3  TRP  74           HE3      TRP  74   3.158 -12.789   4.535
  574    HZ2  TRP  74           HZ2      TRP  74   8.028 -11.847   4.276
  575    HZ3  TRP  74           HZ3      TRP  74   3.972 -10.455   4.628
  576    HH2  TRP  74           HH2      TRP  74   6.414  -9.989   4.532
  577    H    LEU  75           H        LEU  75   1.232 -15.526   6.636
  578    HA   LEU  75           HA       LEU  75  -0.648 -17.723   6.011
  579    HB2  LEU  75           HB2      LEU  75  -1.186 -15.147   7.540
  580    HB3  LEU  75           HB3      LEU  75  -2.197 -16.596   7.449
  581    HG   LEU  75           HG       LEU  75   0.559 -16.386   8.757
  582   HD11  LEU  75          HD11      LEU  75  -1.246 -15.326  10.038
  583   HD12  LEU  75          HD12      LEU  75  -2.198 -16.810   9.966
  584   HD13  LEU  75          HD13      LEU  75  -0.648 -16.783  10.843
  585   HD21  LEU  75          HD21      LEU  75  -1.376 -18.754   8.690
  586   HD22  LEU  75          HD22      LEU  75   0.199 -18.681   7.880
  587   HD23  LEU  75          HD23      LEU  75   0.135 -18.649   9.636
  588    H    ARG  76           H        ARG  76  -1.061 -17.596   3.901
  589    HA   ARG  76           HA       ARG  76  -1.657 -14.936   2.693
  590    HB2  ARG  76           HB2      ARG  76  -0.038 -16.647   1.741
  591    HB3  ARG  76           HB3      ARG  76  -1.429 -17.739   1.556
  592    HG2  ARG  76           HG2      ARG  76  -2.479 -15.820   0.098
  593    HG3  ARG  76           HG3      ARG  76  -0.843 -15.100   0.169
  594    HD2  ARG  76           HD2      ARG  76  -0.199 -17.706  -0.315
  595    HD3  ARG  76           HD3      ARG  76  -1.826 -17.682  -1.043
  596    HE   ARG  76           HE       ARG  76  -0.532 -15.421  -1.958
  597   HH11  ARG  76          HH11      ARG  76   0.190 -18.906  -1.923
  598   HH12  ARG  76          HH12      ARG  76   1.057 -18.913  -3.411
  599   HH21  ARG  76          HH21      ARG  76   0.546 -15.347  -3.885
  600   HH22  ARG  76          HH22      ARG  76   1.287 -16.740  -4.585
  601    H    TYR  77           H        TYR  77  -3.731 -14.501   1.784
  602    HA   TYR  77           HA       TYR  77  -5.511 -16.801   1.531
  603    HB2  TYR  77           HB2      TYR  77  -7.350 -15.983   2.768
  604    HB3  TYR  77           HB3      TYR  77  -5.945 -16.025   3.811
  605    HD1  TYR  77           HD2      TYR  77  -4.880 -14.129   4.662
  606    HD2  TYR  77           HD1      TYR  77  -8.373 -13.765   2.135
  607    HE1  TYR  77           HE2      TYR  77  -5.496 -12.090   5.831
  608    HE2  TYR  77           HE1      TYR  77  -8.947 -11.604   3.253
  609    HH   TYR  77           HH       TYR  77  -6.838 -10.526   6.013
  610    H    LYS  78           H        LYS  78  -7.312 -16.392   0.244
  611    HA   LYS  78           HA       LYS  78  -6.949 -14.171  -1.721
  612    HB2  LYS  78           HB2      LYS  78  -8.027 -17.011  -1.877
  613    HB3  LYS  78           HB3      LYS  78  -8.728 -15.770  -2.909
  614    HG2  LYS  78           HG2      LYS  78  -7.040 -16.889  -4.150
  615    HG3  LYS  78           HG3      LYS  78  -6.500 -15.237  -3.845
  616    HD2  LYS  78           HD2      LYS  78  -4.879 -15.915  -2.255
  617    HD3  LYS  78           HD3      LYS  78  -5.590 -17.520  -2.046
  618    HE2  LYS  78           HE2      LYS  78  -4.391 -16.542  -4.679
  619    HE3  LYS  78           HE3      LYS  78  -3.449 -17.401  -3.446
  620    HZ1  LYS  78           HZ1      LYS  78  -4.972 -19.270  -3.669
  621    HZ2  LYS  78           HZ2      LYS  78  -5.839 -18.471  -4.810
  622    HZ3  LYS  78           HZ3      LYS  78  -4.289 -18.914  -5.128
  623    H    LEU  79           H        LEU  79  -8.678 -12.841  -2.086
  624    HA   LEU  79           HA       LEU  79 -10.727 -12.718  -0.015
  625    HB2  LEU  79           HB2      LEU  79 -10.804 -11.323  -2.690
  626    HB3  LEU  79           HB3      LEU  79 -11.570 -10.840  -1.193
  627    HG   LEU  79           HG       LEU  79  -8.558 -10.653  -1.631
  628   HD11  LEU  79          HD11      LEU  79  -9.825  -9.409  -3.334
  629   HD12  LEU  79          HD12      LEU  79 -10.853  -8.687  -2.085
  630   HD13  LEU  79          HD13      LEU  79  -9.121  -8.272  -2.194
  631   HD21  LEU  79          HD21      LEU  79 -10.505  -9.315   0.309
  632   HD22  LEU  79          HD22      LEU  79  -9.296 -10.543   0.751
  633   HD23  LEU  79          HD23      LEU  79  -8.777  -8.942   0.168
  634    HA   PRO  80           HA       PRO  80 -13.806 -14.803  -2.741
  635    HB2  PRO  80           HB2      PRO  80 -16.112 -13.833  -1.639
  636    HB3  PRO  80           HB3      PRO  80 -15.121 -15.083  -0.817
  637    HG2  PRO  80           HG2      PRO  80 -15.113 -12.101  -0.344
  638    HG3  PRO  80           HG3      PRO  80 -15.217 -13.400   0.877
  639    HD2  PRO  80           HD2      PRO  80 -12.853 -12.168   0.209
  640    HD3  PRO  80           HD3      PRO  80 -12.909 -13.900   0.648
  641    H    LYS  81           H        LYS  81 -15.023 -13.992  -4.588
  642    HA   LYS  81           HA       LYS  81 -13.844 -11.614  -5.519
  643    HB2  LYS  81           HB2      LYS  81 -16.166 -13.016  -6.855
  644    HB3  LYS  81           HB3      LYS  81 -15.064 -11.818  -7.566
  645    HG2  LYS  81           HG2      LYS  81 -13.140 -13.260  -7.281
  646    HG3  LYS  81           HG3      LYS  81 -14.097 -14.452  -6.388
  647    HD2  LYS  81           HD2      LYS  81 -13.689 -15.187  -8.650
  648    HD3  LYS  81           HD3      LYS  81 -15.418 -15.001  -8.300
  649    HE2  LYS  81           HE2      LYS  81 -15.479 -12.882  -9.547
  650    HE3  LYS  81           HE3      LYS  81 -13.731 -12.974  -9.836
  651    HZ1  LYS  81           HZ1      LYS  81 -14.114 -15.022 -11.056
  652    HZ2  LYS  81           HZ2      LYS  81 -15.736 -14.923 -10.798
  653    HZ3  LYS  81           HZ3      LYS  81 -14.977 -13.794 -11.724
  654    H    ARG  82           H        ARG  82 -16.777 -11.873  -3.797
  655    HA   ARG  82           HA       ARG  82 -18.034  -9.464  -4.681
  656    HB2  ARG  82           HB2      ARG  82 -19.213  -9.539  -2.535
  657    HB3  ARG  82           HB3      ARG  82 -19.173 -11.129  -3.298
  658    HG2  ARG  82           HG2      ARG  82 -17.089 -11.595  -1.762
  659    HG3  ARG  82           HG3      ARG  82 -17.616 -10.160  -0.863
  660    HD2  ARG  82           HD2      ARG  82 -19.372 -12.558  -1.498
  661    HD3  ARG  82           HD3      ARG  82 -18.465 -12.364   0.019
  662    HE   ARG  82           HE       ARG  82 -19.938 -10.019  -0.307
  663   HH11  ARG  82          HH11      ARG  82 -20.556 -13.477   0.019
  664   HH12  ARG  82          HH12      ARG  82 -22.090 -13.320   0.788
  665   HH21  ARG  82          HH21      ARG  82 -21.937  -9.723   0.744
  666   HH22  ARG  82          HH22      ARG  82 -22.902 -11.064   1.247
  667    H    LEU  83           H        LEU  83 -15.196 -10.012  -2.640
  668    HA   LEU  83           HA       LEU  83 -15.210  -7.186  -1.739
  669    HB2  LEU  83           HB2      LEU  83 -13.299  -9.456  -1.082
  670    HB3  LEU  83           HB3      LEU  83 -13.338  -7.864  -0.330
  671    HG   LEU  83           HG       LEU  83 -15.460 -10.028  -0.117
  672   HD11  LEU  83          HD11      LEU  83 -13.431 -10.451   1.219
  673   HD12  LEU  83          HD12      LEU  83 -13.563  -8.858   1.953
  674   HD13  LEU  83          HD13      LEU  83 -14.815 -10.085   2.262
  675   HD21  LEU  83          HD21      LEU  83 -15.476  -7.278   1.159
  676   HD22  LEU  83          HD22      LEU  83 -16.591  -7.860  -0.090
  677   HD23  LEU  83          HD23      LEU  83 -16.610  -8.601   1.514
  678    H    VAL  84           H        VAL  84 -13.877  -9.178  -4.251
  679    HA   VAL  84           HA       VAL  84 -11.398  -7.783  -4.622
  680    HB   VAL  84           HB       VAL  84 -13.135  -9.348  -6.588
  681   HG11  VAL  84          HG11      VAL  84 -11.596  -7.864  -7.810
  682   HG12  VAL  84          HG12      VAL  84 -10.252  -8.418  -6.799
  683   HG13  VAL  84          HG13      VAL  84 -11.018  -9.530  -7.912
  684   HG21  VAL  84          HG21      VAL  84 -10.597 -10.227  -5.155
  685   HG22  VAL  84          HG22      VAL  84 -12.211 -10.721  -4.659
  686   HG23  VAL  84          HG23      VAL  84 -11.576 -11.194  -6.255
  687    H    ARG  85           H        ARG  85 -11.000  -5.909  -5.644
  688    HA   ARG  85           HA       ARG  85 -13.321  -4.466  -6.769
  689    HB2  ARG  85           HB2      ARG  85 -11.132  -3.668  -5.027
  690    HB3  ARG  85           HB3      ARG  85 -11.083  -2.684  -6.468
  691    HG2  ARG  85           HG2      ARG  85 -13.604  -3.114  -4.874
  692    HG3  ARG  85           HG3      ARG  85 -12.514  -1.711  -4.766
  693    HD2  ARG  85           HD2      ARG  85 -12.824  -1.514  -7.360
  694    HD3  ARG  85           HD3      ARG  85 -14.218  -2.575  -7.160
  695    HE   ARG  85           HE       ARG  85 -13.887   0.193  -6.333
  696   HH11  ARG  85          HH11      ARG  85 -15.899  -2.741  -5.987
  697   HH12  ARG  85          HH12      ARG  85 -17.266  -1.891  -5.378
  698   HH21  ARG  85          HH21      ARG  85 -15.664   1.306  -5.519
  699   HH22  ARG  85          HH22      ARG  85 -17.131   0.501  -5.100
  700    H    TRP  86           H        TRP  86 -13.304  -5.704  -8.690
  701    HA   TRP  86           HA       TRP  86 -11.152  -5.837 -10.514
  702    HB2  TRP  86           HB2      TRP  86 -14.160  -5.827 -10.911
  703    HB3  TRP  86           HB3      TRP  86 -12.996  -6.283 -12.153
  704    HD1  TRP  86           HD1      TRP  86 -14.957  -7.746  -9.372
  705    HE1  TRP  86           HE1      TRP  86 -14.193 -10.070  -8.758
  706    HE3  TRP  86           HE3      TRP  86 -10.622  -7.860 -12.066
  707    HZ2  TRP  86           HZ2      TRP  86 -11.910 -11.856  -9.401
  708    HZ3  TRP  86           HZ3      TRP  86  -9.144  -9.849 -12.008
  709    HH2  TRP  86           HH2      TRP  86  -9.781 -11.844 -10.681
  710    H    ASP  87           H        ASP  87 -13.123  -3.104  -9.745
  711    HA   ASP  87           HA       ASP  87 -13.041  -1.849 -12.336
  712    HB2  ASP  87           HB2      ASP  87 -14.835  -1.482 -10.717
  713    HB3  ASP  87           HB3      ASP  87 -13.686  -0.804  -9.557
  714    H    THR  88           H        THR  88 -10.796  -1.937  -9.601
  715    HA   THR  88           HA       THR  88  -9.417   0.451 -10.734
  716    HB   THR  88           HB       THR  88 -10.329   0.585  -8.391
  717    HG1  THR  88           HG1      THR  88  -8.380   1.589  -7.693
  718   HG21  THR  88          HG21      THR  88  -9.639  -1.661  -7.597
  719   HG22  THR  88          HG22      THR  88  -7.940  -1.212  -7.762
  720   HG23  THR  88          HG23      THR  88  -8.971  -0.363  -6.584
  721    H    LYS  89           H        LYS  89  -7.002   0.352 -10.435
  722    HA   LYS  89           HA       LYS  89  -6.067  -2.347 -11.240
  723    HB2  LYS  89           HB2      LYS  89  -5.358   0.243 -12.659
  724    HB3  LYS  89           HB3      LYS  89  -4.781  -1.376 -13.088
  725    HG2  LYS  89           HG2      LYS  89  -7.687  -0.551 -13.058
  726    HG3  LYS  89           HG3      LYS  89  -6.663  -0.350 -14.460
  727    HD2  LYS  89           HD2      LYS  89  -6.433  -2.700 -14.827
  728    HD3  LYS  89           HD3      LYS  89  -7.155  -3.105 -13.223
  729    HE2  LYS  89           HE2      LYS  89  -9.225  -2.189 -13.671
  730    HE3  LYS  89           HE3      LYS  89  -8.587  -1.050 -14.857
  731    HZ1  LYS  89           HZ1      LYS  89  -8.645  -2.668 -16.525
  732    HZ2  LYS  89           HZ2      LYS  89  -9.209  -3.840 -15.466
  733    HZ3  LYS  89           HZ3      LYS  89 -10.085  -2.490 -15.756
  734    HA   PRO  90           HA       PRO  90  -4.389  -3.546 -11.211
  735    HB2  PRO  90           HB2      PRO  90  -2.814  -4.957  -9.518
  736    HB3  PRO  90           HB3      PRO  90  -2.165  -4.030 -10.911
  737    HG2  PRO  90           HG2      PRO  90  -2.353  -3.187  -8.019
  738    HG3  PRO  90           HG3      PRO  90  -0.926  -3.044  -9.112
  739    HD2  PRO  90           HD2      PRO  90  -2.669  -0.976  -8.563
  740    HD3  PRO  90           HD3      PRO  90  -1.870  -1.142 -10.159
  741    H    VAL  91           H        VAL  91  -5.674  -5.234 -10.424
  742    HA   VAL  91           HA       VAL  91  -7.452  -4.540  -8.252
  743    HB   VAL  91           HB       VAL  91  -8.182  -5.383 -10.446
  744   HG11  VAL  91          HG11      VAL  91  -6.403  -7.053 -11.010
  745   HG12  VAL  91          HG12      VAL  91  -7.027  -8.093  -9.707
  746   HG13  VAL  91          HG13      VAL  91  -8.045  -7.712 -11.103
  747   HG21  VAL  91          HG21      VAL  91  -8.799  -7.366  -8.222
  748   HG22  VAL  91          HG22      VAL  91  -9.574  -5.816  -8.507
  749   HG23  VAL  91          HG23      VAL  91  -9.742  -7.109  -9.700
  750    H    CYS  92           H        CYS  92  -7.499  -5.520  -6.209
  751    HA   CYS  92           HA       CYS  92  -5.249  -7.299  -5.549
  752    HB2  CYS  92           HB2      CYS  92  -5.831  -6.957  -3.239
  753    HB3  CYS  92           HB3      CYS  92  -5.655  -5.421  -4.075
  754    HG   CYS  92           HG       CYS  92  -7.396  -5.196  -2.258
  755    H    ILE  93           H        ILE  93  -5.533  -9.470  -5.393
  756    HA   ILE  93           HA       ILE  93  -8.304 -10.467  -4.909
  757    HB   ILE  93           HB       ILE  93  -8.056 -12.314  -6.233
  758   HG12  ILE  93          HG12      ILE  93  -5.858 -13.132  -5.757
  759   HG13  ILE  93          HG13      ILE  93  -6.121 -13.054  -7.486
  760   HG21  ILE  93          HG21      ILE  93  -8.599 -10.336  -7.505
  761   HG22  ILE  93          HG22      ILE  93  -6.890  -9.994  -7.822
  762   HG23  ILE  93          HG23      ILE  93  -7.641 -11.444  -8.502
  763   HD11  ILE  93          HD11      ILE  93  -4.734 -10.981  -7.605
  764   HD12  ILE  93          HD12      ILE  93  -4.444 -11.129  -5.847
  765   HD13  ILE  93          HD13      ILE  93  -3.858 -12.368  -6.951
  766    H    GLY  94           H        GLY  94  -5.125 -10.293  -3.626
  767    HA2  GLY  94           HA2      GLY  94  -5.949 -11.737  -1.305
  768    HA3  GLY  94           HA3      GLY  94  -4.825 -12.700  -2.277
  769    H    GLN  95           H        GLN  95  -3.758 -12.262  -0.007
  770    HA   GLN  95           HA       GLN  95  -1.568 -10.431  -0.531
  771    HB2  GLN  95           HB2      GLN  95  -1.693  -9.314   1.684
  772    HB3  GLN  95           HB3      GLN  95  -2.994  -8.852   0.601
  773    HG2  GLN  95           HG2      GLN  95  -3.531 -11.043   2.617
  774    HG3  GLN  95           HG3      GLN  95  -3.405  -9.376   3.173
  775   HE21  GLN  95          HE22      GLN  95  -5.560 -11.639   1.796
  776   HE22  GLN  95          HE21      GLN  95  -6.805 -10.494   1.357
  777    H    LYS  96           H        LYS  96   0.192 -10.861   1.002
  778    HA   LYS  96           HA       LYS  96  -0.105 -13.462   2.447
  779    HB2  LYS  96           HB2      LYS  96   2.441 -13.530   2.405
  780    HB3  LYS  96           HB3      LYS  96   1.594 -14.004   0.938
  781    HG2  LYS  96           HG2      LYS  96   2.030 -11.777  -0.047
  782    HG3  LYS  96           HG3      LYS  96   2.877 -11.280   1.423
  783    HD2  LYS  96           HD2      LYS  96   3.691 -13.334  -0.653
  784    HD3  LYS  96           HD3      LYS  96   4.441 -11.776  -0.286
  785    HE2  LYS  96           HE2      LYS  96   5.184 -12.658   1.920
  786    HE3  LYS  96           HE3      LYS  96   4.497 -14.236   1.518
  787    HZ1  LYS  96           HZ1      LYS  96   5.986 -14.330  -0.394
  788    HZ2  LYS  96           HZ2      LYS  96   6.603 -12.853  -0.043
  789    HZ3  LYS  96           HZ3      LYS  96   6.856 -14.120   0.973
  790    H    GLN  97           H        GLN  97   0.136 -13.350   4.592
  791    HA   GLN  97           HA       GLN  97   0.820 -10.719   5.771
  792    HB2  GLN  97           HB2      GLN  97  -1.301 -12.794   6.445
  793    HB3  GLN  97           HB3      GLN  97  -0.597 -11.772   7.694
  794    HG2  GLN  97           HG2      GLN  97  -1.063  -9.816   6.308
  795    HG3  GLN  97           HG3      GLN  97  -2.004 -10.819   5.190
  796   HE21  GLN  97          HE22      GLN  97  -2.333  -8.627   7.536
  797   HE22  GLN  97          HE21      GLN  97  -3.891  -9.072   8.159
  798    H    LYS  98           H        LYS  98   2.452 -10.644   7.148
  799    HA   LYS  98           HA       LYS  98   3.417 -13.189   8.400
  800    HB2  LYS  98           HB2      LYS  98   5.017 -11.901   6.921
  801    HB3  LYS  98           HB3      LYS  98   4.895 -10.564   8.053
  802    HG2  LYS  98           HG2      LYS  98   6.040 -11.643   9.721
  803    HG3  LYS  98           HG3      LYS  98   5.658 -13.261   9.120
  804    HD2  LYS  98           HD2      LYS  98   7.381 -11.467   7.430
  805    HD3  LYS  98           HD3      LYS  98   8.088 -12.237   8.852
  806    HE2  LYS  98           HE2      LYS  98   6.507 -13.941   6.915
  807    HE3  LYS  98           HE3      LYS  98   8.105 -13.372   6.437
  808    HZ1  LYS  98           HZ1      LYS  98   9.015 -14.398   8.431
  809    HZ2  LYS  98           HZ2      LYS  98   7.547 -14.952   8.898
  810    HZ3  LYS  98           HZ3      LYS  98   8.223 -15.529   7.542
  811    H    TRP  99           H        TRP  99   3.480 -13.148  10.756
  812    HA   TRP  99           HA       TRP  99   2.162 -10.763  11.940
  813    HB2  TRP  99           HB2      TRP  99   1.573 -13.688  12.444
  814    HB3  TRP  99           HB3      TRP  99   1.031 -12.372  13.472
  815    HD1  TRP  99           HD1      TRP  99   0.501 -13.759   9.916
  816    HE1  TRP  99           HE1      TRP  99  -1.777 -12.977   9.039
  817    HE3  TRP  99           HE3      TRP  99  -0.717 -10.515  13.668
  818    HZ2  TRP  99           HZ2      TRP  99  -3.833 -11.078   9.831
  819    HZ3  TRP  99           HZ3      TRP  99  -2.704  -9.054  13.454
  820    HH2  TRP  99           HH2      TRP  99  -4.296  -9.361  11.573
  821    H    PHE 100           H        PHE 100   2.768 -10.372  14.137
  822    HA   PHE 100           HA       PHE 100   5.300 -11.626  15.072
  823    HB2  PHE 100           HB2      PHE 100   4.645  -8.672  14.750
  824    HB3  PHE 100           HB3      PHE 100   6.026  -9.331  15.623
  825    HD1  PHE 100           HD1      PHE 100   4.513  -9.136  12.198
  826    HD2  PHE 100           HD2      PHE 100   8.075  -9.711  14.559
  827    HE1  PHE 100           HE1      PHE 100   5.884  -9.093  10.142
  828    HE2  PHE 100           HE2      PHE 100   9.447  -9.677  12.505
  829    HZ   PHE 100           HZ       PHE 100   8.358  -9.412  10.282
  830    H    LEU 101           H        LEU 101   5.134 -12.062  17.234
  831    HA   LEU 101           HA       LEU 101   2.953 -10.820  18.831
  832    HB2  LEU 101           HB2      LEU 101   2.896 -13.051  19.358
  833    HB3  LEU 101           HB3      LEU 101   4.708 -13.210  19.299
  834    HG   LEU 101           HG       LEU 101   4.289 -11.591  21.415
  835   HD11  LEU 101          HD11      LEU 101   2.040 -11.563  21.890
  836   HD12  LEU 101          HD12      LEU 101   1.648 -13.090  20.999
  837   HD13  LEU 101          HD13      LEU 101   2.423 -13.215  22.446
  838   HD21  LEU 101          HD21      LEU 101   3.924 -14.547  21.805
  839   HD22  LEU 101          HD22      LEU 101   5.475 -13.891  21.340
  840   HD23  LEU 101          HD23      LEU 101   4.646 -13.263  22.803
  841    H    LEU 102           H        LEU 102   3.570  -9.165  20.031
  842    HA   LEU 102           HA       LEU 102   6.400  -9.002  20.872
  843    HB2  LEU 102           HB2      LEU 102   4.552  -6.621  20.787
  844    HB3  LEU 102           HB3      LEU 102   6.293  -6.615  20.873
  845    HG   LEU 102           HG       LEU 102   4.479  -7.283  18.522
  846   HD11  LEU 102          HD11      LEU 102   4.733  -5.040  18.084
  847   HD12  LEU 102          HD12      LEU 102   6.372  -4.943  18.861
  848   HD13  LEU 102          HD13      LEU 102   6.139  -5.643  17.312
  849   HD21  LEU 102          HD21      LEU 102   7.459  -7.242  18.187
  850   HD22  LEU 102          HD22      LEU 102   6.620  -8.747  18.497
  851   HD23  LEU 102          HD23      LEU 102   6.152  -7.827  17.099
  852    H    GLN 103           H        GLN 103   6.657  -8.419  23.148
  853    HA   GLN 103           HA       GLN 103   4.059  -8.367  24.660
  854    HB2  GLN 103           HB2      GLN 103   5.230 -10.025  25.617
  855    HB3  GLN 103           HB3      GLN 103   6.809  -9.205  25.545
  856    HG2  GLN 103           HG2      GLN 103   6.368  -7.959  27.459
  857    HG3  GLN 103           HG3      GLN 103   4.624  -7.917  27.157
  858   HE21  GLN 103          HE22      GLN 103   3.349  -9.905  27.427
  859   HE22  GLN 103          HE21      GLN 103   3.897 -11.016  28.670
  860    H    LEU 104           H        LEU 104   3.458  -6.582  25.480
  861    HA   LEU 104           HA       LEU 104   4.710  -4.068  25.024
  862    HB2  LEU 104           HB2      LEU 104   2.192  -5.138  26.177
  863    HB3  LEU 104           HB3      LEU 104   2.819  -3.889  27.215
  864    HG   LEU 104           HG       LEU 104   1.891  -3.727  24.351
  865   HD11  LEU 104          HD11      LEU 104   0.055  -2.838  25.461
  866   HD12  LEU 104          HD12      LEU 104   1.089  -2.272  26.795
  867   HD13  LEU 104          HD13      LEU 104   0.979  -1.351  25.363
  868   HD21  LEU 104          HD21      LEU 104   3.340  -1.370  25.486
  869   HD22  LEU 104          HD22      LEU 104   3.986  -2.469  24.224
  870   HD23  LEU 104          HD23      LEU 104   2.480  -1.644  23.992
  871    H    VAL 105           H        VAL 105   6.013  -2.800  26.365
  872    HA   VAL 105           HA       VAL 105   7.399  -4.436  28.376
  873    HB   VAL 105           HB       VAL 105   8.008  -1.771  27.066
  874   HG11  VAL 105          HG11      VAL 105   9.068  -1.789  29.269
  875   HG12  VAL 105          HG12      VAL 105   9.782  -3.385  28.934
  876   HG13  VAL 105          HG13      VAL 105  10.274  -1.951  27.991
  877   HG21  VAL 105          HG21      VAL 105   9.286  -4.526  26.731
  878   HG22  VAL 105          HG22      VAL 105   8.199  -3.767  25.576
  879   HG23  VAL 105          HG23      VAL 105   9.777  -3.035  25.887
  880    H    SER 106           H        SER 106   5.869  -1.103  28.291
  881    HA   SER 106           HA       SER 106   5.892  -1.018  31.216
  882    HB2  SER 106           HB2      SER 106   4.759   0.753  29.032
  883    HB3  SER 106           HB3      SER 106   4.474   1.073  30.749
  884    HG   SER 106           HG       SER 106   6.502   1.825  29.369
  885    H    GLY 107           H        GLY 107   3.697  -2.165  28.769
  886    HA2  GLY 107           HA2      GLY 107   1.805  -3.602  29.411
  887    HA3  GLY 107           HA3      GLY 107   1.613  -2.640  30.881
  888    H    ASP 108           H        ASP 108  -0.573  -2.827  29.669
  889    HA   ASP 108           HA       ASP 108  -1.166  -1.763  27.235
  890    HB2  ASP 108           HB2      ASP 108  -3.223  -2.442  27.637
  891    HB3  ASP 108           HB3      ASP 108  -2.451  -3.251  28.985
  892    H    ALA 109           H        ALA 109  -0.673   0.024  30.090
  893    HA   ALA 109           HA       ALA 109  -1.969   2.420  29.656
  894    HB1  ALA 109           HB1      ALA 109  -0.678   1.846  31.682
  895    HB2  ALA 109           HB2      ALA 109   0.838   1.880  30.743
  896    HB3  ALA 109           HB3      ALA 109  -0.084   3.376  30.990
  897    H    GLU 110           H        GLU 110   0.877   1.130  27.942
  898    HA   GLU 110           HA       GLU 110   1.461   3.757  26.770
  899    HB2  GLU 110           HB2      GLU 110   2.882   1.089  26.920
  900    HB3  GLU 110           HB3      GLU 110   3.380   2.246  25.688
  901    HG2  GLU 110           HG2      GLU 110   3.255   2.823  28.671
  902    HG3  GLU 110           HG3      GLU 110   4.712   2.498  27.737
  903    H    ILE 111           H        ILE 111  -1.035   2.193  26.075
  904    HA   ILE 111           HA       ILE 111  -0.663   2.066  23.123
  905    HB   ILE 111           HB       ILE 111  -3.006   1.283  24.923
  906   HG12  ILE 111          HG12      ILE 111  -1.231  -0.552  23.225
  907   HG13  ILE 111          HG13      ILE 111  -0.898  -0.235  24.923
  908   HG21  ILE 111          HG21      ILE 111  -3.831   2.057  22.768
  909   HG22  ILE 111          HG22      ILE 111  -2.537   1.214  21.954
  910   HG23  ILE 111          HG23      ILE 111  -3.864   0.289  22.748
  911   HD11  ILE 111          HD11      ILE 111  -3.080  -1.119  25.598
  912   HD12  ILE 111          HD12      ILE 111  -3.480  -1.478  23.926
  913   HD13  ILE 111          HD13      ILE 111  -2.128  -2.320  24.703
  914    H    ASN 112           H        ASN 112  -1.458   3.688  21.839
  915    HA   ASN 112           HA       ASN 112  -3.213   5.813  22.988
  916    HB2  ASN 112           HB2      ASN 112  -0.904   6.766  22.852
  917    HB3  ASN 112           HB3      ASN 112  -0.767   6.158  21.201
  918   HD21  ASN 112          HD22      ASN 112  -0.532   8.319  20.262
  919   HD22  ASN 112          HD21      ASN 112  -1.932   9.373  20.117
  920    H    MET 113           H        MET 113  -5.113   5.416  21.715
  921    HA   MET 113           HA       MET 113  -4.729   4.160  19.093
  922    HB2  MET 113           HB2      MET 113  -7.197   4.955  20.662
  923    HB3  MET 113           HB3      MET 113  -7.179   3.937  19.210
  924    HG2  MET 113           HG2      MET 113  -5.232   2.834  21.022
  925    HG3  MET 113           HG3      MET 113  -6.654   3.204  21.982
  926    HE1  MET 113           HE1      MET 113  -4.901   0.918  19.492
  927    HE2  MET 113           HE2      MET 113  -5.151   0.297  21.134
  928    HE3  MET 113           HE3      MET 113  -5.919  -0.522  19.764
  929    H    GLN 114           H        GLN 114  -4.239   7.276  19.752
  930    HA   GLN 114           HA       GLN 114  -5.473   8.242  17.247
  931    HB2  GLN 114           HB2      GLN 114  -5.455  10.481  18.968
  932    HB3  GLN 114           HB3      GLN 114  -6.797   9.737  18.129
  933    HG2  GLN 114           HG2      GLN 114  -7.180   8.250  20.063
  934    HG3  GLN 114           HG3      GLN 114  -5.785   8.981  20.897
  935   HE21  GLN 114          HE22      GLN 114  -6.834  11.723  19.515
  936   HE22  GLN 114          HE21      GLN 114  -8.049  12.167  20.703
  937    H    THR 115           H        THR 115  -3.479   7.625  16.574
  938    HA   THR 115           HA       THR 115  -1.079   9.120  17.199
  939    HB   THR 115           HB       THR 115  -0.579   7.858  14.913
  940    HG1  THR 115           HG1      THR 115  -2.128   6.149  14.565
  941   HG21  THR 115          HG21      THR 115   0.143   7.145  17.161
  942   HG22  THR 115          HG22      THR 115  -1.459   6.412  17.487
  943   HG23  THR 115          HG23      THR 115  -0.468   5.781  16.208
  944    H    SER 116           H        SER 116  -3.247   8.834  14.400
  945    HA   SER 116           HA       SER 116  -2.682  11.492  13.380
  946    HB2  SER 116           HB2      SER 116  -4.819   9.404  12.723
  947    HB3  SER 116           HB3      SER 116  -4.509  10.885  11.787
  948    HG   SER 116           HG       SER 116  -3.381   8.798  11.159
  949    H    SER 117           H        SER 117  -4.573  13.051  13.087
  950    HA   SER 117           HA       SER 117  -5.747  13.790  15.522
  951    HB2  SER 117           HB2      SER 117  -6.928  14.392  12.790
  952    HB3  SER 117           HB3      SER 117  -6.889  15.427  14.232
  953    HG   SER 117           HG       SER 117  -5.322  16.065  12.699
  954    H    THR 118           H        THR 118  -6.987  11.727  12.855
  955    HA   THR 118           HA       THR 118  -9.470  11.137  14.229
  956    HB   THR 118           HB       THR 118  -8.894   9.213  12.191
  957    HG1  THR 118           HG1      THR 118  -8.476  10.532  10.442
  958   HG21  THR 118          HG21      THR 118 -11.107  10.157  12.712
  959   HG22  THR 118          HG22      THR 118 -10.580  11.752  12.117
  960   HG23  THR 118          HG23      THR 118 -10.722  10.376  10.996
  961    HA   PRO 119           HA       PRO 119  -7.407   7.727  16.436
  962    HB2  PRO 119           HB2      PRO 119 -10.137   6.597  16.691
  963    HB3  PRO 119           HB3      PRO 119  -8.982   7.030  17.984
  964    HG2  PRO 119           HG2      PRO 119 -11.303   8.454  17.389
  965    HG3  PRO 119           HG3      PRO 119  -9.840   9.183  18.133
  966    HD2  PRO 119           HD2      PRO 119 -10.788   9.342  15.292
  967    HD3  PRO 119           HD3      PRO 119  -9.883  10.535  16.282
  968    H    GLU 120           H        GLU 120  -6.647   5.875  15.433
  969    HA   GLU 120           HA       GLU 120  -7.846   4.983  12.914
  970    HB2  GLU 120           HB2      GLU 120  -5.423   4.301  14.584
  971    HB3  GLU 120           HB3      GLU 120  -6.045   3.023  13.550
  972    HG2  GLU 120           HG2      GLU 120  -5.039   5.754  12.708
  973    HG3  GLU 120           HG3      GLU 120  -4.364   4.168  12.317
  974    H    PHE 121           H        PHE 121  -8.098   4.142  16.286
  975    HA   PHE 121           HA       PHE 121  -9.924   1.901  15.533
  976    HB2  PHE 121           HB2      PHE 121  -8.128   2.235  17.924
  977    HB3  PHE 121           HB3      PHE 121  -9.403   1.028  17.844
  978    HD1  PHE 121           HD1      PHE 121  -9.224  -0.312  15.362
  979    HD2  PHE 121           HD2      PHE 121  -6.018   1.328  17.650
  980    HE1  PHE 121           HE1      PHE 121  -7.686  -1.901  14.260
  981    HE2  PHE 121           HE2      PHE 121  -4.515  -0.411  16.747
  982    HZ   PHE 121           HZ       PHE 121  -5.334  -2.024  15.043
  983    H    ASP 122           H        ASP 122 -11.809   1.817  16.557
  984    HA   ASP 122           HA       ASP 122 -12.782   4.237  17.997
  985    HB2  ASP 122           HB2      ASP 122 -14.136   3.403  16.150
  986    HB3  ASP 122           HB3      ASP 122 -14.170   1.777  16.838
  987    H    GLY 123           H        GLY 123 -11.779   0.846  18.496
  988    HA2  GLY 123           HA2      GLY 123 -12.251   1.185  21.383
  989    HA3  GLY 123           HA3      GLY 123 -13.216  -0.067  20.580
  990    H    TRP 124           H        TRP 124 -11.258  -0.492  22.659
  991    HA   TRP 124           HA       TRP 124  -9.833  -2.576  21.224
  992    HB2  TRP 124           HB2      TRP 124  -7.799  -1.773  21.337
  993    HB3  TRP 124           HB3      TRP 124  -8.454  -0.234  21.857
  994    HD1  TRP 124           HD1      TRP 124  -6.749  -3.346  23.147
  995    HE1  TRP 124           HE1      TRP 124  -5.915  -2.977  25.529
  996    HE3  TRP 124           HE3      TRP 124  -8.764   1.279  24.001
  997    HZ2  TRP 124           HZ2      TRP 124  -6.134  -0.949  27.608
  998    HZ3  TRP 124           HZ3      TRP 124  -8.386   2.426  26.176
  999    HH2  TRP 124           HH2      TRP 124  -7.070   1.309  27.971
 1000    H    ARG 125           H        ARG 125  -9.238  -4.303  22.647
 1001    HA   ARG 125           HA       ARG 125 -10.005  -4.145  25.449
 1002    HB2  ARG 125           HB2      ARG 125 -11.589  -6.010  25.374
 1003    HB3  ARG 125           HB3      ARG 125 -12.155  -4.662  24.396
 1004    HG2  ARG 125           HG2      ARG 125 -11.169  -5.917  22.353
 1005    HG3  ARG 125           HG3      ARG 125 -11.008  -7.311  23.411
 1006    HD2  ARG 125           HD2      ARG 125 -13.619  -5.798  22.924
 1007    HD3  ARG 125           HD3      ARG 125 -13.113  -7.230  22.013
 1008    HE   ARG 125           HE       ARG 125 -13.040  -7.720  24.836
 1009   HH11  ARG 125          HH11      ARG 125 -15.335  -7.480  22.115
 1010   HH12  ARG 125          HH12      ARG 125 -16.507  -8.527  22.840
 1011   HH21  ARG 125          HH21      ARG 125 -14.633  -9.011  25.815
 1012   HH22  ARG 125          HH22      ARG 125 -16.072  -9.452  24.972
 1013    H    TRP 126           H        TRP 126  -9.360  -6.241  26.538
 1014    HA   TRP 126           HA       TRP 126  -7.221  -7.693  25.061
 1015    HB2  TRP 126           HB2      TRP 126  -7.444  -6.853  27.961
 1016    HB3  TRP 126           HB3      TRP 126  -6.416  -8.175  27.448
 1017    HD1  TRP 126           HD1      TRP 126  -6.718  -4.352  27.091
 1018    HE1  TRP 126           HE1      TRP 126  -4.394  -3.389  26.729
 1019    HE3  TRP 126           HE3      TRP 126  -4.125  -8.700  26.376
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.713  -4.356  26.175
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.708  -8.621  25.973
 1022    HH2  TRP 126           HH2      TRP 126  -0.464  -6.488  25.900
 1023    H    VAL 127           H        VAL 127  -7.505  -9.933  25.001
 1024    HA   VAL 127           HA       VAL 127  -9.874 -11.148  26.321
 1025    HB   VAL 127           HB       VAL 127 -10.302 -12.136  23.922
 1026   HG11  VAL 127          HG11      VAL 127 -11.922 -10.801  25.111
 1027   HG12  VAL 127          HG12      VAL 127 -11.106  -9.300  24.625
 1028   HG13  VAL 127          HG13      VAL 127 -11.892 -10.316  23.406
 1029   HG21  VAL 127          HG21      VAL 127  -8.997  -9.503  23.078
 1030   HG22  VAL 127          HG22      VAL 127  -8.378 -11.129  22.739
 1031   HG23  VAL 127          HG23      VAL 127  -9.920 -10.611  22.046
 1032    H    SER 128           H        SER 128  -9.755 -13.533  26.349
 1033    HA   SER 128           HA       SER 128  -7.161 -14.726  26.385
 1034    HB2  SER 128           HB2      SER 128  -9.856 -16.048  25.819
 1035    HB3  SER 128           HB3      SER 128  -8.421 -16.793  26.554
 1036    HG   SER 128           HG       SER 128  -9.969 -16.200  28.146
 1037    H    TYR 129           H        TYR 129  -6.145 -16.109  24.705
 1038    HA   TYR 129           HA       TYR 129  -6.241 -14.937  22.189
 1039    HB2  TYR 129           HB2      TYR 129  -5.175 -17.481  21.658
 1040    HB3  TYR 129           HB3      TYR 129  -4.344 -16.000  22.046
 1041    HD1  TYR 129           HD1      TYR 129  -5.737 -19.125  23.621
 1042    HD2  TYR 129           HD2      TYR 129  -3.000 -15.804  23.788
 1043    HE1  TYR 129           HE1      TYR 129  -4.731 -20.048  25.746
 1044    HE2  TYR 129           HE2      TYR 129  -1.945 -16.787  25.735
 1045    HH   TYR 129           HH       TYR 129  -2.209 -17.884  27.323
 1046    H    TRP 130           H        TRP 130  -8.221 -17.719  23.200
 1047    HA   TRP 130           HA       TRP 130  -8.767 -18.331  20.371
 1048    HB2  TRP 130           HB2      TRP 130  -9.885 -19.601  22.874
 1049    HB3  TRP 130           HB3      TRP 130 -10.012 -20.213  21.225
 1050    HD1  TRP 130           HD1      TRP 130  -8.220 -21.004  24.162
 1051    HE1  TRP 130           HE1      TRP 130  -5.932 -22.066  23.768
 1052    HE3  TRP 130           HE3      TRP 130  -7.631 -19.858  19.195
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.991 -22.247  21.615
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.561 -20.524  18.002
 1055    HH2  TRP 130           HH2      TRP 130  -3.733 -21.673  19.231
 1056    H    TYR 131           H        TYR 131 -10.196 -16.357  22.819
 1057    HA   TYR 131           HA       TYR 131 -12.966 -16.491  22.048
 1058    HB2  TYR 131           HB2      TYR 131 -12.231 -15.478  24.151
 1059    HB3  TYR 131           HB3      TYR 131 -11.308 -14.240  23.300
 1060    HD1  TYR 131           HD2      TYR 131 -14.646 -15.681  23.861
 1061    HD2  TYR 131           HD1      TYR 131 -12.517 -12.211  22.405
 1062    HE1  TYR 131           HE2      TYR 131 -16.739 -14.449  23.792
 1063    HE2  TYR 131           HE1      TYR 131 -14.644 -10.897  22.459
 1064    HH   TYR 131           HH       TYR 131 -17.614 -12.658  23.696
 1065    HA   PRO 132           HA       PRO 132 -11.801 -12.933  19.417
 1066    HB2  PRO 132           HB2      PRO 132  -9.273 -12.842  18.141
 1067    HB3  PRO 132           HB3      PRO 132  -9.805 -12.375  19.813
 1068    HG2  PRO 132           HG2      PRO 132  -8.215 -14.574  19.306
 1069    HG3  PRO 132           HG3      PRO 132  -7.958 -13.075  20.314
 1070    HD2  PRO 132           HD2      PRO 132  -9.287 -15.153  21.423
 1071    HD3  PRO 132           HD3      PRO 132  -9.840 -13.485  21.695
 1072    H    VAL 133           H        VAL 133 -10.461 -15.937  18.439
 1073    HA   VAL 133           HA       VAL 133 -10.828 -15.737  15.663
 1074    HB   VAL 133           HB       VAL 133 -10.949 -18.161  17.511
 1075   HG11  VAL 133          HG11      VAL 133 -11.394 -18.607  15.121
 1076   HG12  VAL 133          HG12      VAL 133  -9.869 -17.801  14.687
 1077   HG13  VAL 133          HG13      VAL 133  -9.867 -19.305  15.665
 1078   HG21  VAL 133          HG21      VAL 133  -8.449 -16.700  16.498
 1079   HG22  VAL 133          HG22      VAL 133  -8.948 -16.835  18.194
 1080   HG23  VAL 133          HG23      VAL 133  -8.463 -18.275  17.329
 1081    H    ARG 134           H        ARG 134 -13.143 -16.247  18.279
 1082    HA   ARG 134           HA       ARG 134 -15.128 -17.646  16.758
 1083    HB2  ARG 134           HB2      ARG 134 -15.757 -15.761  19.067
 1084    HB3  ARG 134           HB3      ARG 134 -16.585 -17.232  18.594
 1085    HG2  ARG 134           HG2      ARG 134 -13.729 -17.208  19.753
 1086    HG3  ARG 134           HG3      ARG 134 -15.185 -17.377  20.712
 1087    HD2  ARG 134           HD2      ARG 134 -14.817 -19.144  18.274
 1088    HD3  ARG 134           HD3      ARG 134 -13.922 -19.517  19.773
 1089    HE   ARG 134           HE       ARG 134 -16.577 -18.742  20.357
 1090   HH11  ARG 134          HH11      ARG 134 -14.892 -21.534  19.019
 1091   HH12  ARG 134          HH12      ARG 134 -16.056 -22.691  19.568
 1092   HH21  ARG 134          HH21      ARG 134 -18.039 -20.086  21.114
 1093   HH22  ARG 134          HH22      ARG 134 -17.986 -21.794  20.871
 1094    H    GLN 135           H        GLN 135 -14.354 -14.206  16.943
 1095    HA   GLN 135           HA       GLN 135 -17.108 -13.430  16.267
 1096    HB2  GLN 135           HB2      GLN 135 -14.473 -11.971  16.718
 1097    HB3  GLN 135           HB3      GLN 135 -15.866 -11.146  16.066
 1098    HG2  GLN 135           HG2      GLN 135 -15.208 -11.245  18.712
 1099    HG3  GLN 135           HG3      GLN 135 -16.719 -10.730  17.999
 1100   HE21  GLN 135          HE22      GLN 135 -15.252 -13.344  19.987
 1101   HE22  GLN 135          HE21      GLN 135 -16.871 -13.787  20.516
 1102    H    VAL 136           H        VAL 136 -14.124 -14.133  14.497
 1103    HA   VAL 136           HA       VAL 136 -14.947 -12.379  12.295
 1104    HB   VAL 136           HB       VAL 136 -12.747 -13.240  11.289
 1105   HG11  VAL 136          HG11      VAL 136 -13.117 -10.985  12.196
 1106   HG12  VAL 136          HG12      VAL 136 -12.751 -11.573  13.834
 1107   HG13  VAL 136          HG13      VAL 136 -11.509 -11.588  12.566
 1108   HG21  VAL 136          HG21      VAL 136 -12.180 -14.039  14.185
 1109   HG22  VAL 136          HG22      VAL 136 -12.325 -15.152  12.819
 1110   HG23  VAL 136          HG23      VAL 136 -11.030 -13.979  12.836
 1111    H    VAL 137           H        VAL 137 -14.778 -13.237  10.013
 1112    HA   VAL 137           HA       VAL 137 -16.651 -15.453   9.766
 1113    HB   VAL 137           HB       VAL 137 -16.878 -14.817   7.521
 1114   HG11  VAL 137          HG11      VAL 137 -17.786 -13.107   9.037
 1115   HG12  VAL 137          HG12      VAL 137 -16.258 -12.206   8.997
 1116   HG13  VAL 137          HG13      VAL 137 -17.224 -12.387   7.524
 1117   HG21  VAL 137          HG21      VAL 137 -14.216 -13.341   7.698
 1118   HG22  VAL 137          HG22      VAL 137 -14.564 -14.801   6.764
 1119   HG23  VAL 137          HG23      VAL 137 -15.332 -13.300   6.305
 1120    H    SER 138           H        SER 138 -16.137 -17.086   7.851
 1121    HA   SER 138           HA       SER 138 -14.430 -18.902   8.851
 1122    HB2  SER 138           HB2      SER 138 -15.214 -18.597   5.925
 1123    HB3  SER 138           HB3      SER 138 -14.838 -20.111   6.774
 1124    HG   SER 138           HG       SER 138 -17.108 -19.734   6.672
 1125    H    PHE 139           H        PHE 139 -13.466 -16.734   6.050
 1126    HA   PHE 139           HA       PHE 139 -10.953 -18.208   5.966
 1127    HB2  PHE 139           HB2      PHE 139 -10.278 -16.602   4.258
 1128    HB3  PHE 139           HB3      PHE 139 -11.695 -17.554   3.872
 1129    HD1  PHE 139           HD1      PHE 139 -14.072 -16.364   4.423
 1130    HD2  PHE 139           HD2      PHE 139 -10.286 -14.453   3.622
 1131    HE1  PHE 139           HE1      PHE 139 -15.259 -14.371   3.602
 1132    HE2  PHE 139           HE2      PHE 139 -11.476 -12.515   2.661
 1133    HZ   PHE 139           HZ       PHE 139 -13.970 -12.436   2.715
 1134    H    LYS 140           H        LYS 140 -12.025 -15.159   7.481
 1135    HA   LYS 140           HA       LYS 140  -9.274 -14.410   8.121
 1136    HB2  LYS 140           HB2      LYS 140 -11.954 -13.485   9.213
 1137    HB3  LYS 140           HB3      LYS 140 -10.388 -12.867   9.800
 1138    HG2  LYS 140           HG2      LYS 140  -9.778 -12.238   7.459
 1139    HG3  LYS 140           HG3      LYS 140 -11.366 -12.771   6.905
 1140    HD2  LYS 140           HD2      LYS 140 -10.645 -10.375   8.594
 1141    HD3  LYS 140           HD3      LYS 140 -11.443 -10.442   7.013
 1142    HE2  LYS 140           HE2      LYS 140 -13.419 -11.549   8.127
 1143    HE3  LYS 140           HE3      LYS 140 -12.621 -11.286   9.695
 1144    HZ1  LYS 140           HZ1      LYS 140 -12.652  -8.921   9.217
 1145    HZ2  LYS 140           HZ2      LYS 140 -13.410  -9.165   7.786
 1146    HZ3  LYS 140           HZ3      LYS 140 -14.187  -9.522   9.187
 1147    H    ARG 141           H        ARG 141 -11.871 -16.265   9.774
 1148    HA   ARG 141           HA       ARG 141 -10.646 -16.754  12.240
 1149    HB2  ARG 141           HB2      ARG 141 -12.286 -18.632  10.428
 1150    HB3  ARG 141           HB3      ARG 141 -11.634 -19.175  11.985
 1151    HG2  ARG 141           HG2      ARG 141 -12.591 -17.360  13.091
 1152    HG3  ARG 141           HG3      ARG 141 -13.311 -16.705  11.640
 1153    HD2  ARG 141           HD2      ARG 141 -14.329 -18.444  13.678
 1154    HD3  ARG 141           HD3      ARG 141 -15.100 -17.451  12.484
 1155    HE   ARG 141           HE       ARG 141 -14.412 -20.271  12.092
 1156   HH11  ARG 141          HH11      ARG 141 -16.753 -17.599  11.734
 1157   HH12  ARG 141          HH12      ARG 141 -18.123 -18.590  12.059
 1158   HH21  ARG 141          HH21      ARG 141 -16.073 -21.436  12.839
 1159   HH22  ARG 141          HH22      ARG 141 -17.703 -20.857  12.807
 1160    H    ASP 142           H        ASP 142 -10.113 -18.435   9.124
 1161    HA   ASP 142           HA       ASP 142  -8.461 -20.425  10.244
 1162    HB2  ASP 142           HB2      ASP 142  -9.461 -20.614   8.027
 1163    HB3  ASP 142           HB3      ASP 142  -8.379 -19.358   7.413
 1164    H    VAL 143           H        VAL 143  -7.625 -17.244   8.772
 1165    HA   VAL 143           HA       VAL 143  -4.836 -17.510   9.302
 1166    HB   VAL 143           HB       VAL 143  -6.667 -15.106   8.916
 1167   HG11  VAL 143          HG11      VAL 143  -4.696 -14.332  10.188
 1168   HG12  VAL 143          HG12      VAL 143  -3.621 -15.118   9.022
 1169   HG13  VAL 143          HG13      VAL 143  -4.648 -13.754   8.525
 1170   HG21  VAL 143          HG21      VAL 143  -4.650 -16.506   7.099
 1171   HG22  VAL 143          HG22      VAL 143  -6.416 -16.611   6.962
 1172   HG23  VAL 143          HG23      VAL 143  -5.609 -15.070   6.682
 1173    H    TYR 144           H        TYR 144  -7.484 -16.005  11.251
 1174    HA   TYR 144           HA       TYR 144  -5.718 -14.984  13.211
 1175    HB2  TYR 144           HB2      TYR 144  -8.694 -15.539  13.178
 1176    HB3  TYR 144           HB3      TYR 144  -7.891 -14.932  14.612
 1177    HD1  TYR 144           HD1      TYR 144  -6.443 -13.605  11.478
 1178    HD2  TYR 144           HD2      TYR 144  -9.531 -13.069  14.457
 1179    HE1  TYR 144           HE1      TYR 144  -6.705 -11.281  10.763
 1180    HE2  TYR 144           HE2      TYR 144  -9.806 -10.736  13.729
 1181    HH   TYR 144           HH       TYR 144  -7.924  -9.237  11.143
 1182    H    ARG 145           H        ARG 145  -7.388 -18.172  13.074
 1183    HA   ARG 145           HA       ARG 145  -6.468 -18.866  15.720
 1184    HB2  ARG 145           HB2      ARG 145  -7.407 -20.939  15.380
 1185    HB3  ARG 145           HB3      ARG 145  -8.372 -19.886  14.331
 1186    HG2  ARG 145           HG2      ARG 145  -6.676 -20.648  12.481
 1187    HG3  ARG 145           HG3      ARG 145  -6.334 -21.936  13.624
 1188    HD2  ARG 145           HD2      ARG 145  -9.082 -22.026  13.598
 1189    HD3  ARG 145           HD3      ARG 145  -8.777 -21.331  11.989
 1190    HE   ARG 145           HE       ARG 145  -6.925 -23.076  11.937
 1191   HH11  ARG 145          HH11      ARG 145 -10.265 -23.880  12.948
 1192   HH12  ARG 145          HH12      ARG 145 -10.040 -25.570  12.655
 1193   HH21  ARG 145          HH21      ARG 145  -6.652 -25.066  11.603
 1194   HH22  ARG 145          HH22      ARG 145  -7.864 -26.295  11.797
 1195    H    ARG 146           H        ARG 146  -5.021 -19.230  12.425
 1196    HA   ARG 146           HA       ARG 146  -2.709 -20.703  13.351
 1197    HB2  ARG 146           HB2      ARG 146  -3.366 -19.073  10.879
 1198    HB3  ARG 146           HB3      ARG 146  -1.673 -19.310  11.295
 1199    HG2  ARG 146           HG2      ARG 146  -2.078 -21.101   9.894
 1200    HG3  ARG 146           HG3      ARG 146  -2.206 -21.815  11.502
 1201    HD2  ARG 146           HD2      ARG 146  -4.764 -21.432  11.263
 1202    HD3  ARG 146           HD3      ARG 146  -4.412 -21.052   9.577
 1203    HE   ARG 146           HE       ARG 146  -3.695 -23.606  10.963
 1204   HH11  ARG 146          HH11      ARG 146  -5.033 -22.105   8.048
 1205   HH12  ARG 146          HH12      ARG 146  -4.831 -23.444   7.056
 1206   HH21  ARG 146          HH21      ARG 146  -3.792 -25.534   9.795
 1207   HH22  ARG 146          HH22      ARG 146  -4.219 -25.515   8.124
 1208    H    VAL 147           H        VAL 147  -3.319 -17.164  13.048
 1209    HA   VAL 147           HA       VAL 147  -0.790 -16.291  13.882
 1210    HB   VAL 147           HB       VAL 147  -3.570 -15.063  14.248
 1211   HG11  VAL 147          HG11      VAL 147  -2.017 -13.941  15.797
 1212   HG12  VAL 147          HG12      VAL 147  -0.873 -13.660  14.467
 1213   HG13  VAL 147          HG13      VAL 147  -2.464 -12.876  14.467
 1214   HG21  VAL 147          HG21      VAL 147  -1.369 -14.557  12.229
 1215   HG22  VAL 147          HG22      VAL 147  -2.865 -15.401  11.880
 1216   HG23  VAL 147          HG23      VAL 147  -2.931 -13.698  12.297
 1217    H    MET 148           H        MET 148  -3.573 -17.376  15.845
 1218    HA   MET 148           HA       MET 148  -2.294 -16.613  18.347
 1219    HB2  MET 148           HB2      MET 148  -4.670 -18.402  17.716
 1220    HB3  MET 148           HB3      MET 148  -4.156 -17.960  19.351
 1221    HG2  MET 148           HG2      MET 148  -4.949 -15.939  17.212
 1222    HG3  MET 148           HG3      MET 148  -6.050 -16.612  18.395
 1223    HE1  MET 148           HE1      MET 148  -2.590 -14.572  18.053
 1224    HE2  MET 148           HE2      MET 148  -4.004 -13.705  17.453
 1225    HE3  MET 148           HE3      MET 148  -3.198 -13.138  18.914
 1226    H    LYS 149           H        LYS 149  -2.892 -19.782  16.709
 1227    HA   LYS 149           HA       LYS 149  -1.572 -21.298  18.724
 1228    HB2  LYS 149           HB2      LYS 149  -3.057 -22.450  17.367
 1229    HB3  LYS 149           HB3      LYS 149  -2.482 -21.736  15.888
 1230    HG2  LYS 149           HG2      LYS 149  -0.975 -23.897  17.421
 1231    HG3  LYS 149           HG3      LYS 149  -2.131 -24.171  16.105
 1232    HD2  LYS 149           HD2      LYS 149  -0.720 -22.534  14.709
 1233    HD3  LYS 149           HD3      LYS 149   0.555 -22.758  15.898
 1234    HE2  LYS 149           HE2      LYS 149  -0.546 -24.813  14.016
 1235    HE3  LYS 149           HE3      LYS 149   1.008 -23.955  13.982
 1236    HZ1  LYS 149           HZ1      LYS 149   1.601 -25.082  16.041
 1237    HZ2  LYS 149           HZ2      LYS 149   0.226 -26.000  15.947
 1238    HZ3  LYS 149           HZ3      LYS 149   1.356 -26.080  14.755
 1239    H    GLU 150           H        GLU 150  -0.221 -19.639  15.893
 1240    HA   GLU 150           HA       GLU 150   2.280 -20.960  15.782
 1241    HB2  GLU 150           HB2      GLU 150   1.066 -19.265  14.190
 1242    HB3  GLU 150           HB3      GLU 150   1.599 -18.120  15.317
 1243    HG2  GLU 150           HG2      GLU 150   2.979 -18.057  13.463
 1244    HG3  GLU 150           HG3      GLU 150   4.003 -18.646  14.722
 1245    H    PHE 151           H        PHE 151   1.064 -18.338  17.861
 1246    HA   PHE 151           HA       PHE 151   3.753 -17.984  19.074
 1247    HB2  PHE 151           HB2      PHE 151   1.424 -16.090  19.323
 1248    HB3  PHE 151           HB3      PHE 151   3.115 -15.753  19.560
 1249    HD1  PHE 151           HD1      PHE 151   4.160 -16.435  16.560
 1250    HD2  PHE 151           HD2      PHE 151   3.456 -14.060  17.915
 1251    HE1  PHE 151           HE1      PHE 151   1.557 -16.072  15.088
 1252    HE2  PHE 151           HE2      PHE 151   3.627 -13.011  15.865
 1253    HZ   PHE 151           HZ       PHE 151   3.259 -14.336  13.912
 1254    H    ALA 152           H        ALA 152   0.653 -19.330  19.696
 1255    HA   ALA 152           HA       ALA 152   0.058 -18.715  22.308
 1256    HB1  ALA 152           HB1      ALA 152  -1.416 -20.032  20.824
 1257    HB2  ALA 152           HB2      ALA 152  -0.276 -21.396  20.874
 1258    HB3  ALA 152           HB3      ALA 152  -1.149 -20.900  22.337
 1259    H    SER 153           H        SER 153   2.285 -21.223  21.116
 1260    HA   SER 153           HA       SER 153   2.835 -22.439  23.603
 1261    HB2  SER 153           HB2      SER 153   4.722 -22.258  21.224
 1262    HB3  SER 153           HB3      SER 153   4.580 -23.572  22.414
 1263    HG   SER 153           HG       SER 153   3.518 -24.061  20.442
 1264    H    VAL 154           H        VAL 154   4.223 -19.544  22.044
 1265    HA   VAL 154           HA       VAL 154   6.418 -19.282  23.933
 1266    HB   VAL 154           HB       VAL 154   5.110 -17.198  22.121
 1267   HG11  VAL 154          HG11      VAL 154   6.397 -16.169  23.945
 1268   HG12  VAL 154          HG12      VAL 154   7.794 -17.187  23.557
 1269   HG13  VAL 154          HG13      VAL 154   7.220 -15.965  22.394
 1270   HG21  VAL 154          HG21      VAL 154   7.558 -18.974  21.686
 1271   HG22  VAL 154          HG22      VAL 154   6.017 -19.073  20.788
 1272   HG23  VAL 154          HG23      VAL 154   7.049 -17.660  20.630
 1273    H    VAL 155           H        VAL 155   3.018 -18.062  23.611
 1274    HA   VAL 155           HA       VAL 155   3.207 -16.253  25.747
 1275    HB   VAL 155           HB       VAL 155   0.687 -17.726  24.899
 1276   HG11  VAL 155          HG11      VAL 155   0.428 -16.582  27.074
 1277   HG12  VAL 155          HG12      VAL 155   1.188 -15.113  26.429
 1278   HG13  VAL 155          HG13      VAL 155  -0.367 -15.605  25.820
 1279   HG21  VAL 155          HG21      VAL 155   1.932 -15.122  23.965
 1280   HG22  VAL 155          HG22      VAL 155   1.703 -16.536  22.979
 1281   HG23  VAL 155          HG23      VAL 155   0.277 -15.670  23.532
 1282    H    MET 156           H        MET 156   2.340 -19.779  25.837
 1283    HA   MET 156           HA       MET 156   1.538 -19.861  28.535
 1284    HB2  MET 156           HB2      MET 156   3.246 -21.945  27.100
 1285    HB3  MET 156           HB3      MET 156   2.261 -22.222  28.534
 1286    HG2  MET 156           HG2      MET 156   1.360 -21.634  25.706
 1287    HG3  MET 156           HG3      MET 156   1.225 -23.149  26.570
 1288    HE1  MET 156           HE1      MET 156  -0.951 -20.380  25.187
 1289    HE2  MET 156           HE2      MET 156  -1.037 -22.128  24.871
 1290    HE3  MET 156           HE3      MET 156  -2.373 -21.301  25.705
 1291    H    SER 157           H        SER 157   4.801 -20.346  27.179
 1292    HA   SER 157           HA       SER 157   6.140 -20.566  29.700
 1293    HB2  SER 157           HB2      SER 157   6.841 -20.254  26.774
 1294    HB3  SER 157           HB3      SER 157   8.129 -20.074  27.986
 1295    HG   SER 157           HG       SER 157   7.813 -22.260  27.234
 1296    H    LEU 158           H        LEU 158   5.295 -17.831  27.602
 1297    HA   LEU 158           HA       LEU 158   6.882 -15.859  28.828
 1298    HB2  LEU 158           HB2      LEU 158   5.788 -15.664  26.596
 1299    HB3  LEU 158           HB3      LEU 158   4.243 -15.611  27.455
 1300    HG   LEU 158           HG       LEU 158   5.054 -13.483  28.623
 1301   HD11  LEU 158          HD11      LEU 158   7.526 -13.923  27.739
 1302   HD12  LEU 158          HD12      LEU 158   6.977 -13.515  26.277
 1303   HD13  LEU 158          HD13      LEU 158   6.830 -12.265  27.562
 1304   HD21  LEU 158          HD21      LEU 158   4.654 -13.551  25.649
 1305   HD22  LEU 158          HD22      LEU 158   3.383 -13.459  26.888
 1306   HD23  LEU 158          HD23      LEU 158   4.544 -12.124  26.679
 1307    H    GLN 159           H        GLN 159   3.681 -17.343  29.698
 1308    HA   GLN 159           HA       GLN 159   3.271 -15.333  31.792
 1309    HB2  GLN 159           HB2      GLN 159   2.183 -18.142  31.703
 1310    HB3  GLN 159           HB3      GLN 159   1.611 -16.759  32.653
 1311    HG2  GLN 159           HG2      GLN 159   1.068 -15.595  30.434
 1312    HG3  GLN 159           HG3      GLN 159   1.463 -17.113  29.650
 1313   HE21  GLN 159          HE22      GLN 159  -0.535 -16.067  32.446
 1314   HE22  GLN 159          HE21      GLN 159  -1.857 -17.176  32.054
 1315    H    GLU 160           H        GLU 160   5.067 -18.402  31.547
 1316    HA   GLU 160           HA       GLU 160   5.149 -18.741  34.444
 1317    HB2  GLU 160           HB2      GLU 160   6.420 -20.171  32.055
 1318    HB3  GLU 160           HB3      GLU 160   6.667 -20.673  33.735
 1319    HG2  GLU 160           HG2      GLU 160   4.119 -20.693  33.981
 1320    HG3  GLU 160           HG3      GLU 160   4.052 -20.555  32.217
 1321    H    ASN 161           H        ASN 161   7.345 -17.593  31.989
 1322    HA   ASN 161           HA       ASN 161   9.748 -17.951  33.657
 1323    HB2  ASN 161           HB2      ASN 161   9.078 -16.709  31.024
 1324    HB3  ASN 161           HB3      ASN 161  10.487 -16.018  31.871
 1325   HD21  ASN 161          HD22      ASN 161   8.812 -18.902  30.867
 1326   HD22  ASN 161          HD21      ASN 161  10.160 -20.021  30.907
 1327    H    THR 162           H        THR 162   7.198 -16.126  33.346
 1328    HA   THR 162           HA       THR 162   6.239 -14.253  33.367
 1329    HB   THR 162           HB       THR 162   5.687 -13.071  35.073
 1330    HG1  THR 162           HG1      THR 162   8.051 -12.771  35.622
 1331   HG21  THR 162          HG21      THR 162   5.566 -15.646  35.267
 1332   HG22  THR 162          HG22      THR 162   6.922 -15.569  36.360
 1333   HG23  THR 162          HG23      THR 162   5.329 -14.870  36.815
 1334    HA   PRO 163           HA       PRO 163  10.464 -13.451  32.231
 1335    HB2  PRO 163           HB2      PRO 163   9.811 -12.695  29.636
 1336    HB3  PRO 163           HB3      PRO 163  10.515 -14.289  30.173
 1337    HG2  PRO 163           HG2      PRO 163   7.693 -13.531  29.567
 1338    HG3  PRO 163           HG3      PRO 163   8.415 -15.233  29.775
 1339    HD2  PRO 163           HD2      PRO 163   6.799 -13.414  31.340
 1340    HD3  PRO 163           HD3      PRO 163   7.143 -15.175  31.596
 1341    H    LYS 164           H        LYS 164  10.753 -11.943  32.739
 1342    HA   LYS 164           HA       LYS 164   9.098 -10.253  33.887
 1343    HB2  LYS 164           HB2      LYS 164  12.085 -10.318  33.375
 1344    HB3  LYS 164           HB3      LYS 164  11.306  -9.473  34.759
 1345    HG2  LYS 164           HG2      LYS 164  11.234 -12.511  34.253
 1346    HG3  LYS 164           HG3      LYS 164  12.344 -11.714  35.299
 1347    HD2  LYS 164           HD2      LYS 164  10.653 -10.911  36.802
 1348    HD3  LYS 164           HD3      LYS 164   9.341 -11.361  35.768
 1349    HE2  LYS 164           HE2      LYS 164  10.109 -13.759  35.725
 1350    HE3  LYS 164           HE3      LYS 164  11.557 -13.326  36.607
 1351    HZ1  LYS 164           HZ1      LYS 164  10.052 -12.609  38.365
 1352    HZ2  LYS 164           HZ2      LYS 164   8.758 -13.150  37.459
 1353    HZ3  LYS 164           HZ3      LYS 164   9.873 -14.244  38.008
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1   0.304   0.537  -0.481
    2    H2   MET   1           H2       MET   1  -1.076  -0.179  -1.000
    3    H3   MET   1           H3       MET   1  -0.068  -0.992   0.002
    4    HA   MET   1           HA       MET   1   0.518  -0.159  -2.769
    5    HB2  MET   1           HB2      MET   1   2.658  -1.058  -2.670
    6    HB3  MET   1           HB3      MET   1   2.540  -0.238  -1.122
    7    HG2  MET   1           HG2      MET   1   2.330  -2.281   0.071
    8    HG3  MET   1           HG3      MET   1   1.988  -3.231  -1.361
    9    HE1  MET   1           HE1      MET   1   3.647  -4.346  -2.928
   10    HE2  MET   1           HE2      MET   1   4.093  -2.736  -3.556
   11    HE3  MET   1           HE3      MET   1   5.354  -3.879  -3.054
   12    H    ILE   2           H        ILE   2   0.841  -2.017  -4.286
   13    HA   ILE   2           HA       ILE   2  -0.219  -4.642  -3.490
   14    HB   ILE   2           HB       ILE   2  -1.120  -3.182  -6.007
   15   HG12  ILE   2          HG12      ILE   2  -2.358  -3.688  -3.339
   16   HG13  ILE   2          HG13      ILE   2  -2.584  -2.349  -4.461
   17   HG21  ILE   2          HG21      ILE   2  -1.756  -6.023  -5.080
   18   HG22  ILE   2          HG22      ILE   2  -2.377  -5.233  -6.544
   19   HG23  ILE   2          HG23      ILE   2  -0.669  -5.610  -6.431
   20   HD11  ILE   2          HD11      ILE   2  -4.108  -3.929  -5.794
   21   HD12  ILE   2          HD12      ILE   2  -3.845  -5.099  -4.447
   22   HD13  ILE   2          HD13      ILE   2  -4.645  -3.540  -4.150
   23    H    ASP   3           H        ASP   3   1.061  -6.295  -4.679
   24    HA   ASP   3           HA       ASP   3   3.714  -5.345  -5.055
   25    HB2  ASP   3           HB2      ASP   3   3.246  -7.470  -3.954
   26    HB3  ASP   3           HB3      ASP   3   2.554  -8.093  -5.465
   27    H    ASP   4           H        ASP   4   1.928  -7.480  -7.254
   28    HA   ASP   4           HA       ASP   4   2.311  -5.805  -9.545
   29    HB2  ASP   4           HB2      ASP   4   4.578  -6.742  -9.459
   30    HB3  ASP   4           HB3      ASP   4   3.908  -8.371  -9.307
   31    H    ASP   5           H        ASP   5   1.839  -9.182  -8.552
   32    HA   ASP   5           HA       ASP   5   0.084  -9.691 -10.780
   33    HB2  ASP   5           HB2      ASP   5   1.907 -11.225 -10.048
   34    HB3  ASP   5           HB3      ASP   5   0.973 -11.586  -8.593
   35    H    GLY   6           H        GLY   6  -0.733  -8.002  -8.363
   36    HA2  GLY   6           HA2      GLY   6  -2.863  -7.416  -7.650
   37    HA3  GLY   6           HA3      GLY   6  -3.497  -8.978  -8.171
   38    H    TYR   7           H        TYR   7  -0.753  -9.625  -6.332
   39    HA   TYR   7           HA       TYR   7  -2.313  -9.871  -3.816
   40    HB2  TYR   7           HB2      TYR   7   0.347 -11.159  -4.520
   41    HB3  TYR   7           HB3      TYR   7  -0.574 -11.376  -3.032
   42    HD1  TYR   7           HD1      TYR   7  -2.795 -12.521  -3.060
   43    HD2  TYR   7           HD2      TYR   7  -0.233 -12.409  -6.526
   44    HE1  TYR   7           HE1      TYR   7  -4.128 -14.332  -4.103
   45    HE2  TYR   7           HE2      TYR   7  -1.525 -14.239  -7.559
   46    HH   TYR   7           HH       TYR   7  -3.367 -15.688  -7.347
   47    H    ARG   8           H        ARG   8  -1.026  -9.265  -1.805
   48    HA   ARG   8           HA       ARG   8   0.841  -7.032  -2.258
   49    HB2  ARG   8           HB2      ARG   8  -0.598  -5.394  -1.124
   50    HB3  ARG   8           HB3      ARG   8  -1.428  -6.079  -2.540
   51    HG2  ARG   8           HG2      ARG   8  -2.604  -7.673  -0.979
   52    HG3  ARG   8           HG3      ARG   8  -1.992  -6.711   0.378
   53    HD2  ARG   8           HD2      ARG   8  -3.450  -5.486  -1.981
   54    HD3  ARG   8           HD3      ARG   8  -4.330  -6.213  -0.626
   55    HE   ARG   8           HE       ARG   8  -2.534  -3.808  -0.557
   56   HH11  ARG   8          HH12      ARG   8  -4.908  -5.836   1.178
   57   HH12  ARG   8          HH11      ARG   8  -5.358  -4.597   2.291
   58   HH21  ARG   8          HH21      ARG   8  -3.149  -2.165   0.963
   59   HH22  ARG   8          HH22      ARG   8  -4.303  -2.498   2.200
   60    HA   PRO   9           HA       PRO   9   2.132  -8.791   1.615
   61    HB2  PRO   9           HB2      PRO   9   4.367  -7.400   2.118
   62    HB3  PRO   9           HB3      PRO   9   4.193  -8.352   0.622
   63    HG2  PRO   9           HG2      PRO   9   3.779  -5.355   0.962
   64    HG3  PRO   9           HG3      PRO   9   4.743  -6.212  -0.275
   65    HD2  PRO   9           HD2      PRO   9   2.130  -5.392  -0.638
   66    HD3  PRO   9           HD3      PRO   9   2.868  -6.787  -1.475
   67    H    ASN  10           H        ASN  10   1.435  -8.664   3.698
   68    HA   ASN  10           HA       ASN  10   0.869  -6.008   4.945
   69    HB2  ASN  10           HB2      ASN  10  -0.860  -8.486   4.695
   70    HB3  ASN  10           HB3      ASN  10  -1.041  -7.394   6.068
   71   HD21  ASN  10          HD22      ASN  10  -1.635  -5.134   5.685
   72   HD22  ASN  10          HD21      ASN  10  -2.555  -4.740   4.239
   73    H    VAL  11           H        VAL  11   0.850  -6.116   7.338
   74    HA   VAL  11           HA       VAL  11   2.091  -8.479   8.502
   75    HB   VAL  11           HB       VAL  11   3.651  -7.188   9.902
   76   HG11  VAL  11          HG11      VAL  11   4.792  -8.305   8.429
   77   HG12  VAL  11          HG12      VAL  11   4.148  -7.445   7.036
   78   HG13  VAL  11          HG13      VAL  11   5.364  -6.672   8.094
   79   HG21  VAL  11          HG21      VAL  11   3.162  -4.872   7.964
   80   HG22  VAL  11          HG22      VAL  11   2.645  -4.911   9.670
   81   HG23  VAL  11          HG23      VAL  11   4.362  -4.943   9.263
   82    H    GLY  12           H        GLY  12   1.765  -8.418  10.970
   83    HA2  GLY  12           HA2      GLY  12  -0.072  -6.353  11.903
   84    HA3  GLY  12           HA3      GLY  12  -0.795  -7.957  11.806
   85    H    ILE  13           H        ILE  13  -0.699  -6.610  14.188
   86    HA   ILE  13           HA       ILE  13   1.606  -7.725  15.700
   87    HB   ILE  13           HB       ILE  13   0.089  -5.091  16.007
   88   HG12  ILE  13          HG12      ILE  13   2.787  -4.494  15.817
   89   HG13  ILE  13          HG13      ILE  13   2.655  -5.882  14.744
   90   HG21  ILE  13          HG21      ILE  13   1.662  -4.634  17.827
   91   HG22  ILE  13          HG22      ILE  13   0.613  -5.989  18.191
   92   HG23  ILE  13          HG23      ILE  13   2.303  -6.294  17.696
   93   HD11  ILE  13          HD11      ILE  13   0.846  -4.671  13.476
   94   HD12  ILE  13          HD12      ILE  13   1.031  -3.301  14.586
   95   HD13  ILE  13          HD13      ILE  13   2.371  -3.767  13.516
   96    H    VAL  14           H        VAL  14   1.165  -8.833  17.489
   97    HA   VAL  14           HA       VAL  14  -1.589  -8.800  18.646
   98    HB   VAL  14           HB       VAL  14   0.377 -11.138  18.552
   99   HG11  VAL  14          HG11      VAL  14  -2.541 -11.085  19.431
  100   HG12  VAL  14          HG12      VAL  14  -1.425 -12.476  19.478
  101   HG13  VAL  14          HG13      VAL  14  -1.149 -11.099  20.539
  102   HG21  VAL  14          HG21      VAL  14  -2.116 -10.695  16.871
  103   HG22  VAL  14          HG22      VAL  14  -0.435 -10.852  16.292
  104   HG23  VAL  14          HG23      VAL  14  -1.245 -12.238  17.033
  105    H    ILE  15           H        ILE  15  -1.463  -8.330  20.936
  106    HA   ILE  15           HA       ILE  15   1.290  -8.329  22.040
  107    HB   ILE  15           HB       ILE  15  -0.865  -6.559  23.196
  108   HG12  ILE  15          HG12      ILE  15  -0.437  -5.724  20.902
  109   HG13  ILE  15          HG13      ILE  15   0.130  -4.632  22.161
  110   HG21  ILE  15          HG21      ILE  15   1.094  -5.476  24.240
  111   HG22  ILE  15          HG22      ILE  15   0.972  -7.161  24.715
  112   HG23  ILE  15          HG23      ILE  15   2.170  -6.682  23.503
  113   HD11  ILE  15          HD11      ILE  15   2.447  -5.295  21.799
  114   HD12  ILE  15          HD12      ILE  15   1.946  -6.555  20.637
  115   HD13  ILE  15          HD13      ILE  15   1.720  -4.832  20.257
  116    H    CYS  16           H        CYS  16   1.572  -9.376  24.061
  117    HA   CYS  16           HA       CYS  16  -0.867 -10.658  25.203
  118    HB2  CYS  16           HB2      CYS  16   0.498 -12.578  25.952
  119    HB3  CYS  16           HB3      CYS  16   0.411 -12.454  24.188
  120    HG   CYS  16           HG       CYS  16   2.733 -11.063  23.973
  121    H    ASN  17           H        ASN  17  -0.957 -10.840  27.463
  122    HA   ASN  17           HA       ASN  17   1.034  -9.203  28.971
  123    HB2  ASN  17           HB2      ASN  17  -0.635  -8.577  30.530
  124    HB3  ASN  17           HB3      ASN  17  -1.260  -8.235  28.929
  125   HD21  ASN  17          HD22      ASN  17  -3.258  -8.149  30.527
  126   HD22  ASN  17          HD21      ASN  17  -4.155  -9.644  30.675
  127    H    ARG  18           H        ARG  18   1.222 -10.185  31.398
  128    HA   ARG  18           HA       ARG  18   1.908 -12.998  30.961
  129    HB2  ARG  18           HB2      ARG  18   2.265 -11.185  33.383
  130    HB3  ARG  18           HB3      ARG  18   2.683 -12.901  33.374
  131    HG2  ARG  18           HG2      ARG  18   4.678 -12.337  32.636
  132    HG3  ARG  18           HG3      ARG  18   3.909 -12.161  31.073
  133    HD2  ARG  18           HD2      ARG  18   5.322 -10.246  31.468
  134    HD3  ARG  18           HD3      ARG  18   3.621  -9.724  31.509
  135    HE   ARG  18           HE       ARG  18   4.328 -10.342  34.164
  136   HH11  ARG  18          HH21      ARG  18   5.340  -7.918  31.744
  137   HH12  ARG  18          HH22      ARG  18   5.790  -6.748  32.928
  138   HH21  ARG  18          HH11      ARG  18   4.931  -8.773  35.714
  139   HH22  ARG  18          HH12      ARG  18   5.546  -7.241  35.220
  140    H    GLN  19           H        GLN  19  -1.012 -11.788  31.427
  141    HA   GLN  19           HA       GLN  19  -1.988 -13.963  33.142
  142    HB2  GLN  19           HB2      GLN  19  -3.749 -11.994  31.696
  143    HB3  GLN  19           HB3      GLN  19  -4.114 -12.949  33.123
  144    HG2  GLN  19           HG2      GLN  19  -2.292 -10.534  32.916
  145    HG3  GLN  19           HG3      GLN  19  -3.855 -10.601  33.698
  146   HE21  GLN  19          HE22      GLN  19  -1.249  -9.794  34.919
  147   HE22  GLN  19          HE21      GLN  19  -0.991 -10.890  36.247
  148    H    GLY  20           H        GLY  20  -1.044 -13.560  29.909
  149    HA2  GLY  20           HA2      GLY  20  -1.216 -15.025  28.171
  150    HA3  GLY  20           HA3      GLY  20  -2.390 -16.012  29.058
  151    H    GLN  21           H        GLN  21  -3.074 -12.543  28.886
  152    HA   GLN  21           HA       GLN  21  -5.369 -13.131  27.093
  153    HB2  GLN  21           HB2      GLN  21  -4.587 -10.531  28.459
  154    HB3  GLN  21           HB3      GLN  21  -6.053 -10.819  27.528
  155    HG2  GLN  21           HG2      GLN  21  -6.809 -12.508  29.178
  156    HG3  GLN  21           HG3      GLN  21  -5.325 -12.281  30.102
  157   HE21  GLN  21          HE22      GLN  21  -8.504 -10.865  29.388
  158   HE22  GLN  21          HE21      GLN  21  -8.353  -9.545  30.521
  159    H    VAL  22           H        VAL  22  -5.566 -12.101  25.077
  160    HA   VAL  22           HA       VAL  22  -3.104 -10.912  23.967
  161    HB   VAL  22           HB       VAL  22  -3.858 -11.489  21.761
  162   HG11  VAL  22          HG11      VAL  22  -2.480 -13.088  23.052
  163   HG12  VAL  22          HG12      VAL  22  -3.949 -13.924  23.589
  164   HG13  VAL  22          HG13      VAL  22  -3.507 -13.895  21.862
  165   HG21  VAL  22          HG21      VAL  22  -6.308 -12.783  23.056
  166   HG22  VAL  22          HG22      VAL  22  -6.280 -11.403  21.935
  167   HG23  VAL  22          HG23      VAL  22  -5.794 -13.005  21.369
  168    H    MET  23           H        MET  23  -3.305  -8.976  22.820
  169    HA   MET  23           HA       MET  23  -5.543  -7.239  23.616
  170    HB2  MET  23           HB2      MET  23  -3.183  -6.580  23.762
  171    HB3  MET  23           HB3      MET  23  -2.996  -6.733  22.017
  172    HG2  MET  23           HG2      MET  23  -5.126  -4.899  23.121
  173    HG3  MET  23           HG3      MET  23  -3.431  -4.430  23.218
  174    HE1  MET  23           HE1      MET  23  -3.460  -2.272  20.282
  175    HE2  MET  23           HE2      MET  23  -4.279  -2.254  21.865
  176    HE3  MET  23           HE3      MET  23  -2.591  -2.823  21.744
  177    H    TRP  24           H        TRP  24  -7.071  -6.342  22.176
  178    HA   TRP  24           HA       TRP  24  -7.265  -7.457  19.428
  179    HB2  TRP  24           HB2      TRP  24  -8.203  -9.033  21.053
  180    HB3  TRP  24           HB3      TRP  24  -9.199  -7.765  21.749
  181    HD1  TRP  24           HD1      TRP  24 -11.585  -8.172  21.181
  182    HE1  TRP  24           HE1      TRP  24 -12.947  -9.218  19.308
  183    HE3  TRP  24           HE3      TRP  24  -7.757  -9.360  18.017
  184    HZ2  TRP  24           HZ2      TRP  24 -12.420 -10.620  16.835
  185    HZ3  TRP  24           HZ3      TRP  24  -8.204 -10.677  15.975
  186    HH2  TRP  24           HH2      TRP  24 -10.550 -11.314  15.373
  187    H    ALA  25           H        ALA  25  -8.716  -6.044  18.064
  188    HA   ALA  25           HA       ALA  25  -9.850  -3.655  19.342
  189    HB1  ALA  25           HB1      ALA  25  -7.544  -3.457  17.353
  190    HB2  ALA  25           HB2      ALA  25  -8.443  -2.089  18.067
  191    HB3  ALA  25           HB3      ALA  25  -7.424  -3.102  19.084
  192    H    ARG  26           H        ARG  26 -10.916  -2.194  17.664
  193    HA   ARG  26           HA       ARG  26 -11.710  -3.686  15.222
  194    HB2  ARG  26           HB2      ARG  26 -14.022  -2.837  15.387
  195    HB3  ARG  26           HB3      ARG  26 -13.600  -4.067  16.578
  196    HG2  ARG  26           HG2      ARG  26 -13.405  -2.365  18.320
  197    HG3  ARG  26           HG3      ARG  26 -13.771  -1.085  17.133
  198    HD2  ARG  26           HD2      ARG  26 -15.962  -2.217  16.666
  199    HD3  ARG  26           HD3      ARG  26 -15.589  -3.419  17.884
  200    HE   ARG  26           HE       ARG  26 -16.071  -1.941  19.575
  201   HH11  ARG  26          HH21      ARG  26 -16.150  -0.177  16.452
  202   HH12  ARG  26          HH22      ARG  26 -16.585   1.333  17.201
  203   HH21  ARG  26          HH11      ARG  26 -16.864   0.049  20.480
  204   HH22  ARG  26          HH12      ARG  26 -17.080   1.428  19.464
  205    H    ARG  27           H        ARG  27 -11.857  -2.428  13.357
  206    HA   ARG  27           HA       ARG  27 -10.006  -0.243  13.463
  207    HB2  ARG  27           HB2      ARG  27 -10.246  -1.958  11.628
  208    HB3  ARG  27           HB3      ARG  27 -11.776  -1.237  11.198
  209    HG2  ARG  27           HG2      ARG  27 -10.642  -0.105   9.661
  210    HG3  ARG  27           HG3      ARG  27 -10.092   0.960  10.934
  211    HD2  ARG  27           HD2      ARG  27  -8.627  -1.519   9.936
  212    HD3  ARG  27           HD3      ARG  27  -8.287   0.143   9.426
  213    HE   ARG  27           HE       ARG  27  -8.027   0.342  12.124
  214   HH11  ARG  27          HH11      ARG  27  -6.364  -1.574   9.599
  215   HH12  ARG  27          HH12      ARG  27  -4.937  -1.818  10.559
  216   HH21  ARG  27          HH21      ARG  27  -6.234  -0.225  13.444
  217   HH22  ARG  27          HH22      ARG  27  -4.890  -1.092  12.768
  218    H    PHE  28           H        PHE  28 -10.369   1.968  12.710
  219    HA   PHE  28           HA       PHE  28 -12.437   3.194  14.136
  220    HB2  PHE  28           HB2      PHE  28 -10.342   4.250  13.564
  221    HB3  PHE  28           HB3      PHE  28 -10.765   4.264  11.854
  222    HD1  PHE  28           HD1      PHE  28 -12.232   5.403  15.168
  223    HD2  PHE  28           HD2      PHE  28 -11.456   6.340  11.023
  224    HE1  PHE  28           HE1      PHE  28 -13.226   7.652  15.482
  225    HE2  PHE  28           HE2      PHE  28 -12.407   8.598  11.357
  226    HZ   PHE  28           HZ       PHE  28 -13.315   9.258  13.583
  227    H    GLY  29           H        GLY  29 -14.532   3.614  13.716
  228    HA2  GLY  29           HA2      GLY  29 -16.470   4.038  12.550
  229    HA3  GLY  29           HA3      GLY  29 -15.623   3.787  11.017
  230    H    GLN  30           H        GLN  30 -14.902   1.070  12.954
  231    HA   GLN  30           HA       GLN  30 -17.038  -0.472  11.565
  232    HB2  GLN  30           HB2      GLN  30 -14.296  -1.433  12.464
  233    HB3  GLN  30           HB3      GLN  30 -15.480  -2.329  11.530
  234    HG2  GLN  30           HG2      GLN  30 -13.959   0.140  10.626
  235    HG3  GLN  30           HG3      GLN  30 -13.695  -1.533  10.118
  236   HE21  GLN  30          HE22      GLN  30 -15.828  -2.647   9.164
  237   HE22  GLN  30          HE21      GLN  30 -16.702  -1.657   8.023
  238    H    HIS  31           H        HIS  31 -18.050  -2.131  12.579
  239    HA   HIS  31           HA       HIS  31 -17.861  -2.299  15.544
  240    HB2  HIS  31           HB2      HIS  31 -19.886  -3.506  13.633
  241    HB3  HIS  31           HB3      HIS  31 -19.950  -3.545  15.395
  242    HD1  HIS  31           HD1      HIS  31 -21.648  -1.751  12.830
  243    HD2  HIS  31           HD2      HIS  31 -19.562  -0.634  16.321
  244    HE1  HIS  31           HE1      HIS  31 -22.471   0.577  13.451
  245    H    SER  32           H        SER  32 -16.722  -3.928  12.681
  246    HA   SER  32           HA       SER  32 -16.610  -6.576  13.850
  247    HB2  SER  32           HB2      SER  32 -15.303  -6.889  11.585
  248    HB3  SER  32           HB3      SER  32 -17.059  -6.674  11.605
  249    HG   SER  32           HG       SER  32 -16.098  -5.333  10.033
  250    H    TRP  33           H        TRP  33 -14.834  -7.549  14.727
  251    HA   TRP  33           HA       TRP  33 -12.611  -5.763  15.492
  252    HB2  TRP  33           HB2      TRP  33 -13.428  -8.484  16.526
  253    HB3  TRP  33           HB3      TRP  33 -12.118  -7.455  17.124
  254    HD1  TRP  33           HD1      TRP  33 -15.983  -7.403  16.897
  255    HE1  TRP  33           HE1      TRP  33 -16.912  -6.013  18.809
  256    HE3  TRP  33           HE3      TRP  33 -11.576  -5.862  18.968
  257    HZ2  TRP  33           HZ2      TRP  33 -15.874  -4.275  20.904
  258    HZ3  TRP  33           HZ3      TRP  33 -11.569  -4.229  20.839
  259    HH2  TRP  33           HH2      TRP  33 -13.711  -3.415  21.803
  260    H    GLN  34           H        GLN  34 -10.410  -6.479  15.426
  261    HA   GLN  34           HA       GLN  34  -9.643  -8.569  13.512
  262    HB2  GLN  34           HB2      GLN  34  -8.924  -5.619  13.124
  263    HB3  GLN  34           HB3      GLN  34  -8.243  -6.979  12.231
  264    HG2  GLN  34           HG2      GLN  34 -10.530  -7.455  11.301
  265    HG3  GLN  34           HG3      GLN  34 -11.120  -5.999  12.116
  266   HE21  GLN  34          HE22      GLN  34 -11.733  -5.182   9.940
  267   HE22  GLN  34          HE21      GLN  34 -10.494  -4.517   8.900
  268    H    PHE  35           H        PHE  35  -7.274  -8.911  13.620
  269    HA   PHE  35           HA       PHE  35  -6.072  -8.073  16.193
  270    HB2  PHE  35           HB2      PHE  35  -5.114  -9.794  13.888
  271    HB3  PHE  35           HB3      PHE  35  -4.011  -9.223  15.142
  272    HD1  PHE  35           HD1      PHE  35  -5.225  -9.581  17.672
  273    HD2  PHE  35           HD2      PHE  35  -5.541 -12.089  14.160
  274    HE1  PHE  35           HE1      PHE  35  -5.915 -11.486  19.091
  275    HE2  PHE  35           HE2      PHE  35  -6.146 -14.003  15.617
  276    HZ   PHE  35           HZ       PHE  35  -6.421 -13.694  18.059
  277    HA   PRO  36           HA       PRO  36  -4.706  -4.197  14.377
  278    HB2  PRO  36           HB2      PRO  36  -2.138  -4.941  15.825
  279    HB3  PRO  36           HB3      PRO  36  -2.887  -3.323  15.706
  280    HG2  PRO  36           HG2      PRO  36  -3.259  -4.813  17.924
  281    HG3  PRO  36           HG3      PRO  36  -4.671  -3.989  17.187
  282    HD2  PRO  36           HD2      PRO  36  -3.882  -6.898  17.008
  283    HD3  PRO  36           HD3      PRO  36  -5.503  -6.165  17.140
  284    H    GLN  37           H        GLN  37  -3.709  -3.678  12.375
  285    HA   GLN  37           HA       GLN  37  -1.568  -5.184  11.358
  286    HB2  GLN  37           HB2      GLN  37  -2.595  -6.312   9.472
  287    HB3  GLN  37           HB3      GLN  37  -3.262  -6.952  10.972
  288    HG2  GLN  37           HG2      GLN  37  -5.283  -5.532  10.632
  289    HG3  GLN  37           HG3      GLN  37  -4.582  -4.938   9.115
  290   HE21  GLN  37          HE22      GLN  37  -7.168  -6.379   9.427
  291   HE22  GLN  37          HE21      GLN  37  -6.995  -7.800   8.418
  292    H    GLY  38           H        GLY  38  -0.916  -4.636   9.229
  293    HA2  GLY  38           HA2      GLY  38  -1.945  -2.206   7.979
  294    HA3  GLY  38           HA3      GLY  38  -0.406  -2.048   8.844
  295    H    GLY  39           H        GLY  39   0.378  -1.555   6.554
  296    HA2  GLY  39           HA2      GLY  39   0.630  -3.936   4.789
  297    HA3  GLY  39           HA3      GLY  39   0.484  -2.272   4.248
  298    H    ILE  40           H        ILE  40   2.593  -4.282   3.858
  299    HA   ILE  40           HA       ILE  40   5.019  -3.037   5.051
  300    HB   ILE  40           HB       ILE  40   4.588  -5.296   3.061
  301   HG12  ILE  40          HG12      ILE  40   5.974  -5.516   5.737
  302   HG13  ILE  40          HG13      ILE  40   4.226  -5.659   5.640
  303   HG21  ILE  40          HG21      ILE  40   7.087  -5.695   3.232
  304   HG22  ILE  40          HG22      ILE  40   6.658  -4.209   2.417
  305   HG23  ILE  40          HG23      ILE  40   7.214  -4.170   4.112
  306   HD11  ILE  40          HD11      ILE  40   5.984  -7.407   3.863
  307   HD12  ILE  40          HD12      ILE  40   5.689  -7.818   5.543
  308   HD13  ILE  40          HD13      ILE  40   4.313  -7.651   4.421
  309    H    ASN  41           H        ASN  41   6.129  -1.419   3.948
  310    HA   ASN  41           HA       ASN  41   4.916  -0.318   1.492
  311    HB2  ASN  41           HB2      ASN  41   7.258   0.553   3.248
  312    HB3  ASN  41           HB3      ASN  41   6.857   1.353   1.742
  313   HD21  ASN  41          HD22      ASN  41   5.547   0.496   4.941
  314   HD22  ASN  41          HD21      ASN  41   4.252   1.703   4.936
  315    HA   PRO  42           HA       PRO  42   7.536  -2.499  -1.271
  316    HB2  PRO  42           HB2      PRO  42   8.397  -0.655  -3.143
  317    HB3  PRO  42           HB3      PRO  42   6.759  -1.371  -3.096
  318    HG2  PRO  42           HG2      PRO  42   7.658   1.295  -1.968
  319    HG3  PRO  42           HG3      PRO  42   6.208   0.943  -2.962
  320    HD2  PRO  42           HD2      PRO  42   6.047   1.157  -0.271
  321    HD3  PRO  42           HD3      PRO  42   5.100  -0.084  -1.138
  322    H    GLY  43           H        GLY  43   9.503  -3.237  -0.617
  323    HA2  GLY  43           HA2      GLY  43  11.809  -3.219  -0.359
  324    HA3  GLY  43           HA3      GLY  43  11.827  -1.454  -0.376
  325    H    GLU  44           H        GLU  44   9.429  -2.221   1.913
  326    HA   GLU  44           HA       GLU  44  11.225  -1.865   4.154
  327    HB2  GLU  44           HB2      GLU  44   8.343  -1.811   3.729
  328    HB3  GLU  44           HB3      GLU  44   8.729  -2.890   5.074
  329    HG2  GLU  44           HG2      GLU  44   9.916  -1.189   6.243
  330    HG3  GLU  44           HG3      GLU  44   9.743  -0.062   4.875
  331    H    SER  45           H        SER  45  11.473  -3.413   5.875
  332    HA   SER  45           HA       SER  45  11.348  -6.274   5.059
  333    HB2  SER  45           HB2      SER  45  12.675  -4.991   7.485
  334    HB3  SER  45           HB3      SER  45  12.808  -6.677   6.962
  335    HG   SER  45           HG       SER  45  14.621  -5.422   6.285
  336    H    ALA  46           H        ALA  46  10.129  -7.730   6.507
  337    HA   ALA  46           HA       ALA  46   7.596  -6.720   7.083
  338    HB1  ALA  46           HB1      ALA  46   8.953  -9.190   8.259
  339    HB2  ALA  46           HB2      ALA  46   7.197  -8.897   8.181
  340    HB3  ALA  46           HB3      ALA  46   8.112  -9.102   6.677
  341    H    GLU  47           H        GLU  47  10.322  -7.216   9.315
  342    HA   GLU  47           HA       GLU  47   8.912  -6.593  11.721
  343    HB2  GLU  47           HB2      GLU  47  11.037  -7.877  11.416
  344    HB3  GLU  47           HB3      GLU  47  11.872  -6.368  11.029
  345    HG2  GLU  47           HG2      GLU  47  11.220  -5.492  13.295
  346    HG3  GLU  47           HG3      GLU  47  10.476  -7.050  13.648
  347    H    GLN  48           H        GLN  48  10.606  -4.584   9.299
  348    HA   GLN  48           HA       GLN  48  10.579  -2.174  10.881
  349    HB2  GLN  48           HB2      GLN  48  10.884  -2.582   7.896
  350    HB3  GLN  48           HB3      GLN  48  11.033  -1.024   8.705
  351    HG2  GLN  48           HG2      GLN  48  12.664  -3.488   9.394
  352    HG3  GLN  48           HG3      GLN  48  13.234  -2.209   8.316
  353   HE21  GLN  48          HE22      GLN  48  14.186  -3.304  11.011
  354   HE22  GLN  48          HE21      GLN  48  14.365  -1.883  12.016
  355    H    ALA  49           H        ALA  49   8.387  -3.658   8.381
  356    HA   ALA  49           HA       ALA  49   6.532  -1.485   8.312
  357    HB1  ALA  49           HB1      ALA  49   6.684  -3.279   6.613
  358    HB2  ALA  49           HB2      ALA  49   6.127  -4.469   7.828
  359    HB3  ALA  49           HB3      ALA  49   5.045  -3.161   7.320
  360    H    MET  50           H        MET  50   6.874  -4.429  10.387
  361    HA   MET  50           HA       MET  50   4.432  -4.113  11.758
  362    HB2  MET  50           HB2      MET  50   5.604  -6.163  11.978
  363    HB3  MET  50           HB3      MET  50   7.060  -5.401  12.596
  364    HG2  MET  50           HG2      MET  50   4.426  -5.147  14.003
  365    HG3  MET  50           HG3      MET  50   5.412  -6.585  14.214
  366    HE1  MET  50           HE1      MET  50   8.504  -5.385  16.138
  367    HE2  MET  50           HE2      MET  50   7.793  -6.627  15.090
  368    HE3  MET  50           HE3      MET  50   8.493  -5.146  14.381
  369    H    TYR  51           H        TYR  51   7.730  -2.806  12.664
  370    HA   TYR  51           HA       TYR  51   6.620  -1.432  14.880
  371    HB2  TYR  51           HB2      TYR  51   9.173  -0.862  13.351
  372    HB3  TYR  51           HB3      TYR  51   8.710  -0.096  14.874
  373    HD1  TYR  51           HD2      TYR  51   7.924  -1.865  16.784
  374    HD2  TYR  51           HD1      TYR  51  10.789  -2.537  13.633
  375    HE1  TYR  51           HE2      TYR  51   9.236  -3.304  18.293
  376    HE2  TYR  51           HE1      TYR  51  12.086  -4.011  15.117
  377    HH   TYR  51           HH       TYR  51  11.194  -4.627  18.551
  378    H    ARG  52           H        ARG  52   6.988  -0.255  11.399
  379    HA   ARG  52           HA       ARG  52   6.256   2.430  12.062
  380    HB2  ARG  52           HB2      ARG  52   7.249   1.770   9.911
  381    HB3  ARG  52           HB3      ARG  52   5.876   0.705   9.587
  382    HG2  ARG  52           HG2      ARG  52   4.378   2.800   9.644
  383    HG3  ARG  52           HG3      ARG  52   5.867   3.763   9.662
  384    HD2  ARG  52           HD2      ARG  52   5.229   1.574   7.658
  385    HD3  ARG  52           HD3      ARG  52   4.789   3.269   7.362
  386    HE   ARG  52           HE       ARG  52   7.404   1.971   7.248
  387   HH11  ARG  52          HH11      ARG  52   5.803   5.169   7.351
  388   HH12  ARG  52          HH12      ARG  52   7.164   6.014   6.718
  389   HH21  ARG  52          HH21      ARG  52   9.197   3.107   6.458
  390   HH22  ARG  52          HH22      ARG  52   9.145   4.818   6.193
  391    H    GLU  53           H        GLU  53   4.286  -0.447  11.031
  392    HA   GLU  53           HA       GLU  53   1.931   1.116  10.990
  393    HB2  GLU  53           HB2      GLU  53   2.264  -1.883  10.971
  394    HB3  GLU  53           HB3      GLU  53   0.732  -1.039  10.703
  395    HG2  GLU  53           HG2      GLU  53   3.218  -0.493   9.042
  396    HG3  GLU  53           HG3      GLU  53   2.028  -1.717   8.608
  397    H    LEU  54           H        LEU  54   3.440  -0.905  13.503
  398    HA   LEU  54           HA       LEU  54   1.458  -0.887  15.488
  399    HB2  LEU  54           HB2      LEU  54   3.570  -2.125  15.684
  400    HB3  LEU  54           HB3      LEU  54   4.483  -0.612  15.658
  401    HG   LEU  54           HG       LEU  54   3.060  -0.069  17.840
  402   HD11  LEU  54          HD11      LEU  54   2.325  -1.968  19.057
  403   HD12  LEU  54          HD12      LEU  54   1.754  -2.270  17.401
  404   HD13  LEU  54          HD13      LEU  54   3.213  -3.083  17.992
  405   HD21  LEU  54          HD21      LEU  54   4.839  -1.121  19.207
  406   HD22  LEU  54          HD22      LEU  54   5.378  -2.050  17.783
  407   HD23  LEU  54          HD23      LEU  54   5.502  -0.275  17.798
  408    H    PHE  55           H        PHE  55   3.972   1.642  14.741
  409    HA   PHE  55           HA       PHE  55   3.005   3.423  16.784
  410    HB2  PHE  55           HB2      PHE  55   5.287   3.501  15.780
  411    HB3  PHE  55           HB3      PHE  55   4.583   4.073  14.270
  412    HD1  PHE  55           HD2      PHE  55   4.879   4.870  17.918
  413    HD2  PHE  55           HD1      PHE  55   4.120   6.420  13.963
  414    HE1  PHE  55           HE2      PHE  55   4.963   7.187  18.809
  415    HE2  PHE  55           HE1      PHE  55   4.208   8.735  14.860
  416    HZ   PHE  55           HZ       PHE  55   4.641   9.122  17.282
  417    H    GLU  56           H        GLU  56   2.163   3.014  13.312
  418    HA   GLU  56           HA       GLU  56   0.596   5.342  13.206
  419    HB2  GLU  56           HB2      GLU  56   0.655   2.831  11.523
  420    HB3  GLU  56           HB3      GLU  56  -0.418   4.180  11.161
  421    HG2  GLU  56           HG2      GLU  56   2.583   4.532  11.491
  422    HG3  GLU  56           HG3      GLU  56   1.835   4.157   9.943
  423    H    GLU  57           H        GLU  57  -0.276   1.982  14.191
  424    HA   GLU  57           HA       GLU  57  -3.098   2.868  14.371
  425    HB2  GLU  57           HB2      GLU  57  -3.778   0.712  13.942
  426    HB3  GLU  57           HB3      GLU  57  -2.446   0.994  12.834
  427    HG2  GLU  57           HG2      GLU  57  -0.973  -0.312  14.535
  428    HG3  GLU  57           HG3      GLU  57  -2.464  -0.744  15.335
  429    H    VAL  58           H        VAL  58  -0.604   1.352  16.392
  430    HA   VAL  58           HA       VAL  58  -2.514   1.111  18.643
  431    HB   VAL  58           HB       VAL  58   0.473   0.457  18.561
  432   HG11  VAL  58          HG11      VAL  58  -0.068  -1.119  20.333
  433   HG12  VAL  58          HG12      VAL  58  -0.534   0.536  20.778
  434   HG13  VAL  58          HG13      VAL  58  -1.779  -0.637  20.267
  435   HG21  VAL  58          HG21      VAL  58  -0.306  -1.923  18.091
  436   HG22  VAL  58          HG22      VAL  58  -1.866  -1.229  17.615
  437   HG23  VAL  58          HG23      VAL  58  -0.371  -0.773  16.742
  438    H    GLY  59           H        GLY  59   0.212   2.976  17.478
  439    HA2  GLY  59           HA2      GLY  59   0.841   5.154  18.053
  440    HA3  GLY  59           HA3      GLY  59  -0.152   5.100  19.513
  441    H    LEU  60           H        LEU  60   1.535   2.227  19.334
  442    HA   LEU  60           HA       LEU  60   3.366   2.952  21.462
  443    HB2  LEU  60           HB2      LEU  60   1.710   1.042  21.356
  444    HB3  LEU  60           HB3      LEU  60   2.666   0.342  20.052
  445    HG   LEU  60           HG       LEU  60   4.566   0.028  21.643
  446   HD11  LEU  60          HD11      LEU  60   4.058   1.848  23.249
  447   HD12  LEU  60          HD12      LEU  60   2.536   1.034  23.683
  448   HD13  LEU  60          HD13      LEU  60   4.103   0.270  24.046
  449   HD21  LEU  60          HD21      LEU  60   3.295  -1.742  22.949
  450   HD22  LEU  60          HD22      LEU  60   1.767  -1.000  22.427
  451   HD23  LEU  60          HD23      LEU  60   2.857  -1.734  21.235
  452    H    SER  61           H        SER  61   5.672   2.397  21.333
  453    HA   SER  61           HA       SER  61   6.800   2.342  18.573
  454    HB2  SER  61           HB2      SER  61   8.479   4.003  19.479
  455    HB3  SER  61           HB3      SER  61   6.827   4.610  19.314
  456    HG   SER  61           HG       SER  61   7.726   5.198  21.346
  457    H    ARG  62           H        ARG  62   9.155   1.785  18.599
  458    HA   ARG  62           HA       ARG  62   9.598  -0.812  19.203
  459    HB2  ARG  62           HB2      ARG  62  11.629   1.454  19.021
  460    HB3  ARG  62           HB3      ARG  62  12.078  -0.239  19.186
  461    HG2  ARG  62           HG2      ARG  62  10.360  -0.556  17.169
  462    HG3  ARG  62           HG3      ARG  62  10.703   1.144  16.881
  463    HD2  ARG  62           HD2      ARG  62  12.150  -0.258  15.540
  464    HD3  ARG  62           HD3      ARG  62  13.119   0.608  16.768
  465    HE   ARG  62           HE       ARG  62  12.269  -2.040  17.599
  466   HH11  ARG  62          HH21      ARG  62  14.813  -0.342  15.797
  467   HH12  ARG  62          HH22      ARG  62  15.911  -1.676  15.820
  468   HH21  ARG  62          HH11      ARG  62  13.651  -3.856  17.505
  469   HH22  ARG  62          HH12      ARG  62  15.246  -3.709  16.864
  470    H    LYS  63           H        LYS  63  10.397   1.922  21.363
  471    HA   LYS  63           HA       LYS  63  12.002   0.401  23.165
  472    HB2  LYS  63           HB2      LYS  63  10.495   2.957  23.852
  473    HB3  LYS  63           HB3      LYS  63  12.017   2.367  24.535
  474    HG2  LYS  63           HG2      LYS  63  11.584   3.510  21.760
  475    HG3  LYS  63           HG3      LYS  63  12.418   4.288  23.101
  476    HD2  LYS  63           HD2      LYS  63  13.284   1.637  21.933
  477    HD3  LYS  63           HD3      LYS  63  13.866   3.198  21.312
  478    HE2  LYS  63           HE2      LYS  63  14.737   3.764  23.591
  479    HE3  LYS  63           HE3      LYS  63  14.236   2.165  24.169
  480    HZ1  LYS  63           HZ1      LYS  63  15.798   1.177  22.581
  481    HZ2  LYS  63           HZ2      LYS  63  16.253   2.658  22.046
  482    HZ3  LYS  63           HZ3      LYS  63  16.579   2.208  23.578
  483    H    ASP  64           H        ASP  64   8.582   0.765  22.904
  484    HA   ASP  64           HA       ASP  64   8.169  -0.098  25.720
  485    HB2  ASP  64           HB2      ASP  64   6.299   1.197  23.746
  486    HB3  ASP  64           HB3      ASP  64   5.838   0.637  25.368
  487    H    VAL  65           H        VAL  65   8.716  -1.698  22.999
  488    HA   VAL  65           HA       VAL  65   6.960  -3.959  23.784
  489    HB   VAL  65           HB       VAL  65   6.791  -4.534  21.333
  490   HG11  VAL  65          HG11      VAL  65   4.905  -3.040  20.931
  491   HG12  VAL  65          HG12      VAL  65   4.910  -3.601  22.619
  492   HG13  VAL  65          HG13      VAL  65   5.479  -1.966  22.230
  493   HG21  VAL  65          HG21      VAL  65   7.579  -1.631  20.860
  494   HG22  VAL  65          HG22      VAL  65   8.613  -3.015  20.492
  495   HG23  VAL  65          HG23      VAL  65   7.071  -2.803  19.639
  496    H    ARG  66           H        ARG  66   7.728  -6.070  22.900
  497    HA   ARG  66           HA       ARG  66  10.511  -6.184  21.990
  498    HB2  ARG  66           HB2      ARG  66  11.210  -7.883  23.538
  499    HB3  ARG  66           HB3      ARG  66  10.799  -6.403  24.389
  500    HG2  ARG  66           HG2      ARG  66   8.634  -8.469  24.335
  501    HG3  ARG  66           HG3      ARG  66  10.125  -8.914  25.151
  502    HD2  ARG  66           HD2      ARG  66  10.012  -6.683  26.402
  503    HD3  ARG  66           HD3      ARG  66   8.350  -6.551  25.820
  504    HE   ARG  66           HE       ARG  66   8.012  -8.813  26.894
  505   HH11  ARG  66          HH11      ARG  66  10.783  -6.960  28.172
  506   HH12  ARG  66          HH12      ARG  66  10.607  -7.644  29.762
  507   HH21  ARG  66          HH21      ARG  66   7.615  -9.349  29.207
  508   HH22  ARG  66          HH22      ARG  66   8.946  -9.054  30.270
  509    H    ILE  67           H        ILE  67  10.703  -7.922  20.432
  510    HA   ILE  67           HA       ILE  67   8.124  -9.090  19.656
  511    HB   ILE  67           HB       ILE  67  10.865  -9.443  18.418
  512   HG12  ILE  67          HG12      ILE  67   8.685  -7.704  17.239
  513   HG13  ILE  67          HG13      ILE  67   9.918  -7.036  18.308
  514   HG21  ILE  67          HG21      ILE  67   8.077 -10.133  17.352
  515   HG22  ILE  67          HG22      ILE  67   9.599 -10.335  16.451
  516   HG23  ILE  67          HG23      ILE  67   9.305 -11.297  17.882
  517   HD11  ILE  67          HD11      ILE  67  10.397  -8.418  15.647
  518   HD12  ILE  67          HD12      ILE  67  10.608  -6.704  16.029
  519   HD13  ILE  67          HD13      ILE  67  11.683  -7.901  16.770
  520    H    LEU  68           H        LEU  68   7.460 -10.777  20.676
  521    HA   LEU  68           HA       LEU  68   9.345 -12.670  21.978
  522    HB2  LEU  68           HB2      LEU  68   6.308 -12.432  22.040
  523    HB3  LEU  68           HB3      LEU  68   7.292 -13.524  23.021
  524    HG   LEU  68           HG       LEU  68   7.223 -10.468  23.262
  525   HD11  LEU  68          HD11      LEU  68   5.318 -11.315  24.143
  526   HD12  LEU  68          HD12      LEU  68   6.078 -12.823  24.737
  527   HD13  LEU  68          HD13      LEU  68   6.453 -11.278  25.527
  528   HD21  LEU  68          HD21      LEU  68   8.693 -10.865  25.247
  529   HD22  LEU  68          HD22      LEU  68   8.887 -12.562  24.761
  530   HD23  LEU  68          HD23      LEU  68   9.524 -11.244  23.740
  531    H    ALA  69           H        ALA  69   7.105 -12.445  19.205
  532    HA   ALA  69           HA       ALA  69   7.972 -15.048  18.176
  533    HB1  ALA  69           HB1      ALA  69   5.011 -14.798  18.458
  534    HB2  ALA  69           HB2      ALA  69   6.015 -16.229  18.255
  535    HB3  ALA  69           HB3      ALA  69   5.942 -15.427  19.838
  536    H    SER  70           H        SER  70   7.066 -15.373  16.062
  537    HA   SER  70           HA       SER  70   5.494 -13.433  14.792
  538    HB2  SER  70           HB2      SER  70   7.145 -12.733  13.009
  539    HB3  SER  70           HB3      SER  70   7.371 -12.016  14.609
  540    HG   SER  70           HG       SER  70   9.379 -12.753  13.696
  541    H    THR  71           H        THR  71   4.943 -14.139  12.488
  542    HA   THR  71           HA       THR  71   4.673 -16.986  12.746
  543    HB   THR  71           HB       THR  71   3.511 -16.753  10.472
  544    HG1  THR  71           HG1      THR  71   4.171 -14.831   9.669
  545   HG21  THR  71          HG21      THR  71   2.527 -16.589  12.898
  546   HG22  THR  71          HG22      THR  71   2.304 -14.891  12.470
  547   HG23  THR  71          HG23      THR  71   1.545 -16.162  11.483
  548    H    ARG  72           H        ARG  72   5.517 -18.618  11.868
  549    HA   ARG  72           HA       ARG  72   8.239 -18.323  10.795
  550    HB2  ARG  72           HB2      ARG  72   6.523 -20.790  11.280
  551    HB3  ARG  72           HB3      ARG  72   8.266 -20.795  11.051
  552    HG2  ARG  72           HG2      ARG  72   8.725 -20.061  13.211
  553    HG3  ARG  72           HG3      ARG  72   7.247 -19.122  13.343
  554    HD2  ARG  72           HD2      ARG  72   6.052 -21.464  13.234
  555    HD3  ARG  72           HD3      ARG  72   7.607 -22.079  13.817
  556    HE   ARG  72           HE       ARG  72   5.641 -20.222  15.039
  557   HH11  ARG  72          HH21      ARG  72   8.781 -21.824  15.536
  558   HH12  ARG  72          HH22      ARG  72   8.759 -21.676  17.258
  559   HH21  ARG  72          HH11      ARG  72   5.539 -20.129  17.338
  560   HH22  ARG  72          HH12      ARG  72   6.886 -20.651  18.306
  561    H    ASN  73           H        ASN  73   5.026 -18.970   9.649
  562    HA   ASN  73           HA       ASN  73   5.939 -19.378   6.891
  563    HB2  ASN  73           HB2      ASN  73   4.257 -20.904   6.476
  564    HB3  ASN  73           HB3      ASN  73   4.832 -21.409   8.063
  565   HD21  ASN  73          HD22      ASN  73   3.364 -20.137  10.046
  566   HD22  ASN  73          HD21      ASN  73   1.684 -20.259   9.672
  567    H    TRP  74           H        TRP  74   4.538 -18.294   5.277
  568    HA   TRP  74           HA       TRP  74   3.333 -15.824   6.383
  569    HB2  TRP  74           HB2      TRP  74   3.807 -16.818   3.539
  570    HB3  TRP  74           HB3      TRP  74   2.855 -15.393   3.906
  571    HD1  TRP  74           HD1      TRP  74   6.481 -16.622   3.969
  572    HE1  TRP  74           HE1      TRP  74   8.056 -14.605   4.068
  573    HE3  TRP  74           HE3      TRP  74   3.012 -12.920   4.566
  574    HZ2  TRP  74           HZ2      TRP  74   7.853 -11.784   4.570
  575    HZ3  TRP  74           HZ3      TRP  74   3.725 -10.552   4.874
  576    HH2  TRP  74           HH2      TRP  74   6.150 -10.003   5.027
  577    H    LEU  75           H        LEU  75   1.214 -15.402   6.529
  578    HA   LEU  75           HA       LEU  75  -0.638 -17.694   6.012
  579    HB2  LEU  75           HB2      LEU  75  -1.260 -15.148   7.544
  580    HB3  LEU  75           HB3      LEU  75  -2.174 -16.653   7.490
  581    HG   LEU  75           HG       LEU  75   0.421 -16.056   8.955
  582   HD11  LEU  75          HD11      LEU  75  -2.279 -17.160   9.877
  583   HD12  LEU  75          HD12      LEU  75  -0.870 -16.851  10.911
  584   HD13  LEU  75          HD13      LEU  75  -1.672 -15.502  10.102
  585   HD21  LEU  75          HD21      LEU  75   0.440 -18.424   9.716
  586   HD22  LEU  75          HD22      LEU  75  -0.760 -18.816   8.457
  587   HD23  LEU  75          HD23      LEU  75   0.865 -18.212   8.020
  588    H    ARG  76           H        ARG  76  -2.013 -17.510   4.199
  589    HA   ARG  76           HA       ARG  76  -2.267 -14.800   2.954
  590    HB2  ARG  76           HB2      ARG  76  -0.506 -16.379   1.940
  591    HB3  ARG  76           HB3      ARG  76  -1.836 -17.463   1.546
  592    HG2  ARG  76           HG2      ARG  76  -2.804 -15.482   0.148
  593    HG3  ARG  76           HG3      ARG  76  -1.212 -14.721   0.404
  594    HD2  ARG  76           HD2      ARG  76  -0.187 -16.900  -0.410
  595    HD3  ARG  76           HD3      ARG  76  -1.832 -17.397  -0.894
  596    HE   ARG  76           HE       ARG  76  -1.386 -14.898  -2.079
  597   HH11  ARG  76          HH11      ARG  76   0.087 -18.139  -2.255
  598   HH12  ARG  76          HH12      ARG  76   0.696 -17.938  -3.855
  599   HH21  ARG  76          HH22      ARG  76  -0.600 -14.653  -4.266
  600   HH22  ARG  76          HH21      ARG  76   0.307 -15.917  -5.006
  601    H    TYR  77           H        TYR  77  -4.241 -14.461   1.872
  602    HA   TYR  77           HA       TYR  77  -6.081 -16.676   1.570
  603    HB2  TYR  77           HB2      TYR  77  -7.999 -15.796   2.600
  604    HB3  TYR  77           HB3      TYR  77  -6.739 -16.034   3.805
  605    HD1  TYR  77           HD1      TYR  77  -5.305 -13.908   4.429
  606    HD2  TYR  77           HD2      TYR  77  -9.197 -13.798   2.558
  607    HE1  TYR  77           HE1      TYR  77  -5.639 -11.643   5.291
  608    HE2  TYR  77           HE2      TYR  77  -9.564 -11.535   3.445
  609    HH   TYR  77           HH       TYR  77  -7.130  -9.805   5.480
  610    H    LYS  78           H        LYS  78  -7.608 -16.342  -0.026
  611    HA   LYS  78           HA       LYS  78  -7.207 -13.948  -1.740
  612    HB2  LYS  78           HB2      LYS  78  -8.461 -16.688  -2.202
  613    HB3  LYS  78           HB3      LYS  78  -8.900 -15.306  -3.196
  614    HG2  LYS  78           HG2      LYS  78  -7.238 -16.533  -4.337
  615    HG3  LYS  78           HG3      LYS  78  -6.599 -14.954  -3.883
  616    HD2  LYS  78           HD2      LYS  78  -5.111 -15.853  -2.284
  617    HD3  LYS  78           HD3      LYS  78  -6.027 -17.352  -2.094
  618    HE2  LYS  78           HE2      LYS  78  -4.521 -16.613  -4.645
  619    HE3  LYS  78           HE3      LYS  78  -3.801 -17.528  -3.316
  620    HZ1  LYS  78           HZ1      LYS  78  -4.639 -19.005  -5.018
  621    HZ2  LYS  78           HZ2      LYS  78  -5.491 -19.248  -3.651
  622    HZ3  LYS  78           HZ3      LYS  78  -6.153 -18.419  -4.906
  623    H    LEU  79           H        LEU  79  -8.885 -12.626  -2.178
  624    HA   LEU  79           HA       LEU  79 -11.033 -12.264  -0.269
  625    HB2  LEU  79           HB2      LEU  79 -10.682 -11.112  -3.074
  626    HB3  LEU  79           HB3      LEU  79 -11.772 -10.517  -1.831
  627    HG   LEU  79           HG       LEU  79  -8.746 -10.318  -1.934
  628   HD11  LEU  79          HD11      LEU  79 -10.016  -8.733  -3.291
  629   HD12  LEU  79          HD12      LEU  79 -10.993  -8.255  -1.890
  630   HD13  LEU  79          HD13      LEU  79  -9.246  -7.900  -1.928
  631   HD21  LEU  79          HD21      LEU  79  -8.905  -9.130   0.246
  632   HD22  LEU  79          HD22      LEU  79 -10.603  -9.655   0.379
  633   HD23  LEU  79          HD23      LEU  79  -9.289 -10.868   0.331
  634    HA   PRO  80           HA       PRO  80 -14.104 -14.587  -2.719
  635    HB2  PRO  80           HB2      PRO  80 -16.410 -13.503  -1.631
  636    HB3  PRO  80           HB3      PRO  80 -15.403 -14.699  -0.743
  637    HG2  PRO  80           HG2      PRO  80 -15.345 -11.694  -0.559
  638    HG3  PRO  80           HG3      PRO  80 -15.476 -12.858   0.795
  639    HD2  PRO  80           HD2      PRO  80 -13.077 -11.789   0.090
  640    HD3  PRO  80           HD3      PRO  80 -13.185 -13.518   0.533
  641    H    LYS  81           H        LYS  81 -15.313 -13.831  -4.722
  642    HA   LYS  81           HA       LYS  81 -14.058 -11.444  -5.594
  643    HB2  LYS  81           HB2      LYS  81 -16.162 -12.946  -7.112
  644    HB3  LYS  81           HB3      LYS  81 -15.026 -11.696  -7.709
  645    HG2  LYS  81           HG2      LYS  81 -13.128 -13.074  -7.416
  646    HG3  LYS  81           HG3      LYS  81 -14.048 -14.304  -6.546
  647    HD2  LYS  81           HD2      LYS  81 -13.563 -14.985  -8.850
  648    HD3  LYS  81           HD3      LYS  81 -15.300 -14.897  -8.513
  649    HE2  LYS  81           HE2      LYS  81 -15.436 -12.738  -9.725
  650    HE3  LYS  81           HE3      LYS  81 -13.692 -12.805 -10.044
  651    HZ1  LYS  81           HZ1      LYS  81 -14.972 -13.606 -11.930
  652    HZ2  LYS  81           HZ2      LYS  81 -14.070 -14.831 -11.334
  653    HZ3  LYS  81           HZ3      LYS  81 -15.685 -14.771 -11.039
  654    H    ARG  82           H        ARG  82 -17.089 -11.728  -3.985
  655    HA   ARG  82           HA       ARG  82 -18.256  -9.331  -4.913
  656    HB2  ARG  82           HB2      ARG  82 -19.467  -9.222  -2.811
  657    HB3  ARG  82           HB3      ARG  82 -19.473 -10.850  -3.507
  658    HG2  ARG  82           HG2      ARG  82 -17.553 -11.366  -1.839
  659    HG3  ARG  82           HG3      ARG  82 -17.977  -9.831  -1.067
  660    HD2  ARG  82           HD2      ARG  82 -19.857 -12.166  -1.561
  661    HD3  ARG  82           HD3      ARG  82 -19.072 -11.822  -0.023
  662    HE   ARG  82           HE       ARG  82 -20.262  -9.688   0.098
  663   HH11  ARG  82          HH11      ARG  82 -21.708 -12.182  -2.004
  664   HH12  ARG  82          HH12      ARG  82 -23.304 -11.532  -1.896
  665   HH21  ARG  82          HH21      ARG  82 -22.380  -8.816   0.201
  666   HH22  ARG  82          HH22      ARG  82 -23.686  -9.582  -0.626
  667    H    LEU  83           H        LEU  83 -15.505  -9.763  -2.771
  668    HA   LEU  83           HA       LEU  83 -15.509  -6.928  -2.017
  669    HB2  LEU  83           HB2      LEU  83 -13.573  -9.133  -1.271
  670    HB3  LEU  83           HB3      LEU  83 -13.626  -7.517  -0.575
  671    HG   LEU  83           HG       LEU  83 -15.774  -9.652  -0.333
  672   HD11  LEU  83          HD11      LEU  83 -15.158  -9.862   1.962
  673   HD12  LEU  83          HD12      LEU  83 -13.687 -10.022   0.999
  674   HD13  LEU  83          HD13      LEU  83 -14.008  -8.497   1.845
  675   HD21  LEU  83          HD21      LEU  83 -15.786  -6.849   0.810
  676   HD22  LEU  83          HD22      LEU  83 -16.938  -7.562  -0.355
  677   HD23  LEU  83          HD23      LEU  83 -16.880  -8.158   1.304
  678    H    VAL  84           H        VAL  84 -14.054  -8.970  -4.403
  679    HA   VAL  84           HA       VAL  84 -11.625  -7.524  -4.817
  680    HB   VAL  84           HB       VAL  84 -13.304  -9.211  -6.748
  681   HG11  VAL  84          HG11      VAL  84 -11.793  -7.926  -8.082
  682   HG12  VAL  84          HG12      VAL  84 -10.458  -8.194  -6.941
  683   HG13  VAL  84          HG13      VAL  84 -11.074  -9.534  -7.918
  684   HG21  VAL  84          HG21      VAL  84 -11.989 -11.086  -6.265
  685   HG22  VAL  84          HG22      VAL  84 -10.790 -10.142  -5.334
  686   HG23  VAL  84          HG23      VAL  84 -12.401 -10.440  -4.666
  687    H    ARG  85           H        ARG  85 -11.247  -5.630  -5.915
  688    HA   ARG  85           HA       ARG  85 -13.463  -4.396  -7.421
  689    HB2  ARG  85           HB2      ARG  85 -11.390  -3.397  -5.597
  690    HB3  ARG  85           HB3      ARG  85 -11.301  -2.554  -7.148
  691    HG2  ARG  85           HG2      ARG  85 -13.855  -2.965  -5.612
  692    HG3  ARG  85           HG3      ARG  85 -12.819  -1.512  -5.486
  693    HD2  ARG  85           HD2      ARG  85 -13.036  -1.360  -8.063
  694    HD3  ARG  85           HD3      ARG  85 -14.383  -2.474  -7.944
  695    HE   ARG  85           HE       ARG  85 -14.200   0.340  -7.115
  696   HH11  ARG  85          HH21      ARG  85 -16.190  -2.604  -6.745
  697   HH12  ARG  85          HH22      ARG  85 -17.620  -1.740  -6.319
  698   HH21  ARG  85          HH11      ARG  85 -16.107   1.469  -6.545
  699   HH22  ARG  85          HH12      ARG  85 -17.564   0.619  -6.183
  700    H    TRP  86           H        TRP  86 -13.376  -5.554  -9.224
  701    HA   TRP  86           HA       TRP  86 -11.034  -5.970 -10.803
  702    HB2  TRP  86           HB2      TRP  86 -14.003  -5.967 -11.423
  703    HB3  TRP  86           HB3      TRP  86 -12.774  -6.485 -12.576
  704    HD1  TRP  86           HD1      TRP  86 -14.933  -7.857  -9.932
  705    HE1  TRP  86           HE1      TRP  86 -14.238 -10.217  -9.237
  706    HE3  TRP  86           HE3      TRP  86 -10.374  -8.053 -12.247
  707    HZ2  TRP  86           HZ2      TRP  86 -11.849 -11.875  -9.410
  708    HZ3  TRP  86           HZ3      TRP  86  -8.903 -10.037 -11.966
  709    HH2  TRP  86           HH2      TRP  86  -9.631 -11.947 -10.543
  710    H    ASP  87           H        ASP  87 -13.168  -3.200 -10.426
  711    HA   ASP  87           HA       ASP  87 -12.851  -2.090 -13.025
  712    HB2  ASP  87           HB2      ASP  87 -14.701  -1.499 -11.557
  713    HB3  ASP  87           HB3      ASP  87 -13.584  -0.788 -10.383
  714    H    THR  88           H        THR  88 -10.847  -1.856 -10.135
  715    HA   THR  88           HA       THR  88  -9.292   0.338 -11.341
  716    HB   THR  88           HB       THR  88 -10.410   0.580  -9.043
  717    HG1  THR  88           HG1      THR  88  -8.982   2.123  -9.585
  718   HG21  THR  88          HG21      THR  88  -7.930  -0.903  -8.101
  719   HG22  THR  88          HG22      THR  88  -9.271  -0.248  -7.116
  720   HG23  THR  88          HG23      THR  88  -9.544  -1.647  -8.159
  721    H    LYS  89           H        LYS  89  -6.927   0.209 -11.024
  722    HA   LYS  89           HA       LYS  89  -5.916  -2.529 -11.424
  723    HB2  LYS  89           HB2      LYS  89  -5.280  -0.128 -13.171
  724    HB3  LYS  89           HB3      LYS  89  -4.631  -1.753 -13.370
  725    HG2  LYS  89           HG2      LYS  89  -7.568  -0.972 -13.635
  726    HG3  LYS  89           HG3      LYS  89  -6.436  -1.155 -14.976
  727    HD2  LYS  89           HD2      LYS  89  -6.092  -3.540 -14.392
  728    HD3  LYS  89           HD3      LYS  89  -7.294  -3.420 -13.107
  729    HE2  LYS  89           HE2      LYS  89  -7.845  -2.844 -16.051
  730    HE3  LYS  89           HE3      LYS  89  -8.118  -4.407 -15.281
  731    HZ1  LYS  89           HZ1      LYS  89 -10.144  -3.113 -15.404
  732    HZ2  LYS  89           HZ2      LYS  89  -9.773  -3.381 -13.837
  733    HZ3  LYS  89           HZ3      LYS  89  -9.519  -1.897 -14.517
  734    HA   PRO  90           HA       PRO  90  -4.225  -3.709 -11.302
  735    HB2  PRO  90           HB2      PRO  90  -2.714  -5.000  -9.509
  736    HB3  PRO  90           HB3      PRO  90  -2.032  -4.069 -10.885
  737    HG2  PRO  90           HG2      PRO  90  -2.383  -3.137  -8.006
  738    HG3  PRO  90           HG3      PRO  90  -0.892  -3.050  -9.007
  739    HD2  PRO  90           HD2      PRO  90  -2.628  -0.939  -8.755
  740    HD3  PRO  90           HD3      PRO  90  -1.766  -1.267 -10.288
  741    H    VAL  91           H        VAL  91  -5.622  -5.343 -10.487
  742    HA   VAL  91           HA       VAL  91  -7.375  -4.523  -8.328
  743    HB   VAL  91           HB       VAL  91  -8.449  -5.371 -10.222
  744   HG11  VAL  91          HG11      VAL  91  -6.602  -7.791 -10.251
  745   HG12  VAL  91          HG12      VAL  91  -8.043  -7.587 -11.267
  746   HG13  VAL  91          HG13      VAL  91  -6.690  -6.484 -11.464
  747   HG21  VAL  91          HG21      VAL  91  -9.692  -7.292  -9.477
  748   HG22  VAL  91          HG22      VAL  91  -8.382  -7.819  -8.419
  749   HG23  VAL  91          HG23      VAL  91  -9.282  -6.335  -8.041
  750    H    CYS  92           H        CYS  92  -7.449  -5.293  -6.276
  751    HA   CYS  92           HA       CYS  92  -5.335  -7.110  -5.354
  752    HB2  CYS  92           HB2      CYS  92  -6.089  -5.210  -3.932
  753    HB3  CYS  92           HB3      CYS  92  -7.726  -5.884  -3.898
  754    HG   CYS  92           HG       CYS  92  -6.670  -6.376  -1.608
  755    H    ILE  93           H        ILE  93  -5.628  -9.328  -5.333
  756    HA   ILE  93           HA       ILE  93  -8.428 -10.296  -4.992
  757    HB   ILE  93           HB       ILE  93  -8.205 -12.143  -6.286
  758   HG12  ILE  93          HG12      ILE  93  -6.020 -13.000  -5.769
  759   HG13  ILE  93          HG13      ILE  93  -6.259 -12.936  -7.509
  760   HG21  ILE  93          HG21      ILE  93  -8.680 -10.139  -7.567
  761   HG22  ILE  93          HG22      ILE  93  -6.958  -9.900  -7.922
  762   HG23  ILE  93          HG23      ILE  93  -7.808 -11.323  -8.548
  763   HD11  ILE  93          HD11      ILE  93  -4.043 -12.238  -7.155
  764   HD12  ILE  93          HD12      ILE  93  -4.899 -10.724  -7.449
  765   HD13  ILE  93          HD13      ILE  93  -4.469 -11.216  -5.785
  766    H    GLY  94           H        GLY  94  -5.292 -10.183  -3.570
  767    HA2  GLY  94           HA2      GLY  94  -6.313 -11.508  -1.278
  768    HA3  GLY  94           HA3      GLY  94  -5.181 -12.573  -2.137
  769    H    GLN  95           H        GLN  95  -4.250 -12.064   0.140
  770    HA   GLN  95           HA       GLN  95  -2.037 -10.159  -0.198
  771    HB2  GLN  95           HB2      GLN  95  -2.380  -9.278   2.117
  772    HB3  GLN  95           HB3      GLN  95  -3.543  -8.709   0.941
  773    HG2  GLN  95           HG2      GLN  95  -4.230 -11.049   2.750
  774    HG3  GLN  95           HG3      GLN  95  -4.339  -9.386   3.323
  775   HE21  GLN  95          HE22      GLN  95  -6.077 -11.845   1.557
  776   HE22  GLN  95          HE21      GLN  95  -7.359 -10.786   1.040
  777    H    LYS  96           H        LYS  96  -0.259 -10.611   1.213
  778    HA   LYS  96           HA       LYS  96  -0.398 -13.261   2.601
  779    HB2  LYS  96           HB2      LYS  96   1.995 -13.525   2.283
  780    HB3  LYS  96           HB3      LYS  96   1.159 -13.429   0.736
  781    HG2  LYS  96           HG2      LYS  96   1.851 -11.069   0.488
  782    HG3  LYS  96           HG3      LYS  96   2.718 -11.141   2.030
  783    HD2  LYS  96           HD2      LYS  96   3.341 -12.889  -0.393
  784    HD3  LYS  96           HD3      LYS  96   4.128 -11.350  -0.042
  785    HE2  LYS  96           HE2      LYS  96   4.976 -12.247   2.127
  786    HE3  LYS  96           HE3      LYS  96   4.214 -13.804   1.775
  787    HZ1  LYS  96           HZ1      LYS  96   6.548 -13.838   1.155
  788    HZ2  LYS  96           HZ2      LYS  96   5.649 -13.989  -0.196
  789    HZ3  LYS  96           HZ3      LYS  96   6.381 -12.563   0.155
  790    H    GLN  97           H        GLN  97   0.229 -13.236   4.742
  791    HA   GLN  97           HA       GLN  97   0.576 -10.549   5.978
  792    HB2  GLN  97           HB2      GLN  97  -1.618 -12.462   6.085
  793    HB3  GLN  97           HB3      GLN  97  -0.864 -12.385   7.657
  794    HG2  GLN  97           HG2      GLN  97  -1.967 -10.005   6.101
  795    HG3  GLN  97           HG3      GLN  97  -2.782 -10.847   7.408
  796   HE21  GLN  97          HE22      GLN  97  -2.830  -8.470   8.275
  797   HE22  GLN  97          HE21      GLN  97  -1.394  -7.946   9.136
  798    H    LYS  98           H        LYS  98   1.855 -10.479   7.815
  799    HA   LYS  98           HA       LYS  98   3.142 -12.961   8.796
  800    HB2  LYS  98           HB2      LYS  98   4.680 -11.918   7.168
  801    HB3  LYS  98           HB3      LYS  98   4.611 -10.377   8.072
  802    HG2  LYS  98           HG2      LYS  98   5.880 -11.219   9.811
  803    HG3  LYS  98           HG3      LYS  98   5.494 -12.912   9.470
  804    HD2  LYS  98           HD2      LYS  98   7.112 -11.275   7.515
  805    HD3  LYS  98           HD3      LYS  98   7.901 -11.947   8.934
  806    HE2  LYS  98           HE2      LYS  98   6.242 -13.731   7.094
  807    HE3  LYS  98           HE3      LYS  98   7.864 -13.247   6.631
  808    HZ1  LYS  98           HZ1      LYS  98   7.253 -14.766   9.134
  809    HZ2  LYS  98           HZ2      LYS  98   7.961 -15.349   7.783
  810    HZ3  LYS  98           HZ3      LYS  98   8.739 -14.236   8.677
  811    H    TRP  99           H        TRP  99   2.750 -12.985  10.966
  812    HA   TRP  99           HA       TRP  99   1.871 -10.398  12.185
  813    HB2  TRP  99           HB2      TRP  99   1.082 -13.192  13.009
  814    HB3  TRP  99           HB3      TRP  99   0.537 -11.685  13.715
  815    HD1  TRP  99           HD1      TRP  99   0.288 -13.707  10.448
  816    HE1  TRP  99           HE1      TRP  99  -1.940 -13.171   9.307
  817    HE3  TRP  99           HE3      TRP  99  -1.262  -9.865  13.447
  818    HZ2  TRP  99           HZ2      TRP  99  -4.092 -11.282   9.601
  819    HZ3  TRP  99           HZ3      TRP  99  -3.318  -8.602  12.884
  820    HH2  TRP  99           HH2      TRP  99  -4.762  -9.321  11.001
  821    H    PHE 100           H        PHE 100   2.477 -10.007  14.382
  822    HA   PHE 100           HA       PHE 100   5.007 -11.314  15.278
  823    HB2  PHE 100           HB2      PHE 100   4.283  -8.358  15.011
  824    HB3  PHE 100           HB3      PHE 100   5.649  -8.943  15.943
  825    HD1  PHE 100           HD1      PHE 100   4.204  -8.793  12.478
  826    HD2  PHE 100           HD2      PHE 100   7.714  -9.474  14.911
  827    HE1  PHE 100           HE1      PHE 100   5.635  -8.782  10.455
  828    HE2  PHE 100           HE2      PHE 100   9.129  -9.464  12.875
  829    HZ   PHE 100           HZ       PHE 100   8.092  -9.134  10.646
  830    H    LEU 101           H        LEU 101   4.826 -11.971  17.372
  831    HA   LEU 101           HA       LEU 101   2.616 -10.931  19.052
  832    HB2  LEU 101           HB2      LEU 101   3.345 -13.463  18.886
  833    HB3  LEU 101           HB3      LEU 101   4.694 -12.984  19.889
  834    HG   LEU 101           HG       LEU 101   1.835 -13.401  20.527
  835   HD11  LEU 101          HD11      LEU 101   3.765 -14.916  21.280
  836   HD12  LEU 101          HD12      LEU 101   4.311 -13.586  22.315
  837   HD13  LEU 101          HD13      LEU 101   2.733 -14.332  22.572
  838   HD21  LEU 101          HD21      LEU 101   1.728 -12.034  22.460
  839   HD22  LEU 101          HD22      LEU 101   3.366 -11.362  22.192
  840   HD23  LEU 101          HD23      LEU 101   1.986 -10.958  21.129
  841    H    LEU 102           H        LEU 102   3.181  -9.166  20.308
  842    HA   LEU 102           HA       LEU 102   6.022  -8.993  21.183
  843    HB2  LEU 102           HB2      LEU 102   4.236  -6.578  21.082
  844    HB3  LEU 102           HB3      LEU 102   5.982  -6.645  21.111
  845    HG   LEU 102           HG       LEU 102   4.238  -7.344  18.725
  846   HD11  LEU 102          HD11      LEU 102   4.176  -4.925  19.420
  847   HD12  LEU 102          HD12      LEU 102   5.939  -4.866  19.145
  848   HD13  LEU 102          HD13      LEU 102   4.834  -5.217  17.804
  849   HD21  LEU 102          HD21      LEU 102   6.392  -7.118  17.450
  850   HD22  LEU 102          HD22      LEU 102   7.257  -7.026  19.006
  851   HD23  LEU 102          HD23      LEU 102   6.374  -8.505  18.544
  852    H    GLN 103           H        GLN 103   6.248  -8.115  23.396
  853    HA   GLN 103           HA       GLN 103   3.677  -8.286  24.943
  854    HB2  GLN 103           HB2      GLN 103   4.845  -9.860  25.802
  855    HB3  GLN 103           HB3      GLN 103   6.408  -9.033  25.733
  856    HG2  GLN 103           HG2      GLN 103   5.868  -7.716  27.699
  857    HG3  GLN 103           HG3      GLN 103   4.130  -7.839  27.419
  858   HE21  GLN 103          HE22      GLN 103   3.008  -9.863  27.815
  859   HE22  GLN 103          HE21      GLN 103   3.656 -10.952  29.045
  860    H    LEU 104           H        LEU 104   2.995  -6.316  25.854
  861    HA   LEU 104           HA       LEU 104   4.248  -3.812  25.258
  862    HB2  LEU 104           HB2      LEU 104   1.777  -4.770  26.401
  863    HB3  LEU 104           HB3      LEU 104   2.555  -3.924  27.696
  864    HG   LEU 104           HG       LEU 104   1.207  -2.337  26.833
  865   HD11  LEU 104          HD11      LEU 104   3.666  -1.758  25.143
  866   HD12  LEU 104          HD12      LEU 104   2.431  -0.609  25.699
  867   HD13  LEU 104          HD13      LEU 104   3.493  -1.385  26.876
  868   HD21  LEU 104          HD21      LEU 104   0.247  -3.468  25.009
  869   HD22  LEU 104          HD22      LEU 104   0.741  -1.878  24.473
  870   HD23  LEU 104          HD23      LEU 104   1.737  -3.276  24.012
  871    H    VAL 105           H        VAL 105   5.893  -2.743  26.469
  872    HA   VAL 105           HA       VAL 105   7.274  -4.396  28.459
  873    HB   VAL 105           HB       VAL 105   7.864  -1.696  27.210
  874   HG11  VAL 105          HG11      VAL 105   9.649  -3.327  29.065
  875   HG12  VAL 105          HG12      VAL 105  10.170  -1.929  28.094
  876   HG13  VAL 105          HG13      VAL 105   8.978  -1.709  29.383
  877   HG21  VAL 105          HG21      VAL 105   9.438  -2.833  25.823
  878   HG22  VAL 105          HG22      VAL 105   9.371  -4.311  26.811
  879   HG23  VAL 105          HG23      VAL 105   8.001  -3.861  25.788
  880    H    SER 106           H        SER 106   5.922  -1.090  28.423
  881    HA   SER 106           HA       SER 106   6.135  -0.727  31.225
  882    HB2  SER 106           HB2      SER 106   4.409   0.785  29.233
  883    HB3  SER 106           HB3      SER 106   5.138   1.411  30.735
  884    HG   SER 106           HG       SER 106   6.450   2.031  28.987
  885    H    GLY 107           H        GLY 107   3.474  -1.823  29.147
  886    HA2  GLY 107           HA2      GLY 107   1.740  -3.228  30.400
  887    HA3  GLY 107           HA3      GLY 107   1.541  -1.795  31.421
  888    H    ASP 108           H        ASP 108  -0.583  -2.788  29.940
  889    HA   ASP 108           HA       ASP 108  -0.900  -1.961  27.338
  890    HB2  ASP 108           HB2      ASP 108  -3.133  -2.559  27.578
  891    HB3  ASP 108           HB3      ASP 108  -2.285  -3.567  28.747
  892    H    ALA 109           H        ALA 109  -1.091  -0.031  30.196
  893    HA   ALA 109           HA       ALA 109  -2.695   2.124  29.387
  894    HB1  ALA 109           HB1      ALA 109  -0.127   2.211  31.023
  895    HB2  ALA 109           HB2      ALA 109  -1.369   3.477  30.972
  896    HB3  ALA 109           HB3      ALA 109  -1.758   1.889  31.663
  897    H    GLU 110           H        GLU 110   0.568   1.303  28.262
  898    HA   GLU 110           HA       GLU 110   0.974   3.842  27.033
  899    HB2  GLU 110           HB2      GLU 110   2.477   1.234  27.319
  900    HB3  GLU 110           HB3      GLU 110   2.966   2.281  26.001
  901    HG2  GLU 110           HG2      GLU 110   4.227   2.555  28.088
  902    HG3  GLU 110           HG3      GLU 110   3.548   4.044  27.425
  903    H    ILE 111           H        ILE 111  -1.287   2.152  26.177
  904    HA   ILE 111           HA       ILE 111  -0.879   2.112  23.225
  905    HB   ILE 111           HB       ILE 111  -3.189   1.033  24.885
  906   HG12  ILE 111          HG12      ILE 111  -1.151  -0.536  23.239
  907   HG13  ILE 111          HG13      ILE 111  -0.942  -0.257  24.964
  908   HG21  ILE 111          HG21      ILE 111  -3.992   0.066  22.755
  909   HG22  ILE 111          HG22      ILE 111  -3.965   1.816  22.705
  910   HG23  ILE 111          HG23      ILE 111  -2.671   0.903  21.886
  911   HD11  ILE 111          HD11      ILE 111  -1.894  -2.489  24.495
  912   HD12  ILE 111          HD12      ILE 111  -2.952  -1.500  25.509
  913   HD13  ILE 111          HD13      ILE 111  -3.333  -1.741  23.806
  914    H    ASN 112           H        ASN 112  -1.856   3.696  21.958
  915    HA   ASN 112           HA       ASN 112  -3.412   5.834  23.409
  916    HB2  ASN 112           HB2      ASN 112  -1.069   6.518  23.148
  917    HB3  ASN 112           HB3      ASN 112  -1.146   6.211  21.414
  918   HD21  ASN 112          HD22      ASN 112  -0.768   8.408  20.740
  919   HD22  ASN 112          HD21      ASN 112  -1.920   9.676  21.067
  920    H    MET 113           H        MET 113  -2.643   4.417  20.223
  921    HA   MET 113           HA       MET 113  -3.780   3.990  18.398
  922    HB2  MET 113           HB2      MET 113  -6.405   4.511  19.790
  923    HB3  MET 113           HB3      MET 113  -6.031   3.424  18.453
  924    HG2  MET 113           HG2      MET 113  -4.389   2.321  20.224
  925    HG3  MET 113           HG3      MET 113  -5.447   3.119  21.392
  926    HE1  MET 113           HE1      MET 113  -5.942  -0.826  19.442
  927    HE2  MET 113           HE2      MET 113  -4.766   0.437  18.969
  928    HE3  MET 113           HE3      MET 113  -4.772  -0.195  20.631
  929    H    GLN 114           H        GLN 114  -3.188   7.007  19.122
  930    HA   GLN 114           HA       GLN 114  -4.842   8.220  17.029
  931    HB2  GLN 114           HB2      GLN 114  -4.684   9.229  19.865
  932    HB3  GLN 114           HB3      GLN 114  -5.519  10.024  18.514
  933    HG2  GLN 114           HG2      GLN 114  -7.058   8.054  18.356
  934    HG3  GLN 114           HG3      GLN 114  -6.295   7.365  19.785
  935   HE21  GLN 114          HE22      GLN 114  -7.948  10.437  18.705
  936   HE22  GLN 114          HE21      GLN 114  -8.735  10.717  20.239
  937    H    THR 115           H        THR 115  -2.128   7.578  17.237
  938    HA   THR 115           HA       THR 115  -0.355   9.792  17.613
  939    HB   THR 115           HB       THR 115   0.690   8.302  15.608
  940    HG1  THR 115           HG1      THR 115   0.096   6.132  15.962
  941   HG21  THR 115          HG21      THR 115   1.807   6.994  17.435
  942   HG22  THR 115          HG22      THR 115   1.645   8.683  17.918
  943   HG23  THR 115          HG23      THR 115   0.488   7.481  18.558
  944    H    SER 116           H        SER 116  -2.018   8.424  14.842
  945    HA   SER 116           HA       SER 116  -1.715  10.773  13.123
  946    HB2  SER 116           HB2      SER 116  -3.563   8.366  12.859
  947    HB3  SER 116           HB3      SER 116  -3.219   9.574  11.601
  948    HG   SER 116           HG       SER 116  -1.893   7.721  11.342
  949    H    SER 117           H        SER 117  -3.565  12.110  12.366
  950    HA   SER 117           HA       SER 117  -4.987  13.199  14.551
  951    HB2  SER 117           HB2      SER 117  -5.602  13.539  11.592
  952    HB3  SER 117           HB3      SER 117  -5.959  14.677  12.910
  953    HG   SER 117           HG       SER 117  -4.060  15.270  11.728
  954    H    THR 118           H        THR 118  -5.882  10.881  12.005
  955    HA   THR 118           HA       THR 118  -8.552  10.428  13.059
  956    HB   THR 118           HB       THR 118  -7.921   8.447  11.292
  957    HG1  THR 118           HG1      THR 118  -7.111   9.482   9.466
  958   HG21  THR 118          HG21      THR 118 -10.027   9.454  11.600
  959   HG22  THR 118          HG22      THR 118  -9.457  11.000  10.896
  960   HG23  THR 118          HG23      THR 118  -9.585   9.525   9.884
  961    HA   PRO 119           HA       PRO 119  -6.886   7.141  15.661
  962    HB2  PRO 119           HB2      PRO 119  -9.768   6.288  15.691
  963    HB3  PRO 119           HB3      PRO 119  -8.654   6.509  17.072
  964    HG2  PRO 119           HG2      PRO 119 -10.618   8.331  16.520
  965    HG3  PRO 119           HG3      PRO 119  -8.997   8.858  17.073
  966    HD2  PRO 119           HD2      PRO 119 -10.083   8.796  14.240
  967    HD3  PRO 119           HD3      PRO 119  -9.111  10.061  15.058
  968    H    GLU 120           H        GLU 120  -6.340   5.008  15.031
  969    HA   GLU 120           HA       GLU 120  -7.446   3.980  12.474
  970    HB2  GLU 120           HB2      GLU 120  -5.200   3.074  14.281
  971    HB3  GLU 120           HB3      GLU 120  -5.747   2.120  12.907
  972    HG2  GLU 120           HG2      GLU 120  -4.664   4.955  12.735
  973    HG3  GLU 120           HG3      GLU 120  -3.804   3.479  12.296
  974    H    PHE 121           H        PHE 121  -8.266   3.698  15.775
  975    HA   PHE 121           HA       PHE 121  -9.900   1.297  15.183
  976    HB2  PHE 121           HB2      PHE 121  -8.329   1.786  17.724
  977    HB3  PHE 121           HB3      PHE 121  -9.480   0.487  17.475
  978    HD1  PHE 121           HD1      PHE 121  -9.002  -1.178  15.490
  979    HD2  PHE 121           HD2      PHE 121  -6.050   1.440  17.196
  980    HE1  PHE 121           HE1      PHE 121  -7.220  -2.716  14.734
  981    HE2  PHE 121           HE2      PHE 121  -4.274  -0.149  16.527
  982    HZ   PHE 121           HZ       PHE 121  -4.849  -2.208  15.291
  983    H    ASP 122           H        ASP 122 -11.875   1.218  16.334
  984    HA   ASP 122           HA       ASP 122 -12.662   3.728  17.772
  985    HB2  ASP 122           HB2      ASP 122 -13.827   3.490  15.622
  986    HB3  ASP 122           HB3      ASP 122 -14.429   1.915  16.112
  987    H    GLY 123           H        GLY 123 -11.798   0.529  18.229
  988    HA2  GLY 123           HA2      GLY 123 -12.852   0.556  20.927
  989    HA3  GLY 123           HA3      GLY 123 -13.502  -0.758  19.912
  990    H    TRP 124           H        TRP 124 -11.579  -0.788  22.255
  991    HA   TRP 124           HA       TRP 124  -9.717  -2.726  21.135
  992    HB2  TRP 124           HB2      TRP 124  -8.128  -1.146  20.866
  993    HB3  TRP 124           HB3      TRP 124  -8.886  -0.015  21.970
  994    HD1  TRP 124           HD1      TRP 124  -7.096  -3.430  22.538
  995    HE1  TRP 124           HE1      TRP 124  -5.693  -3.235  24.652
  996    HE3  TRP 124           HE3      TRP 124  -7.850   1.536  23.528
  997    HZ2  TRP 124           HZ2      TRP 124  -4.961  -1.137  26.571
  998    HZ3  TRP 124           HZ3      TRP 124  -6.752   2.613  25.476
  999    HH2  TRP 124           HH2      TRP 124  -5.319   1.270  27.009
 1000    H    ARG 125           H        ARG 125  -9.246  -4.304  22.629
 1001    HA   ARG 125           HA       ARG 125  -9.957  -4.017  25.437
 1002    HB2  ARG 125           HB2      ARG 125 -11.646  -5.777  25.477
 1003    HB3  ARG 125           HB3      ARG 125 -12.159  -4.494  24.389
 1004    HG2  ARG 125           HG2      ARG 125 -11.277  -5.898  22.454
 1005    HG3  ARG 125           HG3      ARG 125 -11.030  -7.220  23.589
 1006    HD2  ARG 125           HD2      ARG 125 -13.723  -5.845  23.159
 1007    HD3  ARG 125           HD3      ARG 125 -13.179  -7.257  22.246
 1008    HE   ARG 125           HE       ARG 125 -13.109  -7.546  25.171
 1009   HH11  ARG 125          HH11      ARG 125 -15.186  -7.922  22.298
 1010   HH12  ARG 125          HH12      ARG 125 -16.032  -9.298  22.931
 1011   HH21  ARG 125          HH21      ARG 125 -14.373  -9.260  26.062
 1012   HH22  ARG 125          HH22      ARG 125 -15.636  -9.986  25.141
 1013    H    TRP 126           H        TRP 126  -9.585  -6.291  26.493
 1014    HA   TRP 126           HA       TRP 126  -7.434  -7.790  25.073
 1015    HB2  TRP 126           HB2      TRP 126  -7.612  -6.941  27.981
 1016    HB3  TRP 126           HB3      TRP 126  -6.604  -8.266  27.434
 1017    HD1  TRP 126           HD1      TRP 126  -6.836  -4.394  26.935
 1018    HE1  TRP 126           HE1      TRP 126  -4.489  -3.529  26.672
 1019    HE3  TRP 126           HE3      TRP 126  -4.390  -8.859  26.502
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.823  -4.599  26.251
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.959  -8.903  26.164
 1022    HH2  TRP 126           HH2      TRP 126  -0.637  -6.780  26.139
 1023    H    VAL 127           H        VAL 127  -7.624 -10.047  25.193
 1024    HA   VAL 127           HA       VAL 127 -10.045 -11.248  26.431
 1025    HB   VAL 127           HB       VAL 127 -10.402 -12.301  24.061
 1026   HG11  VAL 127          HG11      VAL 127 -11.909 -10.463  23.363
 1027   HG12  VAL 127          HG12      VAL 127 -12.034 -10.788  25.100
 1028   HG13  VAL 127          HG13      VAL 127 -11.123  -9.376  24.515
 1029   HG21  VAL 127          HG21      VAL 127  -9.850 -10.950  22.122
 1030   HG22  VAL 127          HG22      VAL 127  -8.957  -9.799  23.136
 1031   HG23  VAL 127          HG23      VAL 127  -8.388 -11.475  22.970
 1032    H    SER 128           H        SER 128 -10.017 -13.683  26.192
 1033    HA   SER 128           HA       SER 128  -7.363 -14.838  26.446
 1034    HB2  SER 128           HB2      SER 128 -10.075 -16.152  25.986
 1035    HB3  SER 128           HB3      SER 128  -8.607 -16.943  26.602
 1036    HG   SER 128           HG       SER 128 -10.051 -16.339  28.309
 1037    H    TYR 129           H        TYR 129  -6.402 -16.359  24.841
 1038    HA   TYR 129           HA       TYR 129  -6.348 -15.155  22.319
 1039    HB2  TYR 129           HB2      TYR 129  -5.130 -17.541  21.795
 1040    HB3  TYR 129           HB3      TYR 129  -4.381 -16.151  22.528
 1041    HD1  TYR 129           HD2      TYR 129  -6.307 -19.227  23.525
 1042    HD2  TYR 129           HD1      TYR 129  -3.205 -16.412  24.531
 1043    HE1  TYR 129           HE2      TYR 129  -5.866 -20.485  25.610
 1044    HE2  TYR 129           HE1      TYR 129  -2.729 -17.681  26.613
 1045    HH   TYR 129           HH       TYR 129  -4.621 -20.576  27.603
 1046    H    TRP 130           H        TRP 130  -8.379 -17.987  23.217
 1047    HA   TRP 130           HA       TRP 130  -8.829 -18.514  20.375
 1048    HB2  TRP 130           HB2      TRP 130 -10.107 -19.794  22.798
 1049    HB3  TRP 130           HB3      TRP 130 -10.241 -20.351  21.130
 1050    HD1  TRP 130           HD1      TRP 130  -8.540 -21.344  24.052
 1051    HE1  TRP 130           HE1      TRP 130  -6.277 -22.470  23.654
 1052    HE3  TRP 130           HE3      TRP 130  -7.822 -20.082  19.125
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.304 -22.602  21.586
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.734 -20.746  17.963
 1055    HH2  TRP 130           HH2      TRP 130  -3.937 -21.941  19.194
 1056    H    TYR 131           H        TYR 131 -10.547 -16.682  22.850
 1057    HA   TYR 131           HA       TYR 131 -13.122 -16.638  21.743
 1058    HB2  TYR 131           HB2      TYR 131 -12.735 -15.823  23.906
 1059    HB3  TYR 131           HB3      TYR 131 -11.579 -14.612  23.361
 1060    HD1  TYR 131           HD2      TYR 131 -12.348 -12.550  22.168
 1061    HD2  TYR 131           HD1      TYR 131 -15.152 -15.416  23.775
 1062    HE1  TYR 131           HE2      TYR 131 -14.151 -10.877  21.988
 1063    HE2  TYR 131           HE1      TYR 131 -16.957 -13.733  23.625
 1064    HH   TYR 131           HH       TYR 131 -17.538 -11.547  23.031
 1065    HA   PRO 132           HA       PRO 132 -12.093 -12.774  19.101
 1066    HB2  PRO 132           HB2      PRO 132  -9.526 -12.419  18.149
 1067    HB3  PRO 132           HB3      PRO 132 -10.160 -11.692  19.670
 1068    HG2  PRO 132           HG2      PRO 132  -8.521 -14.213  19.347
 1069    HG3  PRO 132           HG3      PRO 132  -8.257 -12.838  20.480
 1070    HD2  PRO 132           HD2      PRO 132  -9.532 -15.045  21.279
 1071    HD3  PRO 132           HD3      PRO 132 -10.134 -13.447  21.795
 1072    H    VAL 133           H        VAL 133 -10.351 -15.840  18.522
 1073    HA   VAL 133           HA       VAL 133 -10.579 -15.815  15.669
 1074    HB   VAL 133           HB       VAL 133 -10.466 -18.217  17.544
 1075   HG11  VAL 133          HG11      VAL 133  -9.503 -17.950  14.667
 1076   HG12  VAL 133          HG12      VAL 133  -9.411 -19.394  15.714
 1077   HG13  VAL 133          HG13      VAL 133 -10.978 -18.804  15.179
 1078   HG21  VAL 133          HG21      VAL 133  -8.168 -16.571  16.381
 1079   HG22  VAL 133          HG22      VAL 133  -8.580 -16.745  18.100
 1080   HG23  VAL 133          HG23      VAL 133  -7.995 -18.139  17.204
 1081    H    ARG 134           H        ARG 134 -12.902 -16.659  18.266
 1082    HA   ARG 134           HA       ARG 134 -14.794 -18.009  16.542
 1083    HB2  ARG 134           HB2      ARG 134 -15.620 -16.365  18.962
 1084    HB3  ARG 134           HB3      ARG 134 -16.338 -17.838  18.320
 1085    HG2  ARG 134           HG2      ARG 134 -13.716 -17.701  19.812
 1086    HG3  ARG 134           HG3      ARG 134 -15.264 -18.106  20.527
 1087    HD2  ARG 134           HD2      ARG 134 -14.040 -19.630  18.228
 1088    HD3  ARG 134           HD3      ARG 134 -13.748 -20.028  19.944
 1089    HE   ARG 134           HE       ARG 134 -16.534 -19.902  19.594
 1090   HH11  ARG 134          HH11      ARG 134 -13.865 -21.974  18.486
 1091   HH12  ARG 134          HH12      ARG 134 -14.858 -23.374  18.273
 1092   HH21  ARG 134          HH21      ARG 134 -17.855 -21.754  19.308
 1093   HH22  ARG 134          HH22      ARG 134 -17.177 -23.242  18.755
 1094    H    GLN 135           H        GLN 135 -14.001 -14.620  17.078
 1095    HA   GLN 135           HA       GLN 135 -16.649 -13.680  16.453
 1096    HB2  GLN 135           HB2      GLN 135 -14.084 -12.194  16.963
 1097    HB3  GLN 135           HB3      GLN 135 -15.649 -11.418  16.731
 1098    HG2  GLN 135           HG2      GLN 135 -15.067 -13.534  18.835
 1099    HG3  GLN 135           HG3      GLN 135 -15.010 -11.805  19.162
 1100   HE21  GLN 135          HE22      GLN 135 -16.686 -13.932  20.417
 1101   HE22  GLN 135          HE21      GLN 135 -18.343 -13.453  20.148
 1102    H    VAL 136           H        VAL 136 -13.784 -14.329  14.522
 1103    HA   VAL 136           HA       VAL 136 -14.603 -12.422  12.434
 1104    HB   VAL 136           HB       VAL 136 -12.425 -13.419  11.383
 1105   HG11  VAL 136          HG11      VAL 136 -11.134 -11.629  12.381
 1106   HG12  VAL 136          HG12      VAL 136 -12.773 -11.066  12.064
 1107   HG13  VAL 136          HG13      VAL 136 -12.308 -11.491  13.722
 1108   HG21  VAL 136          HG21      VAL 136 -10.707 -14.112  12.831
 1109   HG22  VAL 136          HG22      VAL 136 -11.671 -13.807  14.285
 1110   HG23  VAL 136          HG23      VAL 136 -12.084 -15.156  13.199
 1111    H    VAL 137           H        VAL 137 -14.688 -12.987  10.198
 1112    HA   VAL 137           HA       VAL 137 -16.461 -15.149   9.618
 1113    HB   VAL 137           HB       VAL 137 -16.500 -14.283   7.408
 1114   HG11  VAL 137          HG11      VAL 137 -17.385 -12.708   9.149
 1115   HG12  VAL 137          HG12      VAL 137 -15.851 -11.806   9.065
 1116   HG13  VAL 137          HG13      VAL 137 -16.889 -11.940   7.635
 1117   HG21  VAL 137          HG21      VAL 137 -14.708 -12.586   6.629
 1118   HG22  VAL 137          HG22      VAL 137 -13.705 -13.212   7.973
 1119   HG23  VAL 137          HG23      VAL 137 -14.275 -14.293   6.681
 1120    H    SER 138           H        SER 138 -15.871 -16.479   7.452
 1121    HA   SER 138           HA       SER 138 -14.360 -18.615   8.248
 1122    HB2  SER 138           HB2      SER 138 -14.953 -17.790   5.383
 1123    HB3  SER 138           HB3      SER 138 -14.747 -19.442   6.011
 1124    HG   SER 138           HG       SER 138 -16.969 -18.896   5.817
 1125    H    PHE 139           H        PHE 139 -13.281 -16.204   5.737
 1126    HA   PHE 139           HA       PHE 139 -10.786 -17.482   5.330
 1127    HB2  PHE 139           HB2      PHE 139 -11.282 -14.517   4.866
 1128    HB3  PHE 139           HB3      PHE 139 -10.188 -15.580   4.002
 1129    HD1  PHE 139           HD2      PHE 139 -11.279 -17.573   2.660
 1130    HD2  PHE 139           HD1      PHE 139 -13.439 -14.082   4.010
 1131    HE1  PHE 139           HE2      PHE 139 -13.082 -18.047   1.021
 1132    HE2  PHE 139           HE1      PHE 139 -15.266 -14.603   2.412
 1133    HZ   PHE 139           HZ       PHE 139 -15.088 -16.578   0.909
 1134    H    LYS 140           H        LYS 140 -11.693 -14.748   7.441
 1135    HA   LYS 140           HA       LYS 140  -8.958 -14.255   8.315
 1136    HB2  LYS 140           HB2      LYS 140 -11.659 -13.328   9.342
 1137    HB3  LYS 140           HB3      LYS 140 -10.130 -12.882  10.128
 1138    HG2  LYS 140           HG2      LYS 140  -9.302 -11.877   8.042
 1139    HG3  LYS 140           HG3      LYS 140 -10.806 -12.291   7.214
 1140    HD2  LYS 140           HD2      LYS 140 -10.607 -10.478   9.674
 1141    HD3  LYS 140           HD3      LYS 140 -10.700  -9.925   7.976
 1142    HE2  LYS 140           HE2      LYS 140 -12.887 -11.184   7.802
 1143    HE3  LYS 140           HE3      LYS 140 -12.795 -11.443   9.562
 1144    HZ1  LYS 140           HZ1      LYS 140 -14.144  -9.441   8.952
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.832  -8.978   9.822
 1146    HZ3  LYS 140           HZ3      LYS 140 -12.875  -8.774   8.192
 1147    H    ARG 141           H        ARG 141 -11.764 -16.042   9.809
 1148    HA   ARG 141           HA       ARG 141 -10.320 -16.585  12.183
 1149    HB2  ARG 141           HB2      ARG 141 -11.857 -18.215  12.793
 1150    HB3  ARG 141           HB3      ARG 141 -12.728 -16.921  11.981
 1151    HG2  ARG 141           HG2      ARG 141 -12.961 -18.308   9.968
 1152    HG3  ARG 141           HG3      ARG 141 -11.990 -19.590  10.699
 1153    HD2  ARG 141           HD2      ARG 141 -14.362 -20.111  10.850
 1154    HD3  ARG 141           HD3      ARG 141 -13.630 -19.905  12.460
 1155    HE   ARG 141           HE       ARG 141 -14.707 -17.402  11.734
 1156   HH11  ARG 141          HH11      ARG 141 -15.996 -20.657  12.431
 1157   HH12  ARG 141          HH12      ARG 141 -17.463 -20.059  13.119
 1158   HH21  ARG 141          HH21      ARG 141 -16.562 -16.638  12.674
 1159   HH22  ARG 141          HH22      ARG 141 -17.808 -17.699  13.258
 1160    H    ASP 142           H        ASP 142 -10.099 -18.359   9.068
 1161    HA   ASP 142           HA       ASP 142  -8.452 -20.432  10.144
 1162    HB2  ASP 142           HB2      ASP 142  -9.404 -20.635   7.909
 1163    HB3  ASP 142           HB3      ASP 142  -8.393 -19.293   7.334
 1164    H    VAL 143           H        VAL 143  -7.573 -17.239   8.738
 1165    HA   VAL 143           HA       VAL 143  -4.749 -17.559   9.131
 1166    HB   VAL 143           HB       VAL 143  -6.579 -15.136   8.863
 1167   HG11  VAL 143          HG11      VAL 143  -3.542 -15.128   8.846
 1168   HG12  VAL 143          HG12      VAL 143  -4.594 -13.761   8.426
 1169   HG13  VAL 143          HG13      VAL 143  -4.559 -14.360  10.090
 1170   HG21  VAL 143          HG21      VAL 143  -5.622 -15.016   6.599
 1171   HG22  VAL 143          HG22      VAL 143  -4.618 -16.446   6.928
 1172   HG23  VAL 143          HG23      VAL 143  -6.382 -16.584   6.862
 1173    H    TYR 144           H        TYR 144  -7.325 -16.173  11.201
 1174    HA   TYR 144           HA       TYR 144  -5.538 -15.196  13.186
 1175    HB2  TYR 144           HB2      TYR 144  -8.529 -15.668  13.069
 1176    HB3  TYR 144           HB3      TYR 144  -7.753 -15.070  14.507
 1177    HD1  TYR 144           HD1      TYR 144  -6.738 -13.944  11.018
 1178    HD2  TYR 144           HD2      TYR 144  -8.941 -13.003  14.609
 1179    HE1  TYR 144           HE1      TYR 144  -6.841 -11.619  10.318
 1180    HE2  TYR 144           HE2      TYR 144  -9.081 -10.649  13.854
 1181    HH   TYR 144           HH       TYR 144  -7.596  -9.453  10.837
 1182    H    ARG 145           H        ARG 145  -7.282 -18.362  12.922
 1183    HA   ARG 145           HA       ARG 145  -6.355 -19.219  15.521
 1184    HB2  ARG 145           HB2      ARG 145  -7.296 -21.265  15.083
 1185    HB3  ARG 145           HB3      ARG 145  -8.224 -20.223  14.024
 1186    HG2  ARG 145           HG2      ARG 145  -6.377 -20.969  12.245
 1187    HG3  ARG 145           HG3      ARG 145  -6.198 -22.349  13.332
 1188    HD2  ARG 145           HD2      ARG 145  -8.654 -22.762  13.071
 1189    HD3  ARG 145           HD3      ARG 145  -8.747 -21.301  12.070
 1190    HE   ARG 145           HE       ARG 145  -7.633 -22.355  10.287
 1191   HH11  ARG 145          HH11      ARG 145  -7.945 -24.725  12.948
 1192   HH12  ARG 145          HH12      ARG 145  -7.651 -26.067  11.906
 1193   HH21  ARG 145          HH21      ARG 145  -7.304 -23.994   9.010
 1194   HH22  ARG 145          HH22      ARG 145  -7.267 -25.662   9.554
 1195    H    ARG 146           H        ARG 146  -4.893 -19.448  12.203
 1196    HA   ARG 146           HA       ARG 146  -2.574 -20.844  13.069
 1197    HB2  ARG 146           HB2      ARG 146  -3.272 -19.090  10.679
 1198    HB3  ARG 146           HB3      ARG 146  -1.574 -19.355  11.061
 1199    HG2  ARG 146           HG2      ARG 146  -1.997 -21.046   9.574
 1200    HG3  ARG 146           HG3      ARG 146  -2.105 -21.847  11.141
 1201    HD2  ARG 146           HD2      ARG 146  -4.636 -21.625  10.946
 1202    HD3  ARG 146           HD3      ARG 146  -4.375 -21.051   9.290
 1203    HE   ARG 146           HE       ARG 146  -3.557 -23.722  10.392
 1204   HH11  ARG 146          HH11      ARG 146  -5.000 -21.991   7.606
 1205   HH12  ARG 146          HH12      ARG 146  -4.524 -23.202   6.474
 1206   HH21  ARG 146          HH21      ARG 146  -3.140 -25.395   8.892
 1207   HH22  ARG 146          HH22      ARG 146  -3.608 -25.228   7.244
 1208    H    VAL 147           H        VAL 147  -3.152 -17.253  12.957
 1209    HA   VAL 147           HA       VAL 147  -0.675 -16.496  13.974
 1210    HB   VAL 147           HB       VAL 147  -3.395 -15.206  14.514
 1211   HG11  VAL 147          HG11      VAL 147  -1.687 -14.303  16.069
 1212   HG12  VAL 147          HG12      VAL 147  -0.602 -13.998  14.701
 1213   HG13  VAL 147          HG13      VAL 147  -2.134 -13.107  14.849
 1214   HG21  VAL 147          HG21      VAL 147  -1.277 -14.702  12.399
 1215   HG22  VAL 147          HG22      VAL 147  -2.907 -15.309  12.103
 1216   HG23  VAL 147          HG23      VAL 147  -2.709 -13.668  12.674
 1217    H    MET 148           H        MET 148  -3.556 -17.606  15.781
 1218    HA   MET 148           HA       MET 148  -2.408 -16.987  18.318
 1219    HB2  MET 148           HB2      MET 148  -4.797 -18.679  17.567
 1220    HB3  MET 148           HB3      MET 148  -4.295 -18.380  19.240
 1221    HG2  MET 148           HG2      MET 148  -5.091 -16.217  17.256
 1222    HG3  MET 148           HG3      MET 148  -6.113 -16.916  18.495
 1223    HE1  MET 148           HE1      MET 148  -3.381 -13.400  18.887
 1224    HE2  MET 148           HE2      MET 148  -2.418 -14.823  18.433
 1225    HE3  MET 148           HE3      MET 148  -3.803 -14.313  17.433
 1226    H    LYS 149           H        LYS 149  -2.831 -20.161  16.593
 1227    HA   LYS 149           HA       LYS 149  -1.402 -21.617  18.610
 1228    HB2  LYS 149           HB2      LYS 149  -2.848 -22.759  17.340
 1229    HB3  LYS 149           HB3      LYS 149  -2.263 -22.158  15.787
 1230    HG2  LYS 149           HG2      LYS 149  -0.732 -24.119  17.553
 1231    HG3  LYS 149           HG3      LYS 149  -1.867 -24.574  16.277
 1232    HD2  LYS 149           HD2      LYS 149  -0.374 -23.040  14.738
 1233    HD3  LYS 149           HD3      LYS 149   0.856 -23.279  15.973
 1234    HE2  LYS 149           HE2      LYS 149  -0.614 -25.489  14.462
 1235    HE3  LYS 149           HE3      LYS 149   1.000 -24.884  14.069
 1236    HZ1  LYS 149           HZ1      LYS 149   0.276 -26.277  16.602
 1237    HZ2  LYS 149           HZ2      LYS 149   1.141 -26.902  15.370
 1238    HZ3  LYS 149           HZ3      LYS 149   1.765 -25.677  16.250
 1239    H    GLU 150           H        GLU 150  -0.187 -19.887  15.720
 1240    HA   GLU 150           HA       GLU 150   2.433 -20.716  15.662
 1241    HB2  GLU 150           HB2      GLU 150   0.907 -18.199  15.083
 1242    HB3  GLU 150           HB3      GLU 150   2.642 -18.018  15.176
 1243    HG2  GLU 150           HG2      GLU 150   1.481 -20.178  13.454
 1244    HG3  GLU 150           HG3      GLU 150   1.519 -18.481  12.944
 1245    H    PHE 151           H        PHE 151   0.904 -18.362  17.822
 1246    HA   PHE 151           HA       PHE 151   3.500 -17.855  19.190
 1247    HB2  PHE 151           HB2      PHE 151   0.937 -16.250  19.256
 1248    HB3  PHE 151           HB3      PHE 151   2.521 -15.773  19.833
 1249    HD1  PHE 151           HD1      PHE 151   3.930 -16.913  16.987
 1250    HD2  PHE 151           HD2      PHE 151   0.826 -14.073  18.102
 1251    HE1  PHE 151           HE1      PHE 151   4.084 -15.870  14.864
 1252    HE2  PHE 151           HE2      PHE 151   1.186 -12.895  15.982
 1253    HZ   PHE 151           HZ       PHE 151   2.805 -13.824  14.325
 1254    H    ALA 152           H        ALA 152   0.525 -19.508  19.726
 1255    HA   ALA 152           HA       ALA 152  -0.194 -18.937  22.314
 1256    HB1  ALA 152           HB1      ALA 152  -1.177 -21.270  22.306
 1257    HB2  ALA 152           HB2      ALA 152  -1.538 -20.391  20.812
 1258    HB3  ALA 152           HB3      ALA 152  -0.271 -21.622  20.818
 1259    H    SER 153           H        SER 153   2.326 -21.150  21.203
 1260    HA   SER 153           HA       SER 153   2.811 -22.372  23.750
 1261    HB2  SER 153           HB2      SER 153   4.698 -22.167  21.371
 1262    HB3  SER 153           HB3      SER 153   4.704 -23.405  22.645
 1263    HG   SER 153           HG       SER 153   3.667 -24.171  20.742
 1264    H    VAL 154           H        VAL 154   4.003 -19.462  22.112
 1265    HA   VAL 154           HA       VAL 154   6.148 -18.961  24.009
 1266    HB   VAL 154           HB       VAL 154   4.728 -16.984  22.181
 1267   HG11  VAL 154          HG11      VAL 154   6.797 -15.710  22.318
 1268   HG12  VAL 154          HG12      VAL 154   6.095 -15.912  23.926
 1269   HG13  VAL 154          HG13      VAL 154   7.496 -16.904  23.434
 1270   HG21  VAL 154          HG21      VAL 154   7.072 -18.844  21.622
 1271   HG22  VAL 154          HG22      VAL 154   5.548 -18.716  20.715
 1272   HG23  VAL 154          HG23      VAL 154   6.730 -17.410  20.647
 1273    H    VAL 155           H        VAL 155   2.733 -17.939  23.608
 1274    HA   VAL 155           HA       VAL 155   2.675 -16.109  25.720
 1275    HB   VAL 155           HB       VAL 155   0.391 -17.820  24.715
 1276   HG11  VAL 155          HG11      VAL 155  -1.002 -15.901  25.669
 1277   HG12  VAL 155          HG12      VAL 155  -0.221 -16.902  26.895
 1278   HG13  VAL 155          HG13      VAL 155   0.478 -15.319  26.482
 1279   HG21  VAL 155          HG21      VAL 155   1.442 -16.293  22.998
 1280   HG22  VAL 155          HG22      VAL 155  -0.167 -15.731  23.445
 1281   HG23  VAL 155          HG23      VAL 155   1.269 -14.940  24.144
 1282    H    MET 156           H        MET 156   2.276 -19.691  25.967
 1283    HA   MET 156           HA       MET 156   1.493 -19.699  28.637
 1284    HB2  MET 156           HB2      MET 156   3.379 -21.692  27.237
 1285    HB3  MET 156           HB3      MET 156   2.446 -22.031  28.698
 1286    HG2  MET 156           HG2      MET 156   1.403 -21.575  25.895
 1287    HG3  MET 156           HG3      MET 156   1.344 -23.067  26.811
 1288    HE1  MET 156           HE1      MET 156  -2.314 -21.367  26.065
 1289    HE2  MET 156           HE2      MET 156  -0.879 -20.654  25.309
 1290    HE3  MET 156           HE3      MET 156  -1.078 -22.422  25.344
 1291    H    SER 157           H        SER 157   4.760 -20.124  27.317
 1292    HA   SER 157           HA       SER 157   6.094 -20.162  29.822
 1293    HB2  SER 157           HB2      SER 157   6.837 -19.898  26.903
 1294    HB3  SER 157           HB3      SER 157   8.097 -19.991  28.187
 1295    HG   SER 157           HG       SER 157   7.557 -22.063  27.304
 1296    H    LEU 158           H        LEU 158   5.232 -17.589  27.645
 1297    HA   LEU 158           HA       LEU 158   6.638 -15.333  28.567
 1298    HB2  LEU 158           HB2      LEU 158   5.521 -15.415  26.552
 1299    HB3  LEU 158           HB3      LEU 158   4.025 -15.904  27.282
 1300    HG   LEU 158           HG       LEU 158   4.040 -13.822  26.284
 1301   HD11  LEU 158          HD11      LEU 158   3.312 -13.514  29.207
 1302   HD12  LEU 158          HD12      LEU 158   2.604 -12.656  27.813
 1303   HD13  LEU 158          HD13      LEU 158   2.339 -14.382  28.006
 1304   HD21  LEU 158          HD21      LEU 158   6.302 -13.050  27.003
 1305   HD22  LEU 158          HD22      LEU 158   5.001 -11.855  27.067
 1306   HD23  LEU 158          HD23      LEU 158   5.598 -12.617  28.581
 1307    H    GLN 159           H        GLN 159   3.739 -16.970  29.932
 1308    HA   GLN 159           HA       GLN 159   3.321 -14.891  31.924
 1309    HB2  GLN 159           HB2      GLN 159   2.458 -17.816  32.119
 1310    HB3  GLN 159           HB3      GLN 159   1.822 -16.445  33.009
 1311    HG2  GLN 159           HG2      GLN 159   1.047 -15.515  30.704
 1312    HG3  GLN 159           HG3      GLN 159   1.454 -17.143  30.092
 1313   HE21  GLN 159          HE22      GLN 159  -0.342 -15.835  32.958
 1314   HE22  GLN 159          HE21      GLN 159  -1.664 -16.994  32.823
 1315    H    GLU 160           H        GLU 160   5.091 -17.947  31.816
 1316    HA   GLU 160           HA       GLU 160   5.573 -18.004  34.627
 1317    HB2  GLU 160           HB2      GLU 160   6.727 -19.663  32.350
 1318    HB3  GLU 160           HB3      GLU 160   6.975 -19.998  34.067
 1319    HG2  GLU 160           HG2      GLU 160   4.474 -20.162  34.348
 1320    HG3  GLU 160           HG3      GLU 160   4.304 -19.993  32.600
 1321    H    ASN 161           H        ASN 161   7.373 -16.781  31.890
 1322    HA   ASN 161           HA       ASN 161   9.833 -16.440  33.588
 1323    HB2  ASN 161           HB2      ASN 161   9.513 -16.668  30.564
 1324    HB3  ASN 161           HB3      ASN 161  11.021 -16.292  31.387
 1325   HD21  ASN 161          HD22      ASN 161   8.607 -18.830  30.838
 1326   HD22  ASN 161          HD21      ASN 161   9.623 -20.160  31.385
 1327    H    THR 162           H        THR 162   7.265 -14.612  32.330
 1328    HA   THR 162           HA       THR 162   6.893 -12.552  31.664
 1329    HB   THR 162           HB       THR 162   7.124 -11.117  33.429
 1330    HG1  THR 162           HG1      THR 162   9.338 -10.871  33.686
 1331   HG21  THR 162          HG21      THR 162   7.693 -13.756  34.802
 1332   HG22  THR 162          HG22      THR 162   6.785 -12.364  35.449
 1333   HG23  THR 162          HG23      THR 162   6.124 -13.317  34.111
 1334    HA   PRO 163           HA       PRO 163  11.225 -13.117  29.481
 1335    HB2  PRO 163           HB2      PRO 163   9.370 -11.514  27.677
 1336    HB3  PRO 163           HB3      PRO 163  10.844 -12.436  27.171
 1337    HG2  PRO 163           HG2      PRO 163   8.427 -13.703  27.271
 1338    HG3  PRO 163           HG3      PRO 163   9.907 -14.505  27.858
 1339    HD2  PRO 163           HD2      PRO 163   7.654 -13.425  29.466
 1340    HD3  PRO 163           HD3      PRO 163   8.908 -14.631  29.896
 1341    H    LYS 164           H        LYS 164  11.428 -11.750  31.545
 1342    HA   LYS 164           HA       LYS 164  12.522 -10.230  32.617
 1343    HB2  LYS 164           HB2      LYS 164  14.408 -10.086  30.240
 1344    HB3  LYS 164           HB3      LYS 164  14.823  -9.923  31.942
 1345    HG2  LYS 164           HG2      LYS 164  13.948 -12.464  30.491
 1346    HG3  LYS 164           HG3      LYS 164  15.579 -12.051  31.009
 1347    HD2  LYS 164           HD2      LYS 164  14.939 -12.209  33.381
 1348    HD3  LYS 164           HD3      LYS 164  13.245 -12.437  32.940
 1349    HE2  LYS 164           HE2      LYS 164  14.068 -14.584  33.487
 1350    HE3  LYS 164           HE3      LYS 164  13.823 -14.543  31.741
 1351    HZ1  LYS 164           HZ1      LYS 164  16.234 -14.255  31.477
 1352    HZ2  LYS 164           HZ2      LYS 164  16.453 -14.235  33.104
 1353    HZ3  LYS 164           HZ3      LYS 164  15.931 -15.592  32.367
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1   0.662  -0.189  -1.076
    2    H2   MET   1           H2       MET   1   1.223   1.246  -1.657
    3    H3   MET   1           H3       MET   1  -0.157   0.596  -2.247
    4    HA   MET   1           HA       MET   1   1.576   0.285  -3.842
    5    HB2  MET   1           HB2      MET   1   3.580  -0.924  -3.415
    6    HB3  MET   1           HB3      MET   1   3.486   0.322  -2.192
    7    HG2  MET   1           HG2      MET   1   3.033  -1.230  -0.463
    8    HG3  MET   1           HG3      MET   1   2.544  -2.510  -1.565
    9    HE1  MET   1           HE1      MET   1   5.854  -4.010  -2.888
   10    HE2  MET   1           HE2      MET   1   4.084  -4.130  -2.845
   11    HE3  MET   1           HE3      MET   1   4.871  -2.812  -3.743
   12    H    ILE   2           H        ILE   2   1.831  -1.723  -5.149
   13    HA   ILE   2           HA       ILE   2   0.448  -4.146  -4.139
   14    HB   ILE   2           HB       ILE   2   0.042  -2.878  -6.862
   15   HG12  ILE   2          HG12      ILE   2  -1.482  -2.844  -4.381
   16   HG13  ILE   2          HG13      ILE   2  -1.689  -1.901  -5.856
   17   HG21  ILE   2          HG21      ILE   2   0.339  -5.326  -7.101
   18   HG22  ILE   2          HG22      ILE   2  -0.944  -5.577  -5.887
   19   HG23  ILE   2          HG23      ILE   2  -1.304  -4.817  -7.457
   20   HD11  ILE   2          HD11      ILE   2  -2.886  -4.583  -5.110
   21   HD12  ILE   2          HD12      ILE   2  -3.713  -3.014  -5.227
   22   HD13  ILE   2          HD13      ILE   2  -3.157  -3.786  -6.711
   23    H    ASP   3           H        ASP   3   1.589  -6.043  -4.794
   24    HA   ASP   3           HA       ASP   3   4.383  -5.598  -4.968
   25    HB2  ASP   3           HB2      ASP   3   3.428  -7.480  -3.735
   26    HB3  ASP   3           HB3      ASP   3   2.808  -8.153  -5.252
   27    H    ASP   4           H        ASP   4   2.418  -7.605  -7.158
   28    HA   ASP   4           HA       ASP   4   3.326  -6.279  -9.518
   29    HB2  ASP   4           HB2      ASP   4   5.351  -7.619  -9.118
   30    HB3  ASP   4           HB3      ASP   4   4.364  -9.064  -8.907
   31    H    ASP   5           H        ASP   5   2.132  -9.408  -8.329
   32    HA   ASP   5           HA       ASP   5   0.493  -9.756 -10.683
   33    HB2  ASP   5           HB2      ASP   5   2.025 -11.508  -9.793
   34    HB3  ASP   5           HB3      ASP   5   0.946 -11.694  -8.412
   35    H    GLY   6           H        GLY   6  -0.244  -7.848  -8.457
   36    HA2  GLY   6           HA2      GLY   6  -2.350  -6.957  -7.975
   37    HA3  GLY   6           HA3      GLY   6  -3.123  -8.475  -8.414
   38    H    TYR   7           H        TYR   7  -0.522  -9.021  -6.237
   39    HA   TYR   7           HA       TYR   7  -2.370  -9.008  -3.906
   40    HB2  TYR   7           HB2      TYR   7   0.295 -10.447  -4.106
   41    HB3  TYR   7           HB3      TYR   7  -0.847 -10.479  -2.762
   42    HD1  TYR   7           HD1      TYR   7  -0.518 -11.431  -6.396
   43    HD2  TYR   7           HD2      TYR   7  -2.404 -12.264  -2.602
   44    HE1  TYR   7           HE1      TYR   7  -1.546 -13.436  -7.357
   45    HE2  TYR   7           HE2      TYR   7  -3.459 -14.259  -3.568
   46    HH   TYR   7           HH       TYR   7  -2.928 -15.285  -6.987
   47    H    ARG   8           H        ARG   8  -1.414  -8.044  -1.884
   48    HA   ARG   8           HA       ARG   8   1.002  -6.403  -2.410
   49    HB2  ARG   8           HB2      ARG   8   0.060  -4.482  -1.219
   50    HB3  ARG   8           HB3      ARG   8  -0.810  -4.853  -2.714
   51    HG2  ARG   8           HG2      ARG   8  -1.981  -5.993  -0.185
   52    HG3  ARG   8           HG3      ARG   8  -2.011  -4.238  -0.386
   53    HD2  ARG   8           HD2      ARG   8  -2.975  -4.603  -2.721
   54    HD3  ARG   8           HD3      ARG   8  -3.175  -6.299  -2.297
   55    HE   ARG   8           HE       ARG   8  -4.893  -5.807  -0.840
   56   HH11  ARG   8          HH21      ARG   8  -3.432  -2.705  -1.847
   57   HH12  ARG   8          HH22      ARG   8  -4.755  -1.755  -1.285
   58   HH21  ARG   8          HH11      ARG   8  -6.631  -4.501  -0.066
   59   HH22  ARG   8          HH12      ARG   8  -6.581  -2.786  -0.239
   60    HA   PRO   9           HA       PRO   9   2.227  -8.395   1.246
   61    HB2  PRO   9           HB2      PRO   9   4.540  -7.153   1.885
   62    HB3  PRO   9           HB3      PRO   9   4.314  -7.973   0.321
   63    HG2  PRO   9           HG2      PRO   9   4.013  -5.001   0.896
   64    HG3  PRO   9           HG3      PRO   9   4.975  -5.784  -0.396
   65    HD2  PRO   9           HD2      PRO   9   2.426  -4.831  -0.749
   66    HD3  PRO   9           HD3      PRO   9   3.067  -6.246  -1.635
   67    H    ASN  10           H        ASN  10   1.806  -8.453   3.467
   68    HA   ASN  10           HA       ASN  10   1.142  -5.906   4.883
   69    HB2  ASN  10           HB2      ASN  10  -0.900  -6.756   3.825
   70    HB3  ASN  10           HB3      ASN  10  -0.569  -8.368   4.445
   71   HD21  ASN  10          HD22      ASN  10  -1.858  -5.173   5.252
   72   HD22  ASN  10          HD21      ASN  10  -2.438  -5.627   6.835
   73    H    VAL  11           H        VAL  11   1.139  -6.105   7.202
   74    HA   VAL  11           HA       VAL  11   2.066  -8.642   8.284
   75    HB   VAL  11           HB       VAL  11   3.788  -7.648   9.712
   76   HG11  VAL  11          HG11      VAL  11   5.521  -7.111   8.026
   77   HG12  VAL  11          HG12      VAL  11   4.689  -8.667   7.928
   78   HG13  VAL  11          HG13      VAL  11   4.234  -7.376   6.816
   79   HG21  VAL  11          HG21      VAL  11   3.000  -5.310   9.859
   80   HG22  VAL  11          HG22      VAL  11   4.668  -5.413   9.304
   81   HG23  VAL  11          HG23      VAL  11   3.381  -5.073   8.129
   82    H    GLY  12           H        GLY  12   1.536  -8.908  10.558
   83    HA2  GLY  12           HA2      GLY  12  -0.136  -6.769  11.759
   84    HA3  GLY  12           HA3      GLY  12  -0.809  -8.382  11.603
   85    H    ILE  13           H        ILE  13  -0.412  -6.992  14.074
   86    HA   ILE  13           HA       ILE  13   1.806  -8.510  15.321
   87    HB   ILE  13           HB       ILE  13   0.834  -5.736  16.141
   88   HG12  ILE  13          HG12      ILE  13   3.379  -5.259  15.358
   89   HG13  ILE  13          HG13      ILE  13   2.999  -6.529  14.195
   90   HG21  ILE  13          HG21      ILE  13   3.022  -5.863  17.448
   91   HG22  ILE  13          HG22      ILE  13   1.770  -6.988  17.949
   92   HG23  ILE  13          HG23      ILE  13   3.132  -7.559  16.938
   93   HD11  ILE  13          HD11      ILE  13   2.578  -4.275  13.279
   94   HD12  ILE  13          HD12      ILE  13   1.053  -5.165  13.389
   95   HD13  ILE  13          HD13      ILE  13   1.443  -3.926  14.599
   96    H    VAL  14           H        VAL  14   1.345  -9.536  17.191
   97    HA   VAL  14           HA       VAL  14  -1.326  -9.161  18.478
   98    HB   VAL  14           HB       VAL  14   0.386 -11.686  18.523
   99   HG11  VAL  14          HG11      VAL  14  -1.624 -12.755  19.405
  100   HG12  VAL  14          HG12      VAL  14  -1.214 -11.379  20.410
  101   HG13  VAL  14          HG13      VAL  14  -2.551 -11.242  19.246
  102   HG21  VAL  14          HG21      VAL  14  -0.272 -11.418  16.191
  103   HG22  VAL  14          HG22      VAL  14  -1.209 -12.708  16.950
  104   HG23  VAL  14          HG23      VAL  14  -1.962 -11.117  16.674
  105    H    ILE  15           H        ILE  15  -1.147  -8.715  20.743
  106    HA   ILE  15           HA       ILE  15   1.558  -9.006  21.881
  107    HB   ILE  15           HB       ILE  15  -0.256  -6.875  23.056
  108   HG12  ILE  15          HG12      ILE  15   0.127  -6.203  20.643
  109   HG13  ILE  15          HG13      ILE  15   0.795  -5.125  21.862
  110   HG21  ILE  15          HG21      ILE  15   1.965  -6.085  23.796
  111   HG22  ILE  15          HG22      ILE  15   1.483  -7.664  24.455
  112   HG23  ILE  15          HG23      ILE  15   2.700  -7.536  23.151
  113   HD11  ILE  15          HD11      ILE  15   2.464  -7.227  20.436
  114   HD12  ILE  15          HD12      ILE  15   2.321  -5.527  19.916
  115   HD13  ILE  15          HD13      ILE  15   3.034  -5.910  21.497
  116    H    CYS  16           H        CYS  16   1.631 -10.333  23.670
  117    HA   CYS  16           HA       CYS  16  -1.001 -11.058  24.872
  118    HB2  CYS  16           HB2      CYS  16   1.311 -12.976  24.374
  119    HB3  CYS  16           HB3      CYS  16  -0.207 -13.354  25.209
  120    HG   CYS  16           HG       CYS  16  -0.296 -14.348  22.758
  121    H    ASN  17           H        ASN  17  -1.080 -11.418  27.047
  122    HA   ASN  17           HA       ASN  17   1.212 -10.389  28.642
  123    HB2  ASN  17           HB2      ASN  17  -0.310  -9.733  30.310
  124    HB3  ASN  17           HB3      ASN  17  -1.019  -9.203  28.799
  125   HD21  ASN  17          HD22      ASN  17  -2.858  -9.085  30.555
  126   HD22  ASN  17          HD21      ASN  17  -3.861 -10.515  30.673
  127    H    ARG  18           H        ARG  18   1.179 -11.632  30.967
  128    HA   ARG  18           HA       ARG  18   1.722 -14.409  30.187
  129    HB2  ARG  18           HB2      ARG  18   2.131 -12.954  32.815
  130    HB3  ARG  18           HB3      ARG  18   2.564 -14.632  32.530
  131    HG2  ARG  18           HG2      ARG  18   4.542 -13.915  31.900
  132    HG3  ARG  18           HG3      ARG  18   3.773 -13.550  30.365
  133    HD2  ARG  18           HD2      ARG  18   5.172 -11.676  31.211
  134    HD3  ARG  18           HD3      ARG  18   3.449 -11.230  31.054
  135    HE   ARG  18           HE       ARG  18   4.093 -12.258  33.674
  136   HH11  ARG  18          HH11      ARG  18   4.645  -9.282  31.815
  137   HH12  ARG  18          HH12      ARG  18   4.331  -8.218  33.139
  138   HH21  ARG  18          HH21      ARG  18   3.536 -10.837  35.429
  139   HH22  ARG  18          HH22      ARG  18   3.789  -9.130  35.262
  140    H    GLN  19           H        GLN  19  -1.152 -13.151  30.760
  141    HA   GLN  19           HA       GLN  19  -2.078 -15.400  32.424
  142    HB2  GLN  19           HB2      GLN  19  -3.833 -13.135  31.457
  143    HB3  GLN  19           HB3      GLN  19  -4.094 -14.207  32.830
  144    HG2  GLN  19           HG2      GLN  19  -2.116 -11.911  32.585
  145    HG3  GLN  19           HG3      GLN  19  -3.557 -11.962  33.577
  146   HE21  GLN  19          HE22      GLN  19  -1.004 -11.293  34.632
  147   HE22  GLN  19          HE21      GLN  19  -0.480 -12.543  35.740
  148    H    GLY  20           H        GLY  20  -1.399 -14.840  29.217
  149    HA2  GLY  20           HA2      GLY  20  -2.023 -15.986  27.333
  150    HA3  GLY  20           HA3      GLY  20  -3.228 -16.895  28.254
  151    H    GLN  21           H        GLN  21  -3.255 -13.333  28.449
  152    HA   GLN  21           HA       GLN  21  -5.683 -13.305  26.713
  153    HB2  GLN  21           HB2      GLN  21  -4.644 -11.131  28.552
  154    HB3  GLN  21           HB3      GLN  21  -6.108 -11.085  27.583
  155    HG2  GLN  21           HG2      GLN  21  -5.631 -13.052  29.863
  156    HG3  GLN  21           HG3      GLN  21  -6.533 -11.550  29.992
  157   HE21  GLN  21          HE22      GLN  21  -6.716 -14.906  28.979
  158   HE22  GLN  21          HE21      GLN  21  -8.351 -14.841  28.346
  159    H    VAL  22           H        VAL  22  -5.663 -12.096  24.858
  160    HA   VAL  22           HA       VAL  22  -3.068 -10.987  23.953
  161    HB   VAL  22           HB       VAL  22  -3.417 -11.765  21.828
  162   HG11  VAL  22          HG11      VAL  22  -3.114 -13.650  23.602
  163   HG12  VAL  22          HG12      VAL  22  -4.795 -14.047  23.294
  164   HG13  VAL  22          HG13      VAL  22  -3.616 -14.110  21.955
  165   HG21  VAL  22          HG21      VAL  22  -6.354 -12.388  22.390
  166   HG22  VAL  22          HG22      VAL  22  -5.729 -11.060  21.383
  167   HG23  VAL  22          HG23      VAL  22  -5.462 -12.730  20.881
  168    H    MET  23           H        MET  23  -3.147  -8.887  22.983
  169    HA   MET  23           HA       MET  23  -5.549  -7.357  23.713
  170    HB2  MET  23           HB2      MET  23  -4.331  -5.432  23.454
  171    HB3  MET  23           HB3      MET  23  -3.181  -6.587  24.099
  172    HG2  MET  23           HG2      MET  23  -1.925  -5.529  22.495
  173    HG3  MET  23           HG3      MET  23  -2.456  -6.971  21.640
  174    HE1  MET  23           HE1      MET  23  -2.432  -3.172  22.008
  175    HE2  MET  23           HE2      MET  23  -3.752  -2.591  20.947
  176    HE3  MET  23           HE3      MET  23  -4.134  -3.419  22.467
  177    H    TRP  24           H        TRP  24  -6.906  -6.249  22.266
  178    HA   TRP  24           HA       TRP  24  -6.833  -6.927  19.384
  179    HB2  TRP  24           HB2      TRP  24  -7.847  -8.791  20.759
  180    HB3  TRP  24           HB3      TRP  24  -9.014  -7.643  21.387
  181    HD1  TRP  24           HD1      TRP  24  -8.024  -8.389  17.690
  182    HE1  TRP  24           HE1      TRP  24 -10.109  -9.227  16.456
  183    HE3  TRP  24           HE3      TRP  24 -11.300  -8.412  21.592
  184    HZ2  TRP  24           HZ2      TRP  24 -12.804 -10.001  17.126
  185    HZ3  TRP  24           HZ3      TRP  24 -13.621  -9.236  21.290
  186    HH2  TRP  24           HH2      TRP  24 -14.375 -10.030  19.077
  187    H    ALA  25           H        ALA  25  -8.064  -5.236  18.194
  188    HA   ALA  25           HA       ALA  25  -8.987  -2.998  19.941
  189    HB1  ALA  25           HB1      ALA  25  -6.626  -2.652  19.302
  190    HB2  ALA  25           HB2      ALA  25  -7.090  -2.765  17.595
  191    HB3  ALA  25           HB3      ALA  25  -7.697  -1.433  18.614
  192    H    ARG  26           H        ARG  26 -10.438  -1.504  19.052
  193    HA   ARG  26           HA       ARG  26 -12.197  -2.616  16.939
  194    HB2  ARG  26           HB2      ARG  26 -13.123  -2.215  19.225
  195    HB3  ARG  26           HB3      ARG  26 -12.802  -0.492  19.048
  196    HG2  ARG  26           HG2      ARG  26 -14.417  -0.300  17.241
  197    HG3  ARG  26           HG3      ARG  26 -14.495  -2.056  17.067
  198    HD2  ARG  26           HD2      ARG  26 -16.505  -1.432  18.165
  199    HD3  ARG  26           HD3      ARG  26 -15.474  -2.226  19.358
  200    HE   ARG  26           HE       ARG  26 -15.200   0.681  19.396
  201   HH11  ARG  26          HH11      ARG  26 -17.355  -1.941  20.550
  202   HH12  ARG  26          HH12      ARG  26 -17.943  -1.003  21.871
  203   HH21  ARG  26          HH21      ARG  26 -16.004   1.852  20.995
  204   HH22  ARG  26          HH22      ARG  26 -17.148   1.236  22.179
  205    H    ARG  27           H        ARG  27 -12.089  -1.493  14.853
  206    HA   ARG  27           HA       ARG  27 -10.116   0.692  14.934
  207    HB2  ARG  27           HB2      ARG  27  -9.901  -1.202  13.350
  208    HB3  ARG  27           HB3      ARG  27 -11.296  -0.603  12.465
  209    HG2  ARG  27           HG2      ARG  27 -10.084   1.596  12.150
  210    HG3  ARG  27           HG3      ARG  27  -8.744   0.931  13.096
  211    HD2  ARG  27           HD2      ARG  27  -8.650  -0.896  11.217
  212    HD3  ARG  27           HD3      ARG  27  -9.565   0.281  10.276
  213    HE   ARG  27           HE       ARG  27  -7.759   1.797  10.371
  214   HH11  ARG  27          HH11      ARG  27  -6.795  -1.334  11.913
  215   HH12  ARG  27          HH12      ARG  27  -5.211  -0.735  12.317
  216   HH21  ARG  27          HH21      ARG  27  -5.659   2.517  11.079
  217   HH22  ARG  27          HH22      ARG  27  -4.577   1.324  11.774
  218    H    PHE  28           H        PHE  28 -10.402   2.789  14.160
  219    HA   PHE  28           HA       PHE  28 -12.745   3.938  15.186
  220    HB2  PHE  28           HB2      PHE  28 -10.546   5.037  15.062
  221    HB3  PHE  28           HB3      PHE  28 -10.654   5.100  13.312
  222    HD1  PHE  28           HD2      PHE  28 -12.545   6.176  16.410
  223    HD2  PHE  28           HD1      PHE  28 -11.435   7.107  12.340
  224    HE1  PHE  28           HE2      PHE  28 -13.613   8.400  16.617
  225    HE2  PHE  28           HE1      PHE  28 -12.496   9.333  12.563
  226    HZ   PHE  28           HZ       PHE  28 -13.589   9.988  14.699
  227    H    GLY  29           H        GLY  29 -14.643   4.525  14.349
  228    HA2  GLY  29           HA2      GLY  29 -16.344   4.926  12.887
  229    HA3  GLY  29           HA3      GLY  29 -15.194   4.859  11.549
  230    H    GLN  30           H        GLN  30 -14.618   1.911  12.938
  231    HA   GLN  30           HA       GLN  30 -16.371   0.639  10.932
  232    HB2  GLN  30           HB2      GLN  30 -14.349  -0.763  12.704
  233    HB3  GLN  30           HB3      GLN  30 -15.042  -1.305  11.179
  234    HG2  GLN  30           HG2      GLN  30 -12.963   0.830  11.671
  235    HG3  GLN  30           HG3      GLN  30 -12.786  -0.692  10.822
  236   HE21  GLN  30          HE22      GLN  30 -13.204   2.656  10.339
  237   HE22  GLN  30          HE21      GLN  30 -13.772   2.600   8.680
  238    H    HIS  31           H        HIS  31 -15.855   0.661  14.437
  239    HA   HIS  31           HA       HIS  31 -16.789  -0.425  16.166
  240    HB2  HIS  31           HB2      HIS  31 -19.369  -0.509  14.585
  241    HB3  HIS  31           HB3      HIS  31 -19.175  -0.591  16.331
  242    HD1  HIS  31           HD1      HIS  31 -19.569   1.935  13.571
  243    HD2  HIS  31           HD2      HIS  31 -18.151   1.758  17.532
  244    HE1  HIS  31           HE1      HIS  31 -19.416   4.343  14.385
  245    H    SER  32           H        SER  32 -15.323  -1.944  14.213
  246    HA   SER  32           HA       SER  32 -16.316  -4.670  14.865
  247    HB2  SER  32           HB2      SER  32 -14.943  -3.832  12.275
  248    HB3  SER  32           HB3      SER  32 -15.523  -5.452  12.687
  249    HG   SER  32           HG       SER  32 -17.665  -4.636  12.648
  250    H    TRP  33           H        TRP  33 -14.546  -6.213  15.205
  251    HA   TRP  33           HA       TRP  33 -12.230  -4.790  16.397
  252    HB2  TRP  33           HB2      TRP  33 -13.480  -7.472  16.982
  253    HB3  TRP  33           HB3      TRP  33 -12.082  -6.760  17.800
  254    HD1  TRP  33           HD1      TRP  33 -15.881  -6.252  17.486
  255    HE1  TRP  33           HE1      TRP  33 -16.704  -4.883  19.465
  256    HE3  TRP  33           HE3      TRP  33 -11.364  -5.237  19.645
  257    HZ2  TRP  33           HZ2      TRP  33 -15.526  -3.503  21.766
  258    HZ3  TRP  33           HZ3      TRP  33 -11.244  -3.862  21.698
  259    HH2  TRP  33           HH2      TRP  33 -13.306  -2.958  22.744
  260    H    GLN  34           H        GLN  34 -10.110  -5.508  16.129
  261    HA   GLN  34           HA       GLN  34  -9.473  -7.697  14.308
  262    HB2  GLN  34           HB2      GLN  34  -8.209  -6.167  12.755
  263    HB3  GLN  34           HB3      GLN  34  -9.960  -6.038  12.652
  264    HG2  GLN  34           HG2      GLN  34  -9.952  -3.941  13.913
  265    HG3  GLN  34           HG3      GLN  34  -8.216  -4.099  14.240
  266   HE21  GLN  34          HE22      GLN  34 -10.465  -4.081  11.355
  267   HE22  GLN  34          HE21      GLN  34  -9.381  -3.158  10.351
  268    H    PHE  35           H        PHE  35  -7.085  -7.955  14.085
  269    HA   PHE  35           HA       PHE  35  -5.649  -7.121  16.533
  270    HB2  PHE  35           HB2      PHE  35  -4.865  -8.848  14.170
  271    HB3  PHE  35           HB3      PHE  35  -3.797  -8.502  15.531
  272    HD1  PHE  35           HD2      PHE  35  -5.423  -8.869  17.931
  273    HD2  PHE  35           HD1      PHE  35  -5.368 -11.132  14.245
  274    HE1  PHE  35           HE2      PHE  35  -6.320 -10.838  19.120
  275    HE2  PHE  35           HE1      PHE  35  -6.179 -13.122  15.473
  276    HZ   PHE  35           HZ       PHE  35  -6.685 -12.971  17.905
  277    HA   PRO  36           HA       PRO  36  -3.875  -3.515  14.569
  278    HB2  PRO  36           HB2      PRO  36  -1.320  -4.421  15.939
  279    HB3  PRO  36           HB3      PRO  36  -2.014  -2.775  15.860
  280    HG2  PRO  36           HG2      PRO  36  -2.328  -4.262  18.084
  281    HG3  PRO  36           HG3      PRO  36  -3.730  -3.346  17.429
  282    HD2  PRO  36           HD2      PRO  36  -3.100  -6.291  17.125
  283    HD3  PRO  36           HD3      PRO  36  -4.665  -5.485  17.465
  284    H    GLN  37           H        GLN  37  -2.966  -3.165  12.504
  285    HA   GLN  37           HA       GLN  37  -0.868  -4.907  11.497
  286    HB2  GLN  37           HB2      GLN  37  -2.193  -5.968   9.715
  287    HB3  GLN  37           HB3      GLN  37  -2.833  -6.394  11.292
  288    HG2  GLN  37           HG2      GLN  37  -4.550  -4.479  10.937
  289    HG3  GLN  37           HG3      GLN  37  -3.995  -4.459   9.259
  290   HE21  GLN  37          HE22      GLN  37  -5.483  -6.467  11.827
  291   HE22  GLN  37          HE21      GLN  37  -6.247  -7.612  10.726
  292    H    GLY  38           H        GLY  38  -0.347  -4.470   9.154
  293    HA2  GLY  38           HA2      GLY  38  -1.463  -2.144   7.870
  294    HA3  GLY  38           HA3      GLY  38   0.087  -1.768   8.623
  295    H    GLY  39           H        GLY  39  -0.057  -1.500   5.905
  296    HA2  GLY  39           HA2      GLY  39   0.740  -3.890   4.480
  297    HA3  GLY  39           HA3      GLY  39   0.632  -2.242   3.867
  298    H    ILE  40           H        ILE  40   2.759  -4.204   3.698
  299    HA   ILE  40           HA       ILE  40   5.077  -3.008   5.122
  300    HB   ILE  40           HB       ILE  40   4.909  -5.094   2.915
  301   HG12  ILE  40          HG12      ILE  40   5.825  -5.563   5.768
  302   HG13  ILE  40          HG13      ILE  40   4.130  -5.705   5.337
  303   HG21  ILE  40          HG21      ILE  40   7.068  -3.962   2.729
  304   HG22  ILE  40          HG22      ILE  40   7.354  -4.138   4.477
  305   HG23  ILE  40          HG23      ILE  40   7.333  -5.553   3.421
  306   HD11  ILE  40          HD11      ILE  40   5.782  -7.801   5.296
  307   HD12  ILE  40          HD12      ILE  40   4.429  -7.635   4.149
  308   HD13  ILE  40          HD13      ILE  40   6.090  -7.271   3.652
  309    H    ASN  41           H        ASN  41   6.130  -1.212   4.278
  310    HA   ASN  41           HA       ASN  41   5.082  -0.029   1.778
  311    HB2  ASN  41           HB2      ASN  41   6.682   0.968   4.103
  312    HB3  ASN  41           HB3      ASN  41   7.130   1.603   2.528
  313   HD21  ASN  41          HD22      ASN  41   4.097   0.988   4.464
  314   HD22  ASN  41          HD21      ASN  41   3.301   2.437   3.899
  315    HA   PRO  42           HA       PRO  42   7.803  -1.959  -0.830
  316    HB2  PRO  42           HB2      PRO  42   8.737  -0.059  -2.633
  317    HB3  PRO  42           HB3      PRO  42   7.095  -0.766  -2.639
  318    HG2  PRO  42           HG2      PRO  42   7.997   1.858  -1.438
  319    HG3  PRO  42           HG3      PRO  42   6.535   1.526  -2.425
  320    HD2  PRO  42           HD2      PRO  42   6.412   1.687   0.276
  321    HD3  PRO  42           HD3      PRO  42   5.433   0.484  -0.613
  322    H    GLY  43           H        GLY  43   9.699  -2.799  -0.181
  323    HA2  GLY  43           HA2      GLY  43  12.039  -2.867  -0.147
  324    HA3  GLY  43           HA3      GLY  43  12.116  -1.119   0.070
  325    H    GLU  44           H        GLU  44   9.824  -1.789   2.372
  326    HA   GLU  44           HA       GLU  44  11.694  -1.994   4.539
  327    HB2  GLU  44           HB2      GLU  44   8.683  -1.991   4.250
  328    HB3  GLU  44           HB3      GLU  44   9.387  -2.550   5.748
  329    HG2  GLU  44           HG2      GLU  44   8.725  -0.136   5.664
  330    HG3  GLU  44           HG3      GLU  44  10.329  -0.517   6.284
  331    H    SER  45           H        SER  45  11.983  -3.727   5.972
  332    HA   SER  45           HA       SER  45  11.495  -6.448   4.882
  333    HB2  SER  45           HB2      SER  45  12.998  -5.517   7.367
  334    HB3  SER  45           HB3      SER  45  12.866  -7.188   6.790
  335    HG   SER  45           HG       SER  45  14.080  -4.995   5.384
  336    H    ALA  46           H        ALA  46  10.227  -7.973   6.181
  337    HA   ALA  46           HA       ALA  46   7.754  -6.922   6.900
  338    HB1  ALA  46           HB1      ALA  46   8.197  -9.281   6.239
  339    HB2  ALA  46           HB2      ALA  46   8.995  -9.557   7.813
  340    HB3  ALA  46           HB3      ALA  46   7.255  -9.179   7.734
  341    H    GLU  47           H        GLU  47  10.474  -7.741   9.046
  342    HA   GLU  47           HA       GLU  47   9.086  -7.339  11.510
  343    HB2  GLU  47           HB2      GLU  47  11.144  -8.666  11.067
  344    HB3  GLU  47           HB3      GLU  47  12.045  -7.158  10.823
  345    HG2  GLU  47           HG2      GLU  47  11.432  -6.495  13.180
  346    HG3  GLU  47           HG3      GLU  47  10.653  -8.066  13.372
  347    H    GLN  48           H        GLN  48  10.800  -5.120   9.272
  348    HA   GLN  48           HA       GLN  48  10.814  -2.944  11.183
  349    HB2  GLN  48           HB2      GLN  48  11.265  -2.908   8.201
  350    HB3  GLN  48           HB3      GLN  48  11.468  -1.512   9.279
  351    HG2  GLN  48           HG2      GLN  48  12.909  -4.168   9.540
  352    HG3  GLN  48           HG3      GLN  48  13.628  -2.715   8.842
  353   HE21  GLN  48          HE22      GLN  48  14.692  -4.274  11.025
  354   HE22  GLN  48          HE21      GLN  48  14.722  -3.252  12.444
  355    H    ALA  49           H        ALA  49   8.644  -4.110   8.560
  356    HA   ALA  49           HA       ALA  49   6.839  -1.861   8.693
  357    HB1  ALA  49           HB1      ALA  49   6.931  -3.442   6.797
  358    HB2  ALA  49           HB2      ALA  49   6.349  -4.760   7.873
  359    HB3  ALA  49           HB3      ALA  49   5.301  -3.376   7.528
  360    H    MET  50           H        MET  50   7.098  -5.024  10.428
  361    HA   MET  50           HA       MET  50   4.726  -4.797  11.933
  362    HB2  MET  50           HB2      MET  50   5.936  -6.862  11.862
  363    HB3  MET  50           HB3      MET  50   7.395  -6.115  12.475
  364    HG2  MET  50           HG2      MET  50   5.666  -5.645  14.568
  365    HG3  MET  50           HG3      MET  50   5.067  -7.166  13.905
  366    HE1  MET  50           HE1      MET  50   9.172  -6.387  15.851
  367    HE2  MET  50           HE2      MET  50   8.712  -5.520  14.378
  368    HE3  MET  50           HE3      MET  50   7.760  -5.307  15.873
  369    H    TYR  51           H        TYR  51   8.068  -3.580  12.811
  370    HA   TYR  51           HA       TYR  51   7.094  -2.362  15.206
  371    HB2  TYR  51           HB2      TYR  51   9.544  -1.729  13.522
  372    HB3  TYR  51           HB3      TYR  51   9.184  -0.956  15.059
  373    HD1  TYR  51           HD2      TYR  51   8.542  -2.700  17.045
  374    HD2  TYR  51           HD1      TYR  51  11.126  -3.492  13.675
  375    HE1  TYR  51           HE2      TYR  51   9.855  -4.281  18.420
  376    HE2  TYR  51           HE1      TYR  51  12.442  -5.069  15.047
  377    HH   TYR  51           HH       TYR  51  12.744  -6.016  17.186
  378    H    ARG  52           H        ARG  52   7.539  -0.896  11.870
  379    HA   ARG  52           HA       ARG  52   6.896   1.718  12.798
  380    HB2  ARG  52           HB2      ARG  52   8.074   1.036  10.632
  381    HB3  ARG  52           HB3      ARG  52   6.492   0.536  10.016
  382    HG2  ARG  52           HG2      ARG  52   5.803   3.043  10.707
  383    HG3  ARG  52           HG3      ARG  52   7.552   3.299  10.662
  384    HD2  ARG  52           HD2      ARG  52   7.227   3.655   8.435
  385    HD3  ARG  52           HD3      ARG  52   7.162   1.882   8.340
  386    HE   ARG  52           HE       ARG  52   4.809   1.961   8.102
  387   HH11  ARG  52          HH21      ARG  52   6.005   5.294   8.676
  388   HH12  ARG  52          HH22      ARG  52   4.437   5.989   8.447
  389   HH21  ARG  52          HH11      ARG  52   2.880   2.850   7.887
  390   HH22  ARG  52          HH12      ARG  52   2.572   4.547   8.225
  391    H    GLU  53           H        GLU  53   4.871  -0.879  11.292
  392    HA   GLU  53           HA       GLU  53   2.575   0.785  11.198
  393    HB2  GLU  53           HB2      GLU  53   2.768  -2.221  11.047
  394    HB3  GLU  53           HB3      GLU  53   1.292  -1.295  10.791
  395    HG2  GLU  53           HG2      GLU  53   3.867  -0.930   9.238
  396    HG3  GLU  53           HG3      GLU  53   2.467  -1.834   8.648
  397    H    LEU  54           H        LEU  54   3.910  -1.507  13.682
  398    HA   LEU  54           HA       LEU  54   1.705  -1.428  15.439
  399    HB2  LEU  54           HB2      LEU  54   3.742  -2.855  15.739
  400    HB3  LEU  54           HB3      LEU  54   4.664  -1.410  16.156
  401    HG   LEU  54           HG       LEU  54   3.043  -1.082  18.096
  402   HD11  LEU  54          HD11      LEU  54   1.171  -2.491  17.282
  403   HD12  LEU  54          HD12      LEU  54   2.221  -3.893  17.252
  404   HD13  LEU  54          HD13      LEU  54   1.796  -3.149  18.808
  405   HD21  LEU  54          HD21      LEU  54   5.279  -1.966  18.448
  406   HD22  LEU  54          HD22      LEU  54   4.142  -2.870  19.454
  407   HD23  LEU  54          HD23      LEU  54   4.764  -3.588  17.943
  408    H    PHE  55           H        PHE  55   4.457   0.927  15.097
  409    HA   PHE  55           HA       PHE  55   3.534   2.670  17.153
  410    HB2  PHE  55           HB2      PHE  55   5.793   2.831  16.224
  411    HB3  PHE  55           HB3      PHE  55   5.149   3.283  14.650
  412    HD1  PHE  55           HD1      PHE  55   5.396   4.367  18.215
  413    HD2  PHE  55           HD2      PHE  55   4.555   5.564  14.162
  414    HE1  PHE  55           HE1      PHE  55   5.331   6.742  18.934
  415    HE2  PHE  55           HE2      PHE  55   4.514   7.944  14.876
  416    HZ   PHE  55           HZ       PHE  55   4.892   8.535  17.263
  417    H    GLU  56           H        GLU  56   2.730   2.519  13.639
  418    HA   GLU  56           HA       GLU  56   1.094   4.809  13.646
  419    HB2  GLU  56           HB2      GLU  56   1.138   2.374  11.843
  420    HB3  GLU  56           HB3      GLU  56   0.175   3.797  11.518
  421    HG2  GLU  56           HG2      GLU  56   3.133   4.213  12.004
  422    HG3  GLU  56           HG3      GLU  56   2.646   3.453  10.512
  423    H    GLU  57           H        GLU  57   0.454   1.579  14.879
  424    HA   GLU  57           HA       GLU  57  -2.465   1.847  14.666
  425    HB2  GLU  57           HB2      GLU  57  -0.576  -0.354  15.603
  426    HB3  GLU  57           HB3      GLU  57  -2.314  -0.468  15.749
  427    HG2  GLU  57           HG2      GLU  57  -0.898  -0.210  13.079
  428    HG3  GLU  57           HG3      GLU  57  -1.351  -1.719  13.843
  429    H    VAL  58           H        VAL  58  -0.072   1.155  17.258
  430    HA   VAL  58           HA       VAL  58  -2.078   1.999  19.306
  431    HB   VAL  58           HB       VAL  58  -0.512   0.523  20.777
  432   HG11  VAL  58          HG11      VAL  58  -2.896  -0.040  20.043
  433   HG12  VAL  58          HG12      VAL  58  -2.146  -1.058  18.788
  434   HG13  VAL  58          HG13      VAL  58  -1.803  -1.351  20.527
  435   HG21  VAL  58          HG21      VAL  58   0.631  -1.271  19.730
  436   HG22  VAL  58          HG22      VAL  58   0.136  -0.731  18.099
  437   HG23  VAL  58          HG23      VAL  58   1.260   0.243  19.057
  438    H    GLY  59           H        GLY  59   0.645   3.351  17.810
  439    HA2  GLY  59           HA2      GLY  59   2.066   5.028  18.454
  440    HA3  GLY  59           HA3      GLY  59   1.187   5.150  19.977
  441    H    LEU  60           H        LEU  60   2.231   1.952  19.642
  442    HA   LEU  60           HA       LEU  60   4.212   2.238  21.712
  443    HB2  LEU  60           HB2      LEU  60   2.405   0.528  21.512
  444    HB3  LEU  60           HB3      LEU  60   3.226  -0.124  20.087
  445    HG   LEU  60           HG       LEU  60   5.073  -0.981  21.412
  446   HD11  LEU  60          HD11      LEU  60   3.785   0.581  23.653
  447   HD12  LEU  60          HD12      LEU  60   4.893  -0.787  23.918
  448   HD13  LEU  60          HD13      LEU  60   5.458   0.657  23.071
  449   HD21  LEU  60          HD21      LEU  60   3.644  -2.543  22.777
  450   HD22  LEU  60          HD22      LEU  60   2.288  -1.383  22.706
  451   HD23  LEU  60          HD23      LEU  60   2.834  -2.201  21.238
  452    H    SER  61           H        SER  61   6.391   1.691  21.547
  453    HA   SER  61           HA       SER  61   7.549   1.515  18.801
  454    HB2  SER  61           HB2      SER  61   8.671   3.078  21.164
  455    HB3  SER  61           HB3      SER  61   9.293   3.045  19.499
  456    HG   SER  61           HG       SER  61   7.996   4.920  19.952
  457    H    ARG  62           H        ARG  62   9.793   0.687  18.837
  458    HA   ARG  62           HA       ARG  62   9.992  -1.921  19.580
  459    HB2  ARG  62           HB2      ARG  62  12.415  -0.069  19.461
  460    HB3  ARG  62           HB3      ARG  62  12.365  -1.813  19.203
  461    HG2  ARG  62           HG2      ARG  62  10.674  -1.209  17.288
  462    HG3  ARG  62           HG3      ARG  62  11.371   0.408  17.409
  463    HD2  ARG  62           HD2      ARG  62  13.678  -0.666  17.169
  464    HD3  ARG  62           HD3      ARG  62  12.854  -2.198  16.887
  465    HE   ARG  62           HE       ARG  62  12.388  -1.589  14.746
  466   HH11  ARG  62          HH11      ARG  62  13.339   1.396  16.455
  467   HH12  ARG  62          HH12      ARG  62  13.513   2.325  15.010
  468   HH21  ARG  62          HH21      ARG  62  12.767  -0.370  12.814
  469   HH22  ARG  62          HH22      ARG  62  13.128   1.320  12.920
  470    H    LYS  63           H        LYS  63  10.925   0.872  21.560
  471    HA   LYS  63           HA       LYS  63  12.576  -0.527  23.366
  472    HB2  LYS  63           HB2      LYS  63  10.976   1.991  24.017
  473    HB3  LYS  63           HB3      LYS  63  12.542   1.490  24.684
  474    HG2  LYS  63           HG2      LYS  63  11.994   2.532  21.894
  475    HG3  LYS  63           HG3      LYS  63  12.857   3.365  23.183
  476    HD2  LYS  63           HD2      LYS  63  13.730   0.697  22.054
  477    HD3  LYS  63           HD3      LYS  63  14.262   2.245  21.364
  478    HE2  LYS  63           HE2      LYS  63  15.204   2.891  23.600
  479    HE3  LYS  63           HE3      LYS  63  14.752   1.304  24.236
  480    HZ1  LYS  63           HZ1      LYS  63  16.285   0.300  22.620
  481    HZ2  LYS  63           HZ2      LYS  63  16.687   1.779  22.029
  482    HZ3  LYS  63           HZ3      LYS  63  17.073   1.379  23.560
  483    H    ASP  64           H        ASP  64   9.095  -0.420  23.221
  484    HA   ASP  64           HA       ASP  64   9.077  -1.637  25.945
  485    HB2  ASP  64           HB2      ASP  64   8.020   0.678  25.670
  486    HB3  ASP  64           HB3      ASP  64   6.699  -0.172  24.892
  487    H    VAL  65           H        VAL  65   9.407  -2.875  23.215
  488    HA   VAL  65           HA       VAL  65   7.537  -5.092  23.803
  489    HB   VAL  65           HB       VAL  65   7.209  -5.436  21.336
  490   HG11  VAL  65          HG11      VAL  65   5.463  -4.552  22.842
  491   HG12  VAL  65          HG12      VAL  65   5.993  -2.901  22.487
  492   HG13  VAL  65          HG13      VAL  65   5.331  -3.921  21.189
  493   HG21  VAL  65          HG21      VAL  65   7.463  -3.570  19.779
  494   HG22  VAL  65          HG22      VAL  65   8.080  -2.530  21.068
  495   HG23  VAL  65          HG23      VAL  65   9.036  -3.914  20.526
  496    H    ARG  66           H        ARG  66   8.183  -7.146  22.735
  497    HA   ARG  66           HA       ARG  66  10.929  -7.302  21.726
  498    HB2  ARG  66           HB2      ARG  66  11.550  -9.186  23.108
  499    HB3  ARG  66           HB3      ARG  66  11.311  -7.727  24.050
  500    HG2  ARG  66           HG2      ARG  66   8.989  -9.674  23.928
  501    HG3  ARG  66           HG3      ARG  66  10.434 -10.183  24.781
  502    HD2  ARG  66           HD2      ARG  66   8.981  -7.584  25.387
  503    HD3  ARG  66           HD3      ARG  66   8.743  -9.078  26.276
  504    HE   ARG  66           HE       ARG  66  11.128  -7.323  26.278
  505   HH11  ARG  66          HH21      ARG  66   9.774 -10.404  27.496
  506   HH12  ARG  66          HH22      ARG  66  10.945 -10.551  28.752
  507   HH21  ARG  66          HH11      ARG  66  12.660  -7.553  27.957
  508   HH22  ARG  66          HH12      ARG  66  12.607  -8.912  29.012
  509    H    ILE  67           H        ILE  67  11.062  -9.018  20.112
  510    HA   ILE  67           HA       ILE  67   8.451 -10.103  19.331
  511    HB   ILE  67           HB       ILE  67  11.159 -10.536  18.066
  512   HG12  ILE  67          HG12      ILE  67   9.088  -8.637  16.946
  513   HG13  ILE  67          HG13      ILE  67  10.372  -8.078  18.021
  514   HG21  ILE  67          HG21      ILE  67   8.339 -11.004  16.974
  515   HG22  ILE  67          HG22      ILE  67   9.846 -11.300  16.093
  516   HG23  ILE  67          HG23      ILE  67   9.467 -12.268  17.504
  517   HD11  ILE  67          HD11      ILE  67  12.068  -8.998  16.454
  518   HD12  ILE  67          HD12      ILE  67  10.753  -9.409  15.315
  519   HD13  ILE  67          HD13      ILE  67  11.057  -7.723  15.751
  520    H    LEU  68           H        LEU  68   7.736 -11.809  20.279
  521    HA   LEU  68           HA       LEU  68   9.554 -13.737  21.636
  522    HB2  LEU  68           HB2      LEU  68   6.553 -13.553  21.452
  523    HB3  LEU  68           HB3      LEU  68   7.462 -14.725  22.395
  524    HG   LEU  68           HG       LEU  68   7.452 -11.691  22.925
  525   HD11  LEU  68          HD11      LEU  68   5.368 -12.431  23.542
  526   HD12  LEU  68          HD12      LEU  68   5.929 -14.078  23.966
  527   HD13  LEU  68          HD13      LEU  68   6.302 -12.724  25.026
  528   HD21  LEU  68          HD21      LEU  68   9.601 -12.664  23.617
  529   HD22  LEU  68          HD22      LEU  68   8.601 -12.321  25.027
  530   HD23  LEU  68          HD23      LEU  68   8.760 -13.998  24.445
  531    H    ALA  69           H        ALA  69   7.383 -13.399  18.780
  532    HA   ALA  69           HA       ALA  69   8.340 -15.844  17.568
  533    HB1  ALA  69           HB1      ALA  69   6.336 -17.133  17.617
  534    HB2  ALA  69           HB2      ALA  69   6.667 -16.683  19.298
  535    HB3  ALA  69           HB3      ALA  69   5.415 -15.825  18.390
  536    H    SER  70           H        SER  70   7.308 -16.237  15.564
  537    HA   SER  70           HA       SER  70   5.987 -14.008  14.198
  538    HB2  SER  70           HB2      SER  70   8.654 -15.060  13.227
  539    HB3  SER  70           HB3      SER  70   7.735 -13.688  12.577
  540    HG   SER  70           HG       SER  70   9.576 -13.118  13.943
  541    H    THR  71           H        THR  71   5.025 -14.758  12.071
  542    HA   THR  71           HA       THR  71   4.595 -17.628  12.106
  543    HB   THR  71           HB       THR  71   3.495 -17.093   9.802
  544    HG1  THR  71           HG1      THR  71   4.185 -15.159   9.255
  545   HG21  THR  71          HG21      THR  71   1.953 -17.505  11.468
  546   HG22  THR  71          HG22      THR  71   2.377 -16.034  12.377
  547   HG23  THR  71          HG23      THR  71   1.508 -15.924  10.824
  548    H    ARG  72           H        ARG  72   5.282 -19.172  10.891
  549    HA   ARG  72           HA       ARG  72   7.982 -18.770   9.740
  550    HB2  ARG  72           HB2      ARG  72   6.369 -21.284  10.309
  551    HB3  ARG  72           HB3      ARG  72   8.094 -21.227   9.969
  552    HG2  ARG  72           HG2      ARG  72   8.654 -20.298  12.049
  553    HG3  ARG  72           HG3      ARG  72   7.079 -19.594  12.333
  554    HD2  ARG  72           HD2      ARG  72   7.836 -22.473  12.647
  555    HD3  ARG  72           HD3      ARG  72   7.280 -21.288  13.868
  556    HE   ARG  72           HE       ARG  72   5.113 -21.265  12.428
  557   HH11  ARG  72          HH21      ARG  72   7.029 -24.198  13.135
  558   HH12  ARG  72          HH22      ARG  72   5.666 -25.257  13.097
  559   HH21  ARG  72          HH11      ARG  72   3.315 -22.640  12.496
  560   HH22  ARG  72          HH12      ARG  72   3.509 -24.362  12.654
  561    H    ASN  73           H        ASN  73   4.740 -19.530   8.725
  562    HA   ASN  73           HA       ASN  73   5.515 -19.695   5.900
  563    HB2  ASN  73           HB2      ASN  73   3.535 -20.944   5.471
  564    HB3  ASN  73           HB3      ASN  73   4.355 -21.750   6.809
  565   HD21  ASN  73          HD22      ASN  73   3.411 -21.345   9.102
  566   HD22  ASN  73          HD21      ASN  73   1.744 -20.892   9.229
  567    H    TRP  74           H        TRP  74   4.174 -18.304   4.496
  568    HA   TRP  74           HA       TRP  74   3.065 -15.949   5.939
  569    HB2  TRP  74           HB2      TRP  74   3.572 -16.551   2.983
  570    HB3  TRP  74           HB3      TRP  74   2.672 -15.158   3.527
  571    HD1  TRP  74           HD1      TRP  74   6.254 -16.566   3.671
  572    HE1  TRP  74           HE1      TRP  74   7.905 -14.621   3.900
  573    HE3  TRP  74           HE3      TRP  74   2.919 -12.733   4.209
  574    HZ2  TRP  74           HZ2      TRP  74   7.797 -11.815   4.486
  575    HZ3  TRP  74           HZ3      TRP  74   3.713 -10.411   4.608
  576    HH2  TRP  74           HH2      TRP  74   6.155  -9.970   4.900
  577    H    LEU  75           H        LEU  75   0.947 -15.342   5.909
  578    HA   LEU  75           HA       LEU  75  -0.977 -17.490   5.159
  579    HB2  LEU  75           HB2      LEU  75  -1.609 -14.872   6.561
  580    HB3  LEU  75           HB3      LEU  75  -2.636 -16.280   6.373
  581    HG   LEU  75           HG       LEU  75  -0.163 -15.949   8.122
  582   HD11  LEU  75          HD11      LEU  75  -2.238 -15.200   9.114
  583   HD12  LEU  75          HD12      LEU  75  -3.022 -16.782   8.809
  584   HD13  LEU  75          HD13      LEU  75  -1.667 -16.637   9.947
  585   HD21  LEU  75          HD21      LEU  75  -0.429 -18.319   8.859
  586   HD22  LEU  75          HD22      LEU  75  -1.521 -18.590   7.483
  587   HD23  LEU  75          HD23      LEU  75   0.192 -18.124   7.225
  588    H    ARG  76           H        ARG  76  -0.844 -17.429   2.929
  589    HA   ARG  76           HA       ARG  76  -1.113 -14.948   1.429
  590    HB2  ARG  76           HB2      ARG  76  -0.520 -17.747   0.866
  591    HB3  ARG  76           HB3      ARG  76  -1.900 -17.288  -0.113
  592    HG2  ARG  76           HG2      ARG  76   0.744 -15.767  -0.036
  593    HG3  ARG  76           HG3      ARG  76   0.312 -16.988  -1.230
  594    HD2  ARG  76           HD2      ARG  76  -1.692 -15.583  -1.884
  595    HD3  ARG  76           HD3      ARG  76  -1.118 -14.338  -0.786
  596    HE   ARG  76           HE       ARG  76   0.560 -13.744  -2.229
  597   HH11  ARG  76          HH11      ARG  76  -0.839 -16.799  -3.437
  598   HH12  ARG  76          HH12      ARG  76  -0.065 -16.692  -4.974
  599   HH21  ARG  76          HH21      ARG  76   1.581 -13.628  -4.283
  600   HH22  ARG  76          HH22      ARG  76   1.339 -14.866  -5.455
  601    H    TYR  77           H        TYR  77  -3.036 -14.094   0.631
  602    HA   TYR  77           HA       TYR  77  -5.570 -15.293   1.659
  603    HB2  TYR  77           HB2      TYR  77  -4.345 -13.472   3.078
  604    HB3  TYR  77           HB3      TYR  77  -4.768 -12.389   1.753
  605    HD1  TYR  77           HD2      TYR  77  -6.268 -14.831   4.151
  606    HD2  TYR  77           HD1      TYR  77  -6.817 -11.215   1.851
  607    HE1  TYR  77           HE2      TYR  77  -8.343 -14.373   5.382
  608    HE2  TYR  77           HE1      TYR  77  -8.905 -10.750   3.064
  609    HH   TYR  77           HH       TYR  77 -10.373 -11.446   4.736
  610    H    LYS  78           H        LYS  78  -7.422 -14.467   0.655
  611    HA   LYS  78           HA       LYS  78  -7.170 -13.144  -1.999
  612    HB2  LYS  78           HB2      LYS  78  -8.312 -15.887  -1.437
  613    HB3  LYS  78           HB3      LYS  78  -9.251 -14.830  -2.467
  614    HG2  LYS  78           HG2      LYS  78  -7.996 -16.122  -3.909
  615    HG3  LYS  78           HG3      LYS  78  -7.290 -14.503  -3.958
  616    HD2  LYS  78           HD2      LYS  78  -5.417 -15.213  -2.598
  617    HD3  LYS  78           HD3      LYS  78  -6.141 -16.797  -2.290
  618    HE2  LYS  78           HE2      LYS  78  -5.352 -15.753  -5.061
  619    HE3  LYS  78           HE3      LYS  78  -4.281 -16.707  -4.043
  620    HZ1  LYS  78           HZ1      LYS  78  -6.882 -17.665  -5.119
  621    HZ2  LYS  78           HZ2      LYS  78  -5.402 -18.118  -5.622
  622    HZ3  LYS  78           HZ3      LYS  78  -5.899 -18.533  -4.126
  623    H    LEU  79           H        LEU  79  -8.748 -11.644  -2.283
  624    HA   LEU  79           HA       LEU  79 -10.736 -11.107  -0.211
  625    HB2  LEU  79           HB2      LEU  79 -10.510  -9.970  -3.038
  626    HB3  LEU  79           HB3      LEU  79 -11.466  -9.331  -1.717
  627    HG   LEU  79           HG       LEU  79  -8.463  -9.243  -2.088
  628   HD11  LEU  79          HD11      LEU  79 -10.579  -7.086  -1.683
  629   HD12  LEU  79          HD12      LEU  79  -8.844  -6.826  -2.004
  630   HD13  LEU  79          HD13      LEU  79  -9.875  -7.574  -3.239
  631   HD21  LEU  79          HD21      LEU  79  -8.365  -8.104   0.138
  632   HD22  LEU  79          HD22      LEU  79 -10.035  -8.643   0.438
  633   HD23  LEU  79          HD23      LEU  79  -8.730  -9.839   0.193
  634    HA   PRO  80           HA       PRO  80 -14.051 -13.295  -2.502
  635    HB2  PRO  80           HB2      PRO  80 -16.238 -11.988  -1.420
  636    HB3  PRO  80           HB3      PRO  80 -15.322 -13.239  -0.516
  637    HG2  PRO  80           HG2      PRO  80 -15.029 -10.242  -0.404
  638    HG3  PRO  80           HG3      PRO  80 -15.208 -11.375   0.977
  639    HD2  PRO  80           HD2      PRO  80 -12.755 -10.496   0.201
  640    HD3  PRO  80           HD3      PRO  80 -12.989 -12.202   0.685
  641    H    LYS  81           H        LYS  81 -15.190 -12.542  -4.528
  642    HA   LYS  81           HA       LYS  81 -13.798 -10.276  -5.496
  643    HB2  LYS  81           HB2      LYS  81 -16.022 -11.672  -6.939
  644    HB3  LYS  81           HB3      LYS  81 -14.806 -10.515  -7.580
  645    HG2  LYS  81           HG2      LYS  81 -13.004 -12.011  -7.264
  646    HG3  LYS  81           HG3      LYS  81 -13.996 -13.157  -6.357
  647    HD2  LYS  81           HD2      LYS  81 -13.592 -13.943  -8.632
  648    HD3  LYS  81           HD3      LYS  81 -15.314 -13.693  -8.314
  649    HE2  LYS  81           HE2      LYS  81 -15.253 -11.565  -9.588
  650    HE3  LYS  81           HE3      LYS  81 -13.520 -11.796  -9.891
  651    HZ1  LYS  81           HZ1      LYS  81 -14.870 -12.526 -11.765
  652    HZ2  LYS  81           HZ2      LYS  81 -14.081 -13.815 -11.136
  653    HZ3  LYS  81           HZ3      LYS  81 -15.681 -13.599 -10.846
  654    H    ARG  82           H        ARG  82 -16.828 -10.308  -3.853
  655    HA   ARG  82           HA       ARG  82 -17.889  -7.904  -4.844
  656    HB2  ARG  82           HB2      ARG  82 -19.044  -7.647  -2.733
  657    HB3  ARG  82           HB3      ARG  82 -19.130  -9.308  -3.330
  658    HG2  ARG  82           HG2      ARG  82 -17.171  -9.789  -1.682
  659    HG3  ARG  82           HG3      ARG  82 -17.537  -8.207  -0.981
  660    HD2  ARG  82           HD2      ARG  82 -19.510 -10.496  -1.315
  661    HD3  ARG  82           HD3      ARG  82 -18.641 -10.128   0.187
  662    HE   ARG  82           HE       ARG  82 -19.894  -7.746  -0.483
  663   HH11  ARG  82          HH11      ARG  82 -20.985 -11.045   0.292
  664   HH12  ARG  82          HH12      ARG  82 -22.524 -10.546   0.889
  665   HH21  ARG  82          HH21      ARG  82 -21.950  -7.080   0.302
  666   HH22  ARG  82          HH22      ARG  82 -23.080  -8.240   0.896
  667    H    LEU  83           H        LEU  83 -15.080  -8.347  -2.772
  668    HA   LEU  83           HA       LEU  83 -14.986  -5.485  -2.131
  669    HB2  LEU  83           HB2      LEU  83 -13.084  -7.715  -1.370
  670    HB3  LEU  83           HB3      LEU  83 -13.077  -6.079  -0.715
  671    HG   LEU  83           HG       LEU  83 -15.276  -8.146  -0.359
  672   HD11  LEU  83          HD11      LEU  83 -13.160  -8.559   0.915
  673   HD12  LEU  83          HD12      LEU  83 -13.407  -7.000   1.735
  674   HD13  LEU  83          HD13      LEU  83 -14.594  -8.322   1.920
  675   HD21  LEU  83          HD21      LEU  83 -16.376  -6.018  -0.394
  676   HD22  LEU  83          HD22      LEU  83 -16.289  -6.590   1.269
  677   HD23  LEU  83          HD23      LEU  83 -15.170  -5.322   0.728
  678    H    VAL  84           H        VAL  84 -13.669  -7.640  -4.491
  679    HA   VAL  84           HA       VAL  84 -11.175  -6.330  -4.985
  680    HB   VAL  84           HB       VAL  84 -12.950  -7.970  -6.858
  681   HG11  VAL  84          HG11      VAL  84 -11.329  -6.824  -8.199
  682   HG12  VAL  84          HG12      VAL  84 -10.035  -7.151  -7.029
  683   HG13  VAL  84          HG13      VAL  84 -10.731  -8.472  -7.986
  684   HG21  VAL  84          HG21      VAL  84 -12.156  -9.195  -4.725
  685   HG22  VAL  84          HG22      VAL  84 -11.797  -9.915  -6.305
  686   HG23  VAL  84          HG23      VAL  84 -10.527  -9.036  -5.391
  687    H    ARG  85           H        ARG  85 -10.734  -4.482  -6.151
  688    HA   ARG  85           HA       ARG  85 -12.925  -3.225  -7.673
  689    HB2  ARG  85           HB2      ARG  85 -10.782  -2.231  -5.931
  690    HB3  ARG  85           HB3      ARG  85 -10.714  -1.447  -7.515
  691    HG2  ARG  85           HG2      ARG  85 -13.236  -1.726  -5.899
  692    HG3  ARG  85           HG3      ARG  85 -12.161  -0.297  -5.861
  693    HD2  ARG  85           HD2      ARG  85 -12.452  -0.252  -8.441
  694    HD3  ARG  85           HD3      ARG  85 -13.834  -1.315  -8.219
  695    HE   ARG  85           HE       ARG  85 -13.521   1.524  -7.527
  696   HH11  ARG  85          HH21      ARG  85 -15.610  -1.322  -7.004
  697   HH12  ARG  85          HH22      ARG  85 -16.999  -0.391  -6.584
  698   HH21  ARG  85          HH11      ARG  85 -15.375   2.749  -6.952
  699   HH22  ARG  85          HH12      ARG  85 -16.854   1.968  -6.535
  700    H    TRP  86           H        TRP  86 -12.909  -4.511  -9.384
  701    HA   TRP  86           HA       TRP  86 -10.635  -5.081 -11.005
  702    HB2  TRP  86           HB2      TRP  86 -13.616  -4.985 -11.543
  703    HB3  TRP  86           HB3      TRP  86 -12.441  -5.610 -12.705
  704    HD1  TRP  86           HD1      TRP  86 -14.585  -6.765  -9.953
  705    HE1  TRP  86           HE1      TRP  86 -13.972  -9.118  -9.170
  706    HE3  TRP  86           HE3      TRP  86 -10.092  -7.259 -12.349
  707    HZ2  TRP  86           HZ2      TRP  86 -11.672 -10.885  -9.327
  708    HZ3  TRP  86           HZ3      TRP  86  -8.703  -9.287 -12.010
  709    HH2  TRP  86           HH2      TRP  86  -9.485 -11.105 -10.504
  710    H    ASP  87           H        ASP  87 -12.690  -2.243 -10.716
  711    HA   ASP  87           HA       ASP  87 -12.406  -1.255 -13.365
  712    HB2  ASP  87           HB2      ASP  87 -14.199  -0.550 -11.873
  713    HB3  ASP  87           HB3      ASP  87 -13.032   0.190 -10.769
  714    H    THR  88           H        THR  88 -10.321  -0.939 -10.538
  715    HA   THR  88           HA       THR  88  -8.756   1.165 -11.877
  716    HB   THR  88           HB       THR  88  -9.787   1.529  -9.561
  717    HG1  THR  88           HG1      THR  88  -8.345   3.008 -10.200
  718   HG21  THR  88          HG21      THR  88  -8.644   0.738  -7.632
  719   HG22  THR  88          HG22      THR  88  -8.935  -0.694  -8.626
  720   HG23  THR  88          HG23      THR  88  -7.320   0.034  -8.613
  721    H    LYS  89           H        LYS  89  -6.379   0.989 -11.612
  722    HA   LYS  89           HA       LYS  89  -5.439  -1.792 -11.885
  723    HB2  LYS  89           HB2      LYS  89  -4.764   0.508 -13.750
  724    HB3  LYS  89           HB3      LYS  89  -4.149  -1.137 -13.875
  725    HG2  LYS  89           HG2      LYS  89  -7.066  -0.302 -14.160
  726    HG3  LYS  89           HG3      LYS  89  -5.956  -0.583 -15.497
  727    HD2  LYS  89           HD2      LYS  89  -5.670  -2.944 -14.821
  728    HD3  LYS  89           HD3      LYS  89  -6.819  -2.740 -13.504
  729    HE2  LYS  89           HE2      LYS  89  -7.455  -2.300 -16.456
  730    HE3  LYS  89           HE3      LYS  89  -7.747  -3.809 -15.594
  731    HZ1  LYS  89           HZ1      LYS  89  -9.056  -1.222 -14.934
  732    HZ2  LYS  89           HZ2      LYS  89  -9.740  -2.471 -15.718
  733    HZ3  LYS  89           HZ3      LYS  89  -9.325  -2.659 -14.155
  734    HA   PRO  90           HA       PRO  90  -3.774  -2.992 -11.698
  735    HB2  PRO  90           HB2      PRO  90  -2.305  -4.206  -9.804
  736    HB3  PRO  90           HB3      PRO  90  -1.593  -3.394 -11.246
  737    HG2  PRO  90           HG2      PRO  90  -1.903  -2.268  -8.433
  738    HG3  PRO  90           HG3      PRO  90  -0.424  -2.283  -9.444
  739    HD2  PRO  90           HD2      PRO  90  -2.101  -0.118  -9.323
  740    HD3  PRO  90           HD3      PRO  90  -1.264  -0.561 -10.841
  741    H    VAL  91           H        VAL  91  -5.217  -4.529 -10.839
  742    HA   VAL  91           HA       VAL  91  -6.908  -3.648  -8.652
  743    HB   VAL  91           HB       VAL  91  -8.031  -4.511 -10.526
  744   HG11  VAL  91          HG11      VAL  91  -6.244  -6.975 -10.497
  745   HG12  VAL  91          HG12      VAL  91  -7.688  -6.769 -11.507
  746   HG13  VAL  91          HG13      VAL  91  -6.308  -5.705 -11.751
  747   HG21  VAL  91          HG21      VAL  91  -9.295  -6.388  -9.705
  748   HG22  VAL  91          HG22      VAL  91  -7.989  -6.874  -8.615
  749   HG23  VAL  91          HG23      VAL  91  -8.874  -5.368  -8.319
  750    H    CYS  92           H        CYS  92  -7.079  -4.496  -6.637
  751    HA   CYS  92           HA       CYS  92  -4.953  -6.323  -5.735
  752    HB2  CYS  92           HB2      CYS  92  -5.888  -5.733  -3.471
  753    HB3  CYS  92           HB3      CYS  92  -5.202  -4.382  -4.393
  754    HG   CYS  92           HG       CYS  92  -8.389  -5.241  -4.256
  755    H    ILE  93           H        ILE  93  -5.423  -8.519  -5.791
  756    HA   ILE  93           HA       ILE  93  -8.265  -9.272  -5.235
  757    HB   ILE  93           HB       ILE  93  -8.195 -11.121  -6.532
  758   HG12  ILE  93          HG12      ILE  93  -6.145 -12.205  -5.944
  759   HG13  ILE  93          HG13      ILE  93  -6.324 -12.137  -7.687
  760   HG21  ILE  93          HG21      ILE  93  -6.656  -9.061  -8.155
  761   HG22  ILE  93          HG22      ILE  93  -7.669 -10.372  -8.785
  762   HG23  ILE  93          HG23      ILE  93  -8.403  -9.075  -7.831
  763   HD11  ILE  93          HD11      ILE  93  -4.405 -10.566  -5.945
  764   HD12  ILE  93          HD12      ILE  93  -4.038 -11.751  -7.199
  765   HD13  ILE  93          HD13      ILE  93  -4.688 -10.173  -7.669
  766    H    GLY  94           H        GLY  94  -5.108  -9.368  -3.876
  767    HA2  GLY  94           HA2      GLY  94  -6.073 -10.902  -1.617
  768    HA3  GLY  94           HA3      GLY  94  -4.927 -11.776  -2.660
  769    H    GLN  95           H        GLN  95  -3.773 -11.647  -0.505
  770    HA   GLN  95           HA       GLN  95  -1.666  -9.677  -0.695
  771    HB2  GLN  95           HB2      GLN  95  -1.938  -8.757   1.603
  772    HB3  GLN  95           HB3      GLN  95  -3.251  -8.319   0.521
  773    HG2  GLN  95           HG2      GLN  95  -4.681 -10.102   1.571
  774    HG3  GLN  95           HG3      GLN  95  -3.369 -10.451   2.705
  775   HE21  GLN  95          HE22      GLN  95  -5.666  -7.951   1.579
  776   HE22  GLN  95          HE21      GLN  95  -5.659  -7.031   3.076
  777    H    LYS  96           H        LYS  96   0.013 -10.127   1.063
  778    HA   LYS  96           HA       LYS  96  -0.183 -12.947   2.052
  779    HB2  LYS  96           HB2      LYS  96   2.245 -13.181   1.869
  780    HB3  LYS  96           HB3      LYS  96   1.491 -12.931   0.298
  781    HG2  LYS  96           HG2      LYS  96   2.191 -10.555   0.326
  782    HG3  LYS  96           HG3      LYS  96   2.996 -10.789   1.880
  783    HD2  LYS  96           HD2      LYS  96   3.716 -12.283  -0.675
  784    HD3  LYS  96           HD3      LYS  96   4.499 -10.795  -0.128
  785    HE2  LYS  96           HE2      LYS  96   5.235 -11.924   1.971
  786    HE3  LYS  96           HE3      LYS  96   4.471 -13.426   1.437
  787    HZ1  LYS  96           HZ1      LYS  96   6.838 -13.419   0.935
  788    HZ2  LYS  96           HZ2      LYS  96   6.003 -13.461  -0.466
  789    HZ3  LYS  96           HZ3      LYS  96   6.713 -12.069   0.025
  790    H    GLN  97           H        GLN  97  -0.191 -13.007   4.266
  791    HA   GLN  97           HA       GLN  97   0.547 -10.467   5.662
  792    HB2  GLN  97           HB2      GLN  97  -1.426 -12.562   6.611
  793    HB3  GLN  97           HB3      GLN  97  -1.084 -10.972   7.315
  794    HG2  GLN  97           HG2      GLN  97  -1.924  -9.983   5.099
  795    HG3  GLN  97           HG3      GLN  97  -2.494 -11.603   4.699
  796   HE21  GLN  97          HE22      GLN  97  -2.800  -8.932   7.086
  797   HE22  GLN  97          HE21      GLN  97  -4.419  -9.347   7.612
  798    H    LYS  98           H        LYS  98   2.222 -10.578   7.056
  799    HA   LYS  98           HA       LYS  98   3.020 -13.250   8.171
  800    HB2  LYS  98           HB2      LYS  98   4.746 -12.242   6.777
  801    HB3  LYS  98           HB3      LYS  98   4.676 -10.729   7.715
  802    HG2  LYS  98           HG2      LYS  98   5.700 -11.707   9.544
  803    HG3  LYS  98           HG3      LYS  98   5.384 -13.367   9.019
  804    HD2  LYS  98           HD2      LYS  98   7.156 -11.556   7.383
  805    HD3  LYS  98           HD3      LYS  98   7.813 -12.318   8.820
  806    HE2  LYS  98           HE2      LYS  98   6.389 -14.005   6.722
  807    HE3  LYS  98           HE3      LYS  98   8.018 -13.425   6.414
  808    HZ1  LYS  98           HZ1      LYS  98   8.087 -15.611   7.412
  809    HZ2  LYS  98           HZ2      LYS  98   8.784 -14.552   8.430
  810    HZ3  LYS  98           HZ3      LYS  98   7.282 -15.143   8.754
  811    H    TRP  99           H        TRP  99   3.137 -13.365  10.454
  812    HA   TRP  99           HA       TRP  99   2.004 -10.983  11.858
  813    HB2  TRP  99           HB2      TRP  99   1.242 -13.893  12.129
  814    HB3  TRP  99           HB3      TRP  99   0.690 -12.585  13.175
  815    HD1  TRP  99           HD1      TRP  99   0.280 -13.961   9.620
  816    HE1  TRP  99           HE1      TRP  99  -1.859 -13.008   8.601
  817    HE3  TRP  99           HE3      TRP  99  -0.965 -10.622  13.301
  818    HZ2  TRP  99           HZ2      TRP  99  -3.916 -11.154   9.332
  819    HZ3  TRP  99           HZ3      TRP  99  -3.005  -9.260  13.103
  820    HH2  TRP  99           HH2      TRP  99  -4.528  -9.534  11.147
  821    H    PHE 100           H        PHE 100   2.576 -10.724  14.013
  822    HA   PHE 100           HA       PHE 100   5.006 -12.202  14.916
  823    HB2  PHE 100           HB2      PHE 100   4.517  -9.196  14.742
  824    HB3  PHE 100           HB3      PHE 100   5.902  -9.958  15.509
  825    HD1  PHE 100           HD2      PHE 100   4.235  -9.248  12.236
  826    HD2  PHE 100           HD1      PHE 100   7.723 -10.848  14.226
  827    HE1  PHE 100           HE2      PHE 100   5.534  -9.118  10.123
  828    HE2  PHE 100           HE1      PHE 100   9.000 -10.723  12.102
  829    HZ   PHE 100           HZ       PHE 100   7.915  -9.840  10.058
  830    H    LEU 101           H        LEU 101   4.888 -12.745  17.048
  831    HA   LEU 101           HA       LEU 101   2.780 -11.498  18.767
  832    HB2  LEU 101           HB2      LEU 101   2.579 -13.834  19.017
  833    HB3  LEU 101           HB3      LEU 101   4.327 -14.084  18.975
  834    HG   LEU 101           HG       LEU 101   4.529 -13.027  21.210
  835   HD11  LEU 101          HD11      LEU 101   2.545 -11.515  21.132
  836   HD12  LEU 101          HD12      LEU 101   1.517 -12.944  21.202
  837   HD13  LEU 101          HD13      LEU 101   2.610 -12.517  22.570
  838   HD21  LEU 101          HD21      LEU 101   2.476 -15.268  21.231
  839   HD22  LEU 101          HD22      LEU 101   4.220 -15.510  21.016
  840   HD23  LEU 101          HD23      LEU 101   3.605 -14.825  22.531
  841    H    LEU 102           H        LEU 102   3.509  -9.869  19.970
  842    HA   LEU 102           HA       LEU 102   6.363  -9.933  20.824
  843    HB2  LEU 102           HB2      LEU 102   4.688  -7.420  20.860
  844    HB3  LEU 102           HB3      LEU 102   6.423  -7.561  20.939
  845    HG   LEU 102           HG       LEU 102   4.714  -8.052  18.483
  846   HD11  LEU 102          HD11      LEU 102   4.877  -5.661  19.219
  847   HD12  LEU 102          HD12      LEU 102   6.645  -5.770  19.027
  848   HD13  LEU 102          HD13      LEU 102   5.577  -5.982  17.617
  849   HD21  LEU 102          HD21      LEU 102   7.737  -8.049  18.845
  850   HD22  LEU 102          HD22      LEU 102   6.711  -9.429  18.359
  851   HD23  LEU 102          HD23      LEU 102   6.884  -8.060  17.291
  852    H    GLN 103           H        GLN 103   6.685  -9.305  23.083
  853    HA   GLN 103           HA       GLN 103   4.119  -9.318  24.655
  854    HB2  GLN 103           HB2      GLN 103   5.133 -11.026  25.455
  855    HB3  GLN 103           HB3      GLN 103   6.794 -10.371  25.378
  856    HG2  GLN 103           HG2      GLN 103   6.440  -9.086  27.386
  857    HG3  GLN 103           HG3      GLN 103   4.690  -9.029  27.156
  858   HE21  GLN 103          HE22      GLN 103   3.404 -11.039  27.417
  859   HE22  GLN 103          HE21      GLN 103   3.967 -12.194  28.620
  860    H    LEU 104           H        LEU 104   3.538  -7.412  25.482
  861    HA   LEU 104           HA       LEU 104   4.980  -4.950  25.129
  862    HB2  LEU 104           HB2      LEU 104   2.364  -5.894  26.063
  863    HB3  LEU 104           HB3      LEU 104   2.992  -4.760  27.222
  864    HG   LEU 104           HG       LEU 104   2.926  -4.163  24.243
  865   HD11  LEU 104          HD11      LEU 104   0.765  -3.563  26.300
  866   HD12  LEU 104          HD12      LEU 104   0.839  -2.917  24.644
  867   HD13  LEU 104          HD13      LEU 104   0.620  -4.660  24.894
  868   HD21  LEU 104          HD21      LEU 104   4.423  -2.718  25.258
  869   HD22  LEU 104          HD22      LEU 104   2.927  -1.775  25.242
  870   HD23  LEU 104          HD23      LEU 104   3.490  -2.548  26.744
  871    H    VAL 105           H        VAL 105   6.268  -3.816  26.614
  872    HA   VAL 105           HA       VAL 105   7.465  -5.593  28.595
  873    HB   VAL 105           HB       VAL 105   8.306  -2.946  27.426
  874   HG11  VAL 105          HG11      VAL 105  10.553  -3.376  28.362
  875   HG12  VAL 105          HG12      VAL 105   9.346  -3.104  29.623
  876   HG13  VAL 105          HG13      VAL 105   9.900  -4.757  29.275
  877   HG21  VAL 105          HG21      VAL 105   9.616  -5.644  26.978
  878   HG22  VAL 105          HG22      VAL 105   8.340  -5.050  25.918
  879   HG23  VAL 105          HG23      VAL 105   9.838  -4.138  26.041
  880    H    SER 106           H        SER 106   5.960  -2.338  28.571
  881    HA   SER 106           HA       SER 106   6.022  -2.230  31.534
  882    HB2  SER 106           HB2      SER 106   4.892  -0.350  29.429
  883    HB3  SER 106           HB3      SER 106   4.885  -0.046  31.175
  884    HG   SER 106           HG       SER 106   7.071  -0.209  29.390
  885    H    GLY 107           H        GLY 107   3.932  -3.321  29.009
  886    HA2  GLY 107           HA2      GLY 107   2.047  -4.772  29.475
  887    HA3  GLY 107           HA3      GLY 107   1.755  -3.888  30.976
  888    H    ASP 108           H        ASP 108  -0.435  -3.792  30.012
  889    HA   ASP 108           HA       ASP 108  -1.069  -2.625  27.617
  890    HB2  ASP 108           HB2      ASP 108  -3.254  -2.805  28.282
  891    HB3  ASP 108           HB3      ASP 108  -2.432  -4.060  29.214
  892    H    ALA 109           H        ALA 109  -0.213  -1.028  30.519
  893    HA   ALA 109           HA       ALA 109  -1.304   1.542  30.287
  894    HB1  ALA 109           HB1      ALA 109   0.784   2.304  31.401
  895    HB2  ALA 109           HB2      ALA 109   0.171   0.807  32.145
  896    HB3  ALA 109           HB3      ALA 109   1.552   0.753  31.014
  897    H    GLU 110           H        GLU 110   1.288   0.044  28.383
  898    HA   GLU 110           HA       GLU 110   1.892   2.555  27.043
  899    HB2  GLU 110           HB2      GLU 110   3.310  -0.080  27.247
  900    HB3  GLU 110           HB3      GLU 110   3.722   1.047  25.950
  901    HG2  GLU 110           HG2      GLU 110   3.696   1.789  28.885
  902    HG3  GLU 110           HG3      GLU 110   5.136   1.293  27.989
  903    H    ILE 111           H        ILE 111  -0.637   2.014  26.448
  904    HA   ILE 111           HA       ILE 111  -0.403   1.435  23.553
  905    HB   ILE 111           HB       ILE 111  -2.747   0.504  25.275
  906   HG12  ILE 111          HG12      ILE 111  -1.031  -1.262  23.470
  907   HG13  ILE 111          HG13      ILE 111  -0.589  -1.008  25.176
  908   HG21  ILE 111          HG21      ILE 111  -2.185   0.401  22.286
  909   HG22  ILE 111          HG22      ILE 111  -3.574  -0.396  23.055
  910   HG23  ILE 111          HG23      ILE 111  -3.467   1.361  23.067
  911   HD11  ILE 111          HD11      ILE 111  -1.856  -3.086  24.943
  912   HD12  ILE 111          HD12      ILE 111  -2.756  -1.926  25.925
  913   HD13  ILE 111          HD13      ILE 111  -3.229  -2.221  24.250
  914    H    ASN 112           H        ASN 112  -1.107   3.071  22.382
  915    HA   ASN 112           HA       ASN 112  -2.912   5.177  23.479
  916    HB2  ASN 112           HB2      ASN 112  -0.648   6.087  23.080
  917    HB3  ASN 112           HB3      ASN 112  -0.620   5.376  21.469
  918   HD21  ASN 112          HD22      ASN 112  -0.109   7.642  20.726
  919   HD22  ASN 112          HD21      ASN 112  -1.490   8.681  20.416
  920    H    MET 113           H        MET 113  -4.369   5.997  21.685
  921    HA   MET 113           HA       MET 113  -4.987   3.895  19.619
  922    HB2  MET 113           HB2      MET 113  -6.878   5.505  21.377
  923    HB3  MET 113           HB3      MET 113  -7.382   4.402  20.094
  924    HG2  MET 113           HG2      MET 113  -5.554   3.229  22.157
  925    HG3  MET 113           HG3      MET 113  -7.151   3.736  22.725
  926    HE1  MET 113           HE1      MET 113  -5.020   1.566  20.449
  927    HE2  MET 113           HE2      MET 113  -5.364   0.605  21.904
  928    HE3  MET 113           HE3      MET 113  -5.974   0.069  20.326
  929    H    GLN 114           H        GLN 114  -4.076   7.108  20.119
  930    HA   GLN 114           HA       GLN 114  -5.163   7.990  17.554
  931    HB2  GLN 114           HB2      GLN 114  -5.393  10.281  18.564
  932    HB3  GLN 114           HB3      GLN 114  -6.676   9.105  18.863
  933    HG2  GLN 114           HG2      GLN 114  -5.873   8.670  21.137
  934    HG3  GLN 114           HG3      GLN 114  -4.486   9.738  20.887
  935   HE21  GLN 114          HE22      GLN 114  -4.930  12.103  20.561
  936   HE22  GLN 114          HE21      GLN 114  -6.388  12.791  21.239
  937    H    THR 115           H        THR 115  -3.375   7.393  16.748
  938    HA   THR 115           HA       THR 115  -0.724   8.239  17.522
  939    HB   THR 115           HB       THR 115  -0.424   6.979  15.229
  940    HG1  THR 115           HG1      THR 115  -2.169   5.628  14.731
  941   HG21  THR 115          HG21      THR 115   0.087   5.987  17.450
  942   HG22  THR 115          HG22      THR 115  -1.634   5.654  17.742
  943   HG23  THR 115          HG23      THR 115  -0.759   4.772  16.475
  944    H    SER 116           H        SER 116  -2.724   8.459  14.660
  945    HA   SER 116           HA       SER 116  -1.708  11.001  13.674
  946    HB2  SER 116           HB2      SER 116  -4.203   9.398  12.960
  947    HB3  SER 116           HB3      SER 116  -3.525  10.743  12.021
  948    HG   SER 116           HG       SER 116  -2.857   8.683  11.214
  949    H    SER 117           H        SER 117  -3.418  12.857  13.277
  950    HA   SER 117           HA       SER 117  -4.485  13.809  15.710
  951    HB2  SER 117           HB2      SER 117  -5.417  14.518  12.897
  952    HB3  SER 117           HB3      SER 117  -5.522  15.525  14.348
  953    HG   SER 117           HG       SER 117  -3.728  16.098  13.016
  954    H    THR 118           H        THR 118  -5.900  11.852  13.089
  955    HA   THR 118           HA       THR 118  -8.499  11.544  14.279
  956    HB   THR 118           HB       THR 118  -8.048   9.525  12.492
  957    HG1  THR 118           HG1      THR 118  -7.197  10.528  10.655
  958   HG21  THR 118          HG21      THR 118  -9.635  10.730  11.082
  959   HG22  THR 118          HG22      THR 118 -10.103  10.675  12.787
  960   HG23  THR 118          HG23      THR 118  -9.419  12.181  12.104
  961    HA   PRO 119           HA       PRO 119  -7.096   8.072  16.819
  962    HB2  PRO 119           HB2      PRO 119  -9.972   7.263  16.646
  963    HB3  PRO 119           HB3      PRO 119  -8.933   7.433  18.094
  964    HG2  PRO 119           HG2      PRO 119 -10.836   9.302  17.486
  965    HG3  PRO 119           HG3      PRO 119  -9.244   9.774  18.161
  966    HD2  PRO 119           HD2      PRO 119 -10.152   9.874  15.265
  967    HD3  PRO 119           HD3      PRO 119  -9.181  11.063  16.193
  968    H    GLU 120           H        GLU 120  -6.316   6.147  15.981
  969    HA   GLU 120           HA       GLU 120  -7.396   5.176  13.389
  970    HB2  GLU 120           HB2      GLU 120  -4.912   4.460  14.992
  971    HB3  GLU 120           HB3      GLU 120  -5.504   3.427  13.694
  972    HG2  GLU 120           HG2      GLU 120  -4.712   6.354  13.413
  973    HG3  GLU 120           HG3      GLU 120  -3.777   4.965  12.871
  974    H    PHE 121           H        PHE 121  -7.283   4.356  16.843
  975    HA   PHE 121           HA       PHE 121  -9.272   2.204  16.269
  976    HB2  PHE 121           HB2      PHE 121  -7.385   2.494  18.589
  977    HB3  PHE 121           HB3      PHE 121  -8.668   1.293  18.485
  978    HD1  PHE 121           HD1      PHE 121  -8.552  -0.070  16.051
  979    HD2  PHE 121           HD2      PHE 121  -5.258   1.637  18.237
  980    HE1  PHE 121           HE1      PHE 121  -6.994  -1.657  14.944
  981    HE2  PHE 121           HE2      PHE 121  -3.761  -0.065  17.297
  982    HZ   PHE 121           HZ       PHE 121  -4.600  -1.675  15.587
  983    H    ASP 122           H        ASP 122 -11.125   2.208  17.443
  984    HA   ASP 122           HA       ASP 122 -11.956   4.747  18.750
  985    HB2  ASP 122           HB2      ASP 122 -13.558   3.879  17.205
  986    HB3  ASP 122           HB3      ASP 122 -13.397   2.239  17.842
  987    H    GLY 123           H        GLY 123 -11.003   1.382  19.444
  988    HA2  GLY 123           HA2      GLY 123 -10.900   1.850  22.308
  989    HA3  GLY 123           HA3      GLY 123 -12.243   0.800  21.770
  990    H    TRP 124           H        TRP 124 -10.310  -0.280  23.445
  991    HA   TRP 124           HA       TRP 124  -9.649  -2.488  21.746
  992    HB2  TRP 124           HB2      TRP 124  -7.418  -2.476  21.665
  993    HB3  TRP 124           HB3      TRP 124  -7.559  -0.770  21.950
  994    HD1  TRP 124           HD1      TRP 124  -6.496  -4.018  23.522
  995    HE1  TRP 124           HE1      TRP 124  -5.356  -3.659  25.751
  996    HE3  TRP 124           HE3      TRP 124  -7.292   1.017  23.996
  997    HZ2  TRP 124           HZ2      TRP 124  -4.857  -1.427  27.579
  998    HZ3  TRP 124           HZ3      TRP 124  -6.428   2.244  25.972
  999    HH2  TRP 124           HH2      TRP 124  -5.213   1.028  27.770
 1000    H    ARG 125           H        ARG 125  -8.989  -4.400  23.026
 1001    HA   ARG 125           HA       ARG 125  -9.576  -4.311  25.897
 1002    HB2  ARG 125           HB2      ARG 125 -11.330  -5.986  25.823
 1003    HB3  ARG 125           HB3      ARG 125 -11.805  -4.607  24.842
 1004    HG2  ARG 125           HG2      ARG 125 -10.947  -5.948  22.798
 1005    HG3  ARG 125           HG3      ARG 125 -10.847  -7.341  23.861
 1006    HD2  ARG 125           HD2      ARG 125 -13.379  -5.697  23.436
 1007    HD3  ARG 125           HD3      ARG 125 -12.971  -7.136  22.493
 1008    HE   ARG 125           HE       ARG 125 -12.861  -7.767  25.279
 1009   HH11  ARG 125          HH11      ARG 125 -15.267  -6.964  22.786
 1010   HH12  ARG 125          HH12      ARG 125 -16.548  -7.843  23.539
 1011   HH21  ARG 125          HH21      ARG 125 -14.573  -8.962  26.276
 1012   HH22  ARG 125          HH22      ARG 125 -16.134  -9.020  25.551
 1013    H    TRP 126           H        TRP 126  -9.179  -6.580  26.809
 1014    HA   TRP 126           HA       TRP 126  -7.129  -8.047  25.223
 1015    HB2  TRP 126           HB2      TRP 126  -7.311  -7.570  28.213
 1016    HB3  TRP 126           HB3      TRP 126  -6.311  -8.812  27.485
 1017    HD1  TRP 126           HD1      TRP 126  -6.562  -4.950  27.646
 1018    HE1  TRP 126           HE1      TRP 126  -4.221  -4.011  27.532
 1019    HE3  TRP 126           HE3      TRP 126  -4.006  -9.225  26.436
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.573  -4.897  26.771
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.583  -9.117  25.966
 1022    HH2  TRP 126           HH2      TRP 126  -0.340  -6.968  26.186
 1023    H    VAL 127           H        VAL 127  -7.513 -10.245  24.980
 1024    HA   VAL 127           HA       VAL 127  -9.974 -11.438  26.141
 1025    HB   VAL 127           HB       VAL 127 -10.271 -12.235  23.617
 1026   HG11  VAL 127          HG11      VAL 127 -11.983 -11.079  24.896
 1027   HG12  VAL 127          HG12      VAL 127 -11.185  -9.514  24.624
 1028   HG13  VAL 127          HG13      VAL 127 -11.907 -10.400  23.264
 1029   HG21  VAL 127          HG21      VAL 127  -8.302 -11.042  22.702
 1030   HG22  VAL 127          HG22      VAL 127  -9.823 -10.596  21.920
 1031   HG23  VAL 127          HG23      VAL 127  -9.078  -9.489  23.087
 1032    H    SER 128           H        SER 128 -10.035 -13.766  26.044
 1033    HA   SER 128           HA       SER 128  -7.540 -15.170  25.980
 1034    HB2  SER 128           HB2      SER 128 -10.385 -16.188  25.569
 1035    HB3  SER 128           HB3      SER 128  -8.978 -17.161  26.060
 1036    HG   SER 128           HG       SER 128 -10.341 -16.481  27.842
 1037    H    TYR 129           H        TYR 129  -6.612 -16.396  24.285
 1038    HA   TYR 129           HA       TYR 129  -6.569 -15.201  21.832
 1039    HB2  TYR 129           HB2      TYR 129  -5.698 -17.806  21.260
 1040    HB3  TYR 129           HB3      TYR 129  -4.740 -16.440  21.779
 1041    HD1  TYR 129           HD2      TYR 129  -6.871 -19.173  23.275
 1042    HD2  TYR 129           HD1      TYR 129  -3.348 -16.711  23.651
 1043    HE1  TYR 129           HE2      TYR 129  -6.335 -20.290  25.414
 1044    HE2  TYR 129           HE1      TYR 129  -2.774 -17.873  25.770
 1045    HH   TYR 129           HH       TYR 129  -4.865 -20.379  27.252
 1046    H    TRP 130           H        TRP 130  -8.804 -17.889  22.639
 1047    HA   TRP 130           HA       TRP 130  -9.456 -18.199  19.805
 1048    HB2  TRP 130           HB2      TRP 130 -10.758 -19.515  22.200
 1049    HB3  TRP 130           HB3      TRP 130 -10.863 -20.014  20.514
 1050    HD1  TRP 130           HD1      TRP 130  -9.278 -21.151  23.457
 1051    HE1  TRP 130           HE1      TRP 130  -7.034 -22.328  23.099
 1052    HE3  TRP 130           HE3      TRP 130  -8.351 -19.747  18.598
 1053    HZ2  TRP 130           HZ2      TRP 130  -5.024 -22.503  21.071
 1054    HZ3  TRP 130           HZ3      TRP 130  -6.258 -20.457  17.482
 1055    HH2  TRP 130           HH2      TRP 130  -4.567 -21.789  18.715
 1056    H    TYR 131           H        TYR 131 -10.658 -16.139  22.336
 1057    HA   TYR 131           HA       TYR 131 -13.377 -16.019  21.459
 1058    HB2  TYR 131           HB2      TYR 131 -12.637 -15.363  23.681
 1059    HB3  TYR 131           HB3      TYR 131 -11.793 -13.968  23.015
 1060    HD1  TYR 131           HD1      TYR 131 -13.123 -12.055  22.012
 1061    HD2  TYR 131           HD2      TYR 131 -15.055 -15.440  23.884
 1062    HE1  TYR 131           HE1      TYR 131 -15.256 -10.805  22.066
 1063    HE2  TYR 131           HE2      TYR 131 -17.185 -14.187  23.948
 1064    HH   TYR 131           HH       TYR 131 -17.529 -10.838  22.665
 1065    HA   PRO 132           HA       PRO 132 -12.176 -12.078  18.995
 1066    HB2  PRO 132           HB2      PRO 132  -9.690 -11.950  17.769
 1067    HB3  PRO 132           HB3      PRO 132 -10.068 -11.251  19.376
 1068    HG2  PRO 132           HG2      PRO 132  -8.802 -13.935  18.821
 1069    HG3  PRO 132           HG3      PRO 132  -8.256 -12.648  19.952
 1070    HD2  PRO 132           HD2      PRO 132  -9.695 -14.696  20.832
 1071    HD3  PRO 132           HD3      PRO 132 -10.067 -13.062  21.437
 1072    H    VAL 133           H        VAL 133 -10.942 -15.276  18.182
 1073    HA   VAL 133           HA       VAL 133 -11.245 -15.182  15.351
 1074    HB   VAL 133           HB       VAL 133 -11.413 -17.607  17.182
 1075   HG11  VAL 133          HG11      VAL 133 -11.980 -18.077  14.822
 1076   HG12  VAL 133          HG12      VAL 133 -10.427 -17.372  14.307
 1077   HG13  VAL 133          HG13      VAL 133 -10.478 -18.845  15.314
 1078   HG21  VAL 133          HG21      VAL 133  -9.350 -16.402  17.782
 1079   HG22  VAL 133          HG22      VAL 133  -8.951 -17.837  16.841
 1080   HG23  VAL 133          HG23      VAL 133  -8.921 -16.244  16.065
 1081    H    ARG 134           H        ARG 134 -13.591 -15.597  18.010
 1082    HA   ARG 134           HA       ARG 134 -15.658 -16.858  16.445
 1083    HB2  ARG 134           HB2      ARG 134 -16.092 -14.980  18.804
 1084    HB3  ARG 134           HB3      ARG 134 -17.145 -16.272  18.236
 1085    HG2  ARG 134           HG2      ARG 134 -14.456 -16.724  19.547
 1086    HG3  ARG 134           HG3      ARG 134 -15.993 -16.710  20.402
 1087    HD2  ARG 134           HD2      ARG 134 -15.359 -18.550  18.082
 1088    HD3  ARG 134           HD3      ARG 134 -15.060 -18.967  19.794
 1089    HE   ARG 134           HE       ARG 134 -17.739 -18.173  19.637
 1090   HH11  ARG 134          HH11      ARG 134 -15.759 -20.834  18.344
 1091   HH12  ARG 134          HH12      ARG 134 -17.075 -21.943  18.236
 1092   HH21  ARG 134          HH21      ARG 134 -19.491 -19.655  19.487
 1093   HH22  ARG 134          HH22      ARG 134 -19.238 -21.260  18.911
 1094    H    GLN 135           H        GLN 135 -14.579 -13.479  16.809
 1095    HA   GLN 135           HA       GLN 135 -17.185 -12.533  15.825
 1096    HB2  GLN 135           HB2      GLN 135 -14.871 -11.031  16.996
 1097    HB3  GLN 135           HB3      GLN 135 -16.342 -10.260  16.418
 1098    HG2  GLN 135           HG2      GLN 135 -16.212 -12.453  18.519
 1099    HG3  GLN 135           HG3      GLN 135 -16.436 -10.740  18.879
 1100   HE21  GLN 135          HE22      GLN 135 -18.162 -13.120  19.530
 1101   HE22  GLN 135          HE21      GLN 135 -19.727 -12.726  18.860
 1102    H    VAL 136           H        VAL 136 -13.987 -13.034  14.466
 1103    HA   VAL 136           HA       VAL 136 -14.435 -11.143  12.285
 1104    HB   VAL 136           HB       VAL 136 -12.492 -12.631  11.302
 1105   HG11  VAL 136          HG11      VAL 136 -10.867 -11.057  12.235
 1106   HG12  VAL 136          HG12      VAL 136 -12.330 -10.208  11.763
 1107   HG13  VAL 136          HG13      VAL 136 -12.033 -10.556  13.481
 1108   HG21  VAL 136          HG21      VAL 136 -10.928 -13.469  12.859
 1109   HG22  VAL 136          HG22      VAL 136 -11.848 -12.881  14.243
 1110   HG23  VAL 136          HG23      VAL 136 -12.476 -14.236  13.265
 1111    H    VAL 137           H        VAL 137 -14.788 -11.675  10.082
 1112    HA   VAL 137           HA       VAL 137 -16.871 -13.578   9.640
 1113    HB   VAL 137           HB       VAL 137 -16.961 -12.731   7.439
 1114   HG11  VAL 137          HG11      VAL 137 -15.869 -10.361   9.008
 1115   HG12  VAL 137          HG12      VAL 137 -17.001 -10.352   7.648
 1116   HG13  VAL 137          HG13      VAL 137 -17.506 -11.042   9.198
 1117   HG21  VAL 137          HG21      VAL 137 -15.042 -11.297   6.482
 1118   HG22  VAL 137          HG22      VAL 137 -14.019 -12.012   7.760
 1119   HG23  VAL 137          HG23      VAL 137 -14.824 -13.048   6.545
 1120    H    SER 138           H        SER 138 -16.619 -15.010   7.475
 1121    HA   SER 138           HA       SER 138 -15.338 -17.308   8.243
 1122    HB2  SER 138           HB2      SER 138 -16.011 -16.467   5.396
 1123    HB3  SER 138           HB3      SER 138 -15.976 -18.122   6.049
 1124    HG   SER 138           HG       SER 138 -18.125 -17.286   5.979
 1125    H    PHE 139           H        PHE 139 -14.122 -14.992   5.731
 1126    HA   PHE 139           HA       PHE 139 -11.779 -16.527   5.168
 1127    HB2  PHE 139           HB2      PHE 139 -12.253 -13.554   4.715
 1128    HB3  PHE 139           HB3      PHE 139 -11.027 -14.547   3.941
 1129    HD1  PHE 139           HD1      PHE 139 -11.700 -16.386   2.363
 1130    HD2  PHE 139           HD2      PHE 139 -14.495 -13.445   3.833
 1131    HE1  PHE 139           HE1      PHE 139 -13.279 -16.963   0.527
 1132    HE2  PHE 139           HE2      PHE 139 -16.073 -14.038   2.011
 1133    HZ   PHE 139           HZ       PHE 139 -15.468 -15.794   0.357
 1134    H    LYS 140           H        LYS 140 -12.297 -13.638   7.243
 1135    HA   LYS 140           HA       LYS 140  -9.507 -13.448   7.986
 1136    HB2  LYS 140           HB2      LYS 140 -12.029 -12.260   9.186
 1137    HB3  LYS 140           HB3      LYS 140 -10.408 -11.944   9.840
 1138    HG2  LYS 140           HG2      LYS 140  -9.681 -11.081   7.635
 1139    HG3  LYS 140           HG3      LYS 140 -11.324 -11.299   7.009
 1140    HD2  LYS 140           HD2      LYS 140 -10.601  -9.525   9.385
 1141    HD3  LYS 140           HD3      LYS 140 -10.804  -8.970   7.697
 1142    HE2  LYS 140           HE2      LYS 140 -13.144  -9.888   7.754
 1143    HE3  LYS 140           HE3      LYS 140 -12.907 -10.258   9.477
 1144    HZ1  LYS 140           HZ1      LYS 140 -14.020  -8.063   9.127
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.564  -7.818   9.836
 1146    HZ3  LYS 140           HZ3      LYS 140 -12.770  -7.525   8.238
 1147    H    ARG 141           H        ARG 141 -12.334 -14.977   9.634
 1148    HA   ARG 141           HA       ARG 141 -10.850 -15.646  11.959
 1149    HB2  ARG 141           HB2      ARG 141 -12.493 -17.157  12.609
 1150    HB3  ARG 141           HB3      ARG 141 -13.280 -15.799  11.825
 1151    HG2  ARG 141           HG2      ARG 141 -13.644 -17.179   9.805
 1152    HG3  ARG 141           HG3      ARG 141 -12.794 -18.533  10.559
 1153    HD2  ARG 141           HD2      ARG 141 -15.193 -18.829  10.733
 1154    HD3  ARG 141           HD3      ARG 141 -14.458 -18.631  12.341
 1155    HE   ARG 141           HE       ARG 141 -15.248 -16.068  11.600
 1156   HH11  ARG 141          HH11      ARG 141 -16.961 -19.164  12.103
 1157   HH12  ARG 141          HH12      ARG 141 -18.405 -18.404  12.670
 1158   HH21  ARG 141          HH21      ARG 141 -17.075 -15.108  12.401
 1159   HH22  ARG 141          HH22      ARG 141 -18.480 -16.022  12.865
 1160    H    ASP 142           H        ASP 142 -10.756 -17.341   8.810
 1161    HA   ASP 142           HA       ASP 142  -9.267 -19.573   9.827
 1162    HB2  ASP 142           HB2      ASP 142 -10.249 -19.627   7.581
 1163    HB3  ASP 142           HB3      ASP 142  -9.145 -18.334   7.060
 1164    H    VAL 143           H        VAL 143  -8.247 -16.366   8.581
 1165    HA   VAL 143           HA       VAL 143  -5.441 -16.841   8.970
 1166    HB   VAL 143           HB       VAL 143  -7.190 -14.381   8.640
 1167   HG11  VAL 143          HG11      VAL 143  -4.198 -14.345   9.163
 1168   HG12  VAL 143          HG12      VAL 143  -5.135 -12.993   8.488
 1169   HG13  VAL 143          HG13      VAL 143  -5.445 -13.546  10.131
 1170   HG21  VAL 143          HG21      VAL 143  -4.952 -15.637   6.994
 1171   HG22  VAL 143          HG22      VAL 143  -6.698 -15.767   6.669
 1172   HG23  VAL 143          HG23      VAL 143  -5.887 -14.192   6.553
 1173    H    TYR 144           H        TYR 144  -7.940 -15.334  11.099
 1174    HA   TYR 144           HA       TYR 144  -6.073 -14.639  13.113
 1175    HB2  TYR 144           HB2      TYR 144  -9.084 -15.015  13.147
 1176    HB3  TYR 144           HB3      TYR 144  -8.180 -14.623  14.590
 1177    HD1  TYR 144           HD2      TYR 144  -7.692 -13.159  11.087
 1178    HD2  TYR 144           HD1      TYR 144  -8.912 -12.505  15.180
 1179    HE1  TYR 144           HE2      TYR 144  -7.722 -10.760  10.681
 1180    HE2  TYR 144           HE1      TYR 144  -8.960 -10.075  14.753
 1181    HH   TYR 144           HH       TYR 144  -8.208  -8.652  11.549
 1182    H    ARG 145           H        ARG 145  -7.987 -17.701  12.688
 1183    HA   ARG 145           HA       ARG 145  -7.035 -18.760  15.187
 1184    HB2  ARG 145           HB2      ARG 145  -8.120 -20.713  14.685
 1185    HB3  ARG 145           HB3      ARG 145  -9.012 -19.551  13.715
 1186    HG2  ARG 145           HG2      ARG 145  -7.263 -20.337  11.841
 1187    HG3  ARG 145           HG3      ARG 145  -7.165 -21.780  12.853
 1188    HD2  ARG 145           HD2      ARG 145  -9.659 -21.986  12.629
 1189    HD3  ARG 145           HD3      ARG 145  -9.647 -20.485  11.688
 1190    HE   ARG 145           HE       ARG 145  -8.610 -21.548   9.851
 1191   HH11  ARG 145          HH21      ARG 145  -9.179 -23.991  12.407
 1192   HH12  ARG 145          HH22      ARG 145  -8.993 -25.308  11.310
 1193   HH21  ARG 145          HH11      ARG 145  -8.419 -23.152   8.504
 1194   HH22  ARG 145          HH12      ARG 145  -8.555 -24.838   8.974
 1195    H    ARG 146           H        ARG 146  -5.658 -18.957  11.815
 1196    HA   ARG 146           HA       ARG 146  -3.458 -20.599  12.538
 1197    HB2  ARG 146           HB2      ARG 146  -4.046 -18.614  10.304
 1198    HB3  ARG 146           HB3      ARG 146  -2.371 -19.035  10.606
 1199    HG2  ARG 146           HG2      ARG 146  -2.976 -20.571   9.017
 1200    HG3  ARG 146           HG3      ARG 146  -3.047 -21.474  10.530
 1201    HD2  ARG 146           HD2      ARG 146  -5.573 -21.082  10.478
 1202    HD3  ARG 146           HD3      ARG 146  -5.351 -20.460   8.836
 1203    HE   ARG 146           HE       ARG 146  -4.693 -23.224   9.821
 1204   HH11  ARG 146          HH21      ARG 146  -5.985 -21.276   7.104
 1205   HH12  ARG 146          HH22      ARG 146  -5.594 -22.467   5.920
 1206   HH21  ARG 146          HH11      ARG 146  -4.413 -24.865   8.250
 1207   HH22  ARG 146          HH12      ARG 146  -4.853 -24.596   6.607
 1208    H    VAL 147           H        VAL 147  -3.721 -17.011  12.538
 1209    HA   VAL 147           HA       VAL 147  -1.154 -16.436  13.428
 1210    HB   VAL 147           HB       VAL 147  -3.829 -15.019  13.816
 1211   HG11  VAL 147          HG11      VAL 147  -2.293 -14.083  15.495
 1212   HG12  VAL 147          HG12      VAL 147  -1.058 -13.841  14.241
 1213   HG13  VAL 147          HG13      VAL 147  -2.582 -12.926  14.190
 1214   HG21  VAL 147          HG21      VAL 147  -1.515 -14.583  11.896
 1215   HG22  VAL 147          HG22      VAL 147  -3.034 -15.319  11.455
 1216   HG23  VAL 147          HG23      VAL 147  -3.034 -13.634  11.948
 1217    H    MET 148           H        MET 148  -3.954 -17.470  15.317
 1218    HA   MET 148           HA       MET 148  -2.746 -16.788  17.879
 1219    HB2  MET 148           HB2      MET 148  -5.238 -18.375  17.179
 1220    HB3  MET 148           HB3      MET 148  -4.684 -18.088  18.830
 1221    HG2  MET 148           HG2      MET 148  -5.407 -15.884  16.861
 1222    HG3  MET 148           HG3      MET 148  -6.487 -16.577  18.052
 1223    HE1  MET 148           HE1      MET 148  -2.809 -14.571  17.968
 1224    HE2  MET 148           HE2      MET 148  -4.220 -13.976  17.061
 1225    HE3  MET 148           HE3      MET 148  -3.698 -13.135  18.529
 1226    H    LYS 149           H        LYS 149  -3.512 -19.869  16.144
 1227    HA   LYS 149           HA       LYS 149  -2.226 -21.554  18.040
 1228    HB2  LYS 149           HB2      LYS 149  -3.828 -22.387  16.617
 1229    HB3  LYS 149           HB3      LYS 149  -3.022 -21.855  15.142
 1230    HG2  LYS 149           HG2      LYS 149  -1.932 -24.044  16.966
 1231    HG3  LYS 149           HG3      LYS 149  -3.050 -24.328  15.630
 1232    HD2  LYS 149           HD2      LYS 149  -1.282 -23.042  14.171
 1233    HD3  LYS 149           HD3      LYS 149  -0.158 -23.453  15.470
 1234    HE2  LYS 149           HE2      LYS 149  -1.858 -25.419  13.880
 1235    HE3  LYS 149           HE3      LYS 149  -0.163 -25.062  13.566
 1236    HZ1  LYS 149           HZ1      LYS 149   0.367 -25.962  15.794
 1237    HZ2  LYS 149           HZ2      LYS 149  -1.214 -26.328  16.048
 1238    HZ3  LYS 149           HZ3      LYS 149  -0.378 -27.078  14.869
 1239    H    GLU 150           H        GLU 150  -0.794 -19.780  15.217
 1240    HA   GLU 150           HA       GLU 150   1.591 -21.082  15.106
 1241    HB2  GLU 150           HB2      GLU 150   0.594 -19.291  13.575
 1242    HB3  GLU 150           HB3      GLU 150   1.050 -18.107  14.776
 1243    HG2  GLU 150           HG2      GLU 150   2.877 -18.089  13.371
 1244    HG3  GLU 150           HG3      GLU 150   3.429 -19.210  14.588
 1245    H    PHE 151           H        PHE 151   0.591 -18.442  17.282
 1246    HA   PHE 151           HA       PHE 151   3.245 -18.542  18.655
 1247    HB2  PHE 151           HB2      PHE 151   1.146 -16.475  19.173
 1248    HB3  PHE 151           HB3      PHE 151   2.893 -16.426  19.397
 1249    HD1  PHE 151           HD2      PHE 151   4.099 -17.145  16.800
 1250    HD2  PHE 151           HD1      PHE 151   0.587 -14.738  17.690
 1251    HE1  PHE 151           HE2      PHE 151   4.146 -16.185  14.580
 1252    HE2  PHE 151           HE1      PHE 151   0.816 -13.636  15.507
 1253    HZ   PHE 151           HZ       PHE 151   2.559 -14.417  13.913
 1254    H    ALA 152           H        ALA 152   0.101 -19.794  19.105
 1255    HA   ALA 152           HA       ALA 152  -0.556 -19.322  21.728
 1256    HB1  ALA 152           HB1      ALA 152  -2.040 -20.540  20.145
 1257    HB2  ALA 152           HB2      ALA 152  -0.909 -21.901  20.100
 1258    HB3  ALA 152           HB3      ALA 152  -1.781 -21.519  21.597
 1259    H    SER 153           H        SER 153   1.668 -21.773  20.479
 1260    HA   SER 153           HA       SER 153   2.056 -23.149  22.947
 1261    HB2  SER 153           HB2      SER 153   3.948 -23.000  20.566
 1262    HB3  SER 153           HB3      SER 153   3.843 -24.293  21.776
 1263    HG   SER 153           HG       SER 153   2.716 -24.862  19.858
 1264    H    VAL 154           H        VAL 154   3.571 -20.286  21.500
 1265    HA   VAL 154           HA       VAL 154   5.760 -20.200  23.435
 1266    HB   VAL 154           HB       VAL 154   4.709 -18.045  21.561
 1267   HG11  VAL 154          HG11      VAL 154   7.371 -18.266  23.046
 1268   HG12  VAL 154          HG12      VAL 154   6.928 -16.996  21.887
 1269   HG13  VAL 154          HG13      VAL 154   6.072 -17.125  23.438
 1270   HG21  VAL 154          HG21      VAL 154   6.743 -18.710  20.166
 1271   HG22  VAL 154          HG22      VAL 154   6.941 -20.115  21.220
 1272   HG23  VAL 154          HG23      VAL 154   5.484 -19.939  20.212
 1273    H    VAL 155           H        VAL 155   2.543 -18.666  22.995
 1274    HA   VAL 155           HA       VAL 155   2.705 -16.950  25.227
 1275    HB   VAL 155           HB       VAL 155   0.219 -18.349  24.143
 1276   HG11  VAL 155          HG11      VAL 155   0.556 -15.924  25.967
 1277   HG12  VAL 155          HG12      VAL 155  -0.965 -16.346  25.131
 1278   HG13  VAL 155          HG13      VAL 155  -0.283 -17.448  26.341
 1279   HG21  VAL 155          HG21      VAL 155  -0.165 -16.277  22.902
 1280   HG22  VAL 155          HG22      VAL 155   1.347 -15.570  23.557
 1281   HG23  VAL 155          HG23      VAL 155   1.392 -16.946  22.441
 1282    H    MET 156           H        MET 156   1.739 -20.474  25.227
 1283    HA   MET 156           HA       MET 156   1.052 -20.520  27.914
 1284    HB2  MET 156           HB2      MET 156   2.530 -22.725  26.380
 1285    HB3  MET 156           HB3      MET 156   1.554 -22.960  27.837
 1286    HG2  MET 156           HG2      MET 156   0.602 -22.253  25.061
 1287    HG3  MET 156           HG3      MET 156   0.263 -23.710  25.960
 1288    HE1  MET 156           HE1      MET 156  -1.574 -21.124  24.405
 1289    HE2  MET 156           HE2      MET 156  -2.065 -22.827  24.606
 1290    HE3  MET 156           HE3      MET 156  -3.082 -21.523  25.253
 1291    H    SER 157           H        SER 157   4.182 -21.249  26.412
 1292    HA   SER 157           HA       SER 157   5.462 -21.791  28.904
 1293    HB2  SER 157           HB2      SER 157   6.233 -21.553  25.993
 1294    HB3  SER 157           HB3      SER 157   7.459 -21.935  27.248
 1295    HG   SER 157           HG       SER 157   6.505 -23.831  26.313
 1296    H    LEU 158           H        LEU 158   5.053 -18.877  26.990
 1297    HA   LEU 158           HA       LEU 158   7.081 -17.220  27.976
 1298    HB2  LEU 158           HB2      LEU 158   5.600 -16.667  26.110
 1299    HB3  LEU 158           HB3      LEU 158   4.181 -16.774  27.144
 1300    HG   LEU 158           HG       LEU 158   4.941 -14.760  28.390
 1301   HD11  LEU 158          HD11      LEU 158   7.331 -14.861  27.952
 1302   HD12  LEU 158          HD12      LEU 158   7.070 -14.713  26.196
 1303   HD13  LEU 158          HD13      LEU 158   6.694 -13.355  27.301
 1304   HD21  LEU 158          HD21      LEU 158   3.236 -14.530  26.801
 1305   HD22  LEU 158          HD22      LEU 158   4.385 -13.242  26.352
 1306   HD23  LEU 158          HD23      LEU 158   4.331 -14.756  25.424
 1307    H    GLN 159           H        GLN 159   3.833 -17.904  29.337
 1308    HA   GLN 159           HA       GLN 159   4.058 -16.214  31.642
 1309    HB2  GLN 159           HB2      GLN 159   2.724 -18.919  31.838
 1310    HB3  GLN 159           HB3      GLN 159   2.135 -17.377  32.462
 1311    HG2  GLN 159           HG2      GLN 159   1.377 -16.792  30.132
 1312    HG3  GLN 159           HG3      GLN 159   2.026 -18.341  29.589
 1313   HE21  GLN 159          HE22      GLN 159  -0.333 -17.182  32.070
 1314   HE22  GLN 159          HE21      GLN 159  -1.428 -18.540  31.836
 1315    H    GLU 160           H        GLU 160   5.249 -19.516  31.082
 1316    HA   GLU 160           HA       GLU 160   5.836 -19.996  33.858
 1317    HB2  GLU 160           HB2      GLU 160   6.312 -21.536  31.284
 1318    HB3  GLU 160           HB3      GLU 160   6.849 -22.133  32.849
 1319    HG2  GLU 160           HG2      GLU 160   3.977 -21.298  32.428
 1320    HG3  GLU 160           HG3      GLU 160   4.533 -22.904  31.959
 1321    H    ASN 161           H        ASN 161   7.343 -18.493  31.313
 1322    HA   ASN 161           HA       ASN 161  10.170 -19.114  32.176
 1323    HB2  ASN 161           HB2      ASN 161   9.014 -18.149  29.551
 1324    HB3  ASN 161           HB3      ASN 161  10.665 -17.723  29.994
 1325   HD21  ASN 161          HD22      ASN 161   8.513 -20.603  29.735
 1326   HD22  ASN 161          HD21      ASN 161   9.810 -21.734  29.360
 1327    H    THR 162           H        THR 162   7.972 -16.418  31.439
 1328    HA   THR 162           HA       THR 162   9.572 -14.529  33.055
 1329    HB   THR 162           HB       THR 162   8.120 -12.892  32.041
 1330    HG1  THR 162           HG1      THR 162   6.800 -15.042  30.751
 1331   HG21  THR 162          HG21      THR 162   9.072 -14.722  29.838
 1332   HG22  THR 162          HG22      THR 162   8.748 -12.979  29.745
 1333   HG23  THR 162          HG23      THR 162  10.093 -13.577  30.742
 1334    HA   PRO 163           HA       PRO 163   6.503 -15.365  36.233
 1335    HB2  PRO 163           HB2      PRO 163   6.063 -13.066  37.519
 1336    HB3  PRO 163           HB3      PRO 163   7.752 -13.480  37.080
 1337    HG2  PRO 163           HG2      PRO 163   5.819 -11.666  35.606
 1338    HG3  PRO 163           HG3      PRO 163   7.544 -11.347  35.996
 1339    HD2  PRO 163           HD2      PRO 163   6.512 -12.494  33.560
 1340    HD3  PRO 163           HD3      PRO 163   8.232 -12.502  34.117
 1341    H    LYS 164           H        LYS 164   4.360 -14.570  37.469
 1342    HA   LYS 164           HA       LYS 164   2.247 -14.611  35.408
 1343    HB2  LYS 164           HB2      LYS 164   1.954 -15.055  38.402
 1344    HB3  LYS 164           HB3      LYS 164   0.807 -15.487  37.136
 1345    HG2  LYS 164           HG2      LYS 164   3.559 -16.742  37.580
 1346    HG3  LYS 164           HG3      LYS 164   2.006 -17.457  38.019
 1347    HD2  LYS 164           HD2      LYS 164   1.350 -17.713  35.693
 1348    HD3  LYS 164           HD3      LYS 164   2.708 -16.733  35.141
 1349    HE2  LYS 164           HE2      LYS 164   3.279 -18.970  34.678
 1350    HE3  LYS 164           HE3      LYS 164   4.323 -18.396  35.976
 1351    HZ1  LYS 164           HZ1      LYS 164   1.897 -20.066  36.426
 1352    HZ2  LYS 164           HZ2      LYS 164   3.399 -20.675  36.214
 1353    HZ3  LYS 164           HZ3      LYS 164   3.074 -19.732  37.526
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1   0.872   1.215  -1.653
    2    H2   MET   1           H2       MET   1   0.067   0.738  -2.988
    3    H3   MET   1           H3       MET   1   0.221  -0.292  -1.726
    4    HA   MET   1           HA       MET   1   2.376   0.785  -3.409
    5    HB2  MET   1           HB2      MET   1   4.002  -0.638  -2.361
    6    HB3  MET   1           HB3      MET   1   3.290   0.498  -1.252
    7    HG2  MET   1           HG2      MET   1   3.602  -1.377   0.018
    8    HG3  MET   1           HG3      MET   1   1.889  -1.384  -0.298
    9    HE1  MET   1           HE1      MET   1   4.923  -2.784  -2.641
   10    HE2  MET   1           HE2      MET   1   5.385  -3.105  -0.944
   11    HE3  MET   1           HE3      MET   1   4.947  -4.444  -2.031
   12    H    ILE   2           H        ILE   2   1.209  -2.557  -2.616
   13    HA   ILE   2           HA       ILE   2   0.867  -4.384  -3.828
   14    HB   ILE   2           HB       ILE   2   0.535  -2.694  -6.278
   15   HG12  ILE   2          HG12      ILE   2  -1.096  -2.907  -3.913
   16   HG13  ILE   2          HG13      ILE   2  -1.370  -1.987  -5.396
   17   HG21  ILE   2          HG21      ILE   2   1.006  -5.062  -6.782
   18   HG22  ILE   2          HG22      ILE   2  -0.341  -5.543  -5.711
   19   HG23  ILE   2          HG23      ILE   2  -0.646  -4.600  -7.190
   20   HD11  ILE   2          HD11      ILE   2  -2.618  -3.986  -6.298
   21   HD12  ILE   2          HD12      ILE   2  -2.311  -4.774  -4.696
   22   HD13  ILE   2          HD13      ILE   2  -3.276  -3.286  -4.833
   23    H    ASP   3           H        ASP   3   2.294  -5.902  -4.304
   24    HA   ASP   3           HA       ASP   3   5.019  -5.201  -4.377
   25    HB2  ASP   3           HB2      ASP   3   4.203  -7.241  -3.295
   26    HB3  ASP   3           HB3      ASP   3   3.723  -7.876  -4.880
   27    H    ASP   4           H        ASP   4   3.270  -7.197  -6.768
   28    HA   ASP   4           HA       ASP   4   4.267  -5.700  -8.996
   29    HB2  ASP   4           HB2      ASP   4   6.312  -6.967  -8.523
   30    HB3  ASP   4           HB3      ASP   4   5.381  -8.467  -8.479
   31    H    ASP   5           H        ASP   5   3.123  -8.956  -8.119
   32    HA   ASP   5           HA       ASP   5   1.706  -9.186 -10.632
   33    HB2  ASP   5           HB2      ASP   5   3.249 -10.931  -9.753
   34    HB3  ASP   5           HB3      ASP   5   2.059 -11.293  -8.503
   35    H    GLY   6           H        GLY   6   0.680  -7.515  -8.332
   36    HA2  GLY   6           HA2      GLY   6  -1.528  -6.768  -8.017
   37    HA3  GLY   6           HA3      GLY   6  -2.161  -8.311  -8.581
   38    H    TYR   7           H        TYR   7   0.298  -8.834  -6.246
   39    HA   TYR   7           HA       TYR   7  -1.707  -8.924  -4.048
   40    HB2  TYR   7           HB2      TYR   7   0.929 -10.403  -3.984
   41    HB3  TYR   7           HB3      TYR   7  -0.459 -10.564  -2.913
   42    HD1  TYR   7           HD2      TYR   7   0.795 -11.304  -6.356
   43    HD2  TYR   7           HD1      TYR   7  -2.183 -12.164  -3.358
   44    HE1  TYR   7           HE2      TYR   7   0.010 -13.225  -7.693
   45    HE2  TYR   7           HE1      TYR   7  -2.985 -14.078  -4.688
   46    HH   TYR   7           HH       TYR   7  -2.735 -15.315  -6.706
   47    H    ARG   8           H        ARG   8  -0.831  -8.201  -1.919
   48    HA   ARG   8           HA       ARG   8   1.582  -6.472  -2.145
   49    HB2  ARG   8           HB2      ARG   8   0.541  -4.781  -0.689
   50    HB3  ARG   8           HB3      ARG   8  -0.291  -4.909  -2.244
   51    HG2  ARG   8           HG2      ARG   8  -1.396  -6.452   0.101
   52    HG3  ARG   8           HG3      ARG   8  -1.623  -4.712   0.038
   53    HD2  ARG   8           HD2      ARG   8  -2.212  -5.890  -2.577
   54    HD3  ARG   8           HD3      ARG   8  -3.170  -6.680  -1.326
   55    HE   ARG   8           HE       ARG   8  -3.107  -3.762  -1.997
   56   HH11  ARG   8          HH21      ARG   8  -4.800  -6.403  -0.217
   57   HH12  ARG   8          HH22      ARG   8  -6.120  -5.380   0.217
   58   HH21  ARG   8          HH11      ARG   8  -4.909  -2.482  -1.412
   59   HH22  ARG   8          HH12      ARG   8  -6.200  -3.148  -0.493
   60    HA   PRO   9           HA       PRO   9   2.311  -8.980   1.484
   61    HB2  PRO   9           HB2      PRO   9   4.761  -7.733   2.252
   62    HB3  PRO   9           HB3      PRO   9   4.548  -9.151   1.214
   63    HG2  PRO   9           HG2      PRO   9   5.530  -6.633   0.373
   64    HG3  PRO   9           HG3      PRO   9   4.904  -7.937  -0.688
   65    HD2  PRO   9           HD2      PRO   9   3.475  -5.511   0.380
   66    HD3  PRO   9           HD3      PRO   9   3.418  -6.229  -1.253
   67    H    ASN  10           H        ASN  10   1.873  -8.943   3.707
   68    HA   ASN  10           HA       ASN  10   1.342  -6.260   4.934
   69    HB2  ASN  10           HB2      ASN  10  -0.525  -8.620   4.560
   70    HB3  ASN  10           HB3      ASN  10  -0.734  -7.521   5.924
   71   HD21  ASN  10          HD22      ASN  10  -1.228  -5.238   5.534
   72   HD22  ASN  10          HD21      ASN  10  -1.960  -4.787   4.005
   73    H    VAL  11           H        VAL  11   1.041  -6.340   7.299
   74    HA   VAL  11           HA       VAL  11   2.407  -8.599   8.627
   75    HB   VAL  11           HB       VAL  11   3.588  -6.886  10.126
   76   HG11  VAL  11          HG11      VAL  11   5.476  -6.568   8.463
   77   HG12  VAL  11          HG12      VAL  11   4.963  -8.199   8.863
   78   HG13  VAL  11          HG13      VAL  11   4.438  -7.488   7.339
   79   HG21  VAL  11          HG21      VAL  11   4.109  -4.698   9.209
   80   HG22  VAL  11          HG22      VAL  11   3.224  -5.028   7.718
   81   HG23  VAL  11          HG23      VAL  11   2.349  -4.844   9.263
   82    H    GLY  12           H        GLY  12   2.000  -8.410  11.049
   83    HA2  GLY  12           HA2      GLY  12  -0.583  -7.221  11.760
   84    HA3  GLY  12           HA3      GLY  12  -0.509  -8.968  11.506
   85    H    ILE  13           H        ILE  13  -0.905  -7.413  14.027
   86    HA   ILE  13           HA       ILE  13   1.482  -8.284  15.588
   87    HB   ILE  13           HB       ILE  13  -0.118  -5.715  15.507
   88   HG12  ILE  13          HG12      ILE  13   2.616  -5.169  15.948
   89   HG13  ILE  13          HG13      ILE  13   2.635  -6.538  14.857
   90   HG21  ILE  13          HG21      ILE  13   0.935  -4.969  17.590
   91   HG22  ILE  13          HG22      ILE  13  -0.192  -6.280  17.842
   92   HG23  ILE  13          HG23      ILE  13   1.555  -6.629  17.851
   93   HD11  ILE  13          HD11      ILE  13   2.657  -4.422  13.621
   94   HD12  ILE  13          HD12      ILE  13   1.138  -5.283  13.288
   95   HD13  ILE  13          HD13      ILE  13   1.160  -3.907  14.415
   96    H    VAL  14           H        VAL  14   1.131  -9.267  17.445
   97    HA   VAL  14           HA       VAL  14  -1.587  -9.375  18.627
   98    HB   VAL  14           HB       VAL  14   0.414 -11.682  18.707
   99   HG11  VAL  14          HG11      VAL  14  -1.229 -11.615  20.545
  100   HG12  VAL  14          HG12      VAL  14  -2.559 -11.488  19.383
  101   HG13  VAL  14          HG13      VAL  14  -1.569 -12.968  19.473
  102   HG21  VAL  14          HG21      VAL  14  -1.892 -11.343  16.759
  103   HG22  VAL  14          HG22      VAL  14  -0.159 -11.516  16.367
  104   HG23  VAL  14          HG23      VAL  14  -1.036 -12.871  17.085
  105    H    ILE  15           H        ILE  15  -1.446  -8.847  20.864
  106    HA   ILE  15           HA       ILE  15   1.275  -8.841  22.024
  107    HB   ILE  15           HB       ILE  15  -0.840  -6.827  22.852
  108   HG12  ILE  15          HG12      ILE  15  -0.120  -6.254  20.524
  109   HG13  ILE  15          HG13      ILE  15   0.297  -5.049  21.733
  110   HG21  ILE  15          HG21      ILE  15   0.711  -7.327  24.604
  111   HG22  ILE  15          HG22      ILE  15   2.102  -7.151  23.506
  112   HG23  ILE  15          HG23      ILE  15   1.122  -5.744  23.915
  113   HD11  ILE  15          HD11      ILE  15   2.110  -5.445  20.080
  114   HD12  ILE  15          HD12      ILE  15   2.631  -5.748  21.748
  115   HD13  ILE  15          HD13      ILE  15   2.262  -7.111  20.664
  116    H    CYS  16           H        CYS  16   1.386 -10.087  23.846
  117    HA   CYS  16           HA       CYS  16  -1.226 -10.821  25.116
  118    HB2  CYS  16           HB2      CYS  16   1.135 -12.731  24.808
  119    HB3  CYS  16           HB3      CYS  16  -0.456 -13.081  25.517
  120    HG   CYS  16           HG       CYS  16  -1.674 -12.128  23.180
  121    H    ASN  17           H        ASN  17  -1.244 -11.226  27.323
  122    HA   ASN  17           HA       ASN  17   1.087 -10.167  28.857
  123    HB2  ASN  17           HB2      ASN  17  -0.392  -9.324  30.504
  124    HB3  ASN  17           HB3      ASN  17  -0.970  -8.754  28.955
  125   HD21  ASN  17          HD22      ASN  17  -2.865  -8.382  30.626
  126   HD22  ASN  17          HD21      ASN  17  -4.028  -9.683  30.725
  127    H    ARG  18           H        ARG  18   0.970 -11.292  31.262
  128    HA   ARG  18           HA       ARG  18   1.310 -14.098  30.635
  129    HB2  ARG  18           HB2      ARG  18   1.644 -12.649  33.294
  130    HB3  ARG  18           HB3      ARG  18   1.947 -14.367  33.044
  131    HG2  ARG  18           HG2      ARG  18   4.030 -13.832  32.510
  132    HG3  ARG  18           HG3      ARG  18   3.372 -13.329  30.953
  133    HD2  ARG  18           HD2      ARG  18   3.041 -11.039  31.917
  134    HD3  ARG  18           HD3      ARG  18   3.911 -11.549  33.371
  135    HE   ARG  18           HE       ARG  18   4.982 -11.076  30.643
  136   HH11  ARG  18          HH21      ARG  18   5.901 -12.128  33.968
  137   HH12  ARG  18          HH22      ARG  18   7.584 -11.840  33.639
  138   HH21  ARG  18          HH11      ARG  18   7.156 -10.942  30.267
  139   HH22  ARG  18          HH12      ARG  18   8.303 -11.268  31.557
  140    H    GLN  19           H        GLN  19  -1.490 -12.463  31.234
  141    HA   GLN  19           HA       GLN  19  -2.821 -14.621  32.714
  142    HB2  GLN  19           HB2      GLN  19  -4.166 -12.207  31.487
  143    HB3  GLN  19           HB3      GLN  19  -4.763 -13.240  32.777
  144    HG2  GLN  19           HG2      GLN  19  -2.497 -11.218  32.903
  145    HG3  GLN  19           HG3      GLN  19  -4.088 -11.059  33.619
  146   HE21  GLN  19          HE22      GLN  19  -1.523 -10.866  35.053
  147   HE22  GLN  19          HE21      GLN  19  -1.523 -12.148  36.246
  148    H    GLY  20           H        GLY  20  -1.810 -14.122  29.506
  149    HA2  GLY  20           HA2      GLY  20  -2.358 -15.261  27.592
  150    HA3  GLY  20           HA3      GLY  20  -3.587 -16.183  28.476
  151    H    GLN  21           H        GLN  21  -3.662 -12.637  28.675
  152    HA   GLN  21           HA       GLN  21  -6.093 -12.637  26.962
  153    HB2  GLN  21           HB2      GLN  21  -4.942 -10.417  28.687
  154    HB3  GLN  21           HB3      GLN  21  -6.419 -10.347  27.734
  155    HG2  GLN  21           HG2      GLN  21  -5.967 -12.202  30.112
  156    HG3  GLN  21           HG3      GLN  21  -6.863 -10.693  30.144
  157   HE21  GLN  21          HE22      GLN  21  -7.048 -14.114  29.413
  158   HE22  GLN  21          HE21      GLN  21  -8.675 -14.099  28.750
  159    H    VAL  22           H        VAL  22  -6.008 -11.619  25.012
  160    HA   VAL  22           HA       VAL  22  -3.409 -10.575  24.116
  161    HB   VAL  22           HB       VAL  22  -3.858 -11.281  21.929
  162   HG11  VAL  22          HG11      VAL  22  -4.855 -13.675  23.496
  163   HG12  VAL  22          HG12      VAL  22  -3.686 -13.601  22.137
  164   HG13  VAL  22          HG13      VAL  22  -3.245 -13.050  23.780
  165   HG21  VAL  22          HG21      VAL  22  -6.250 -10.831  21.658
  166   HG22  VAL  22          HG22      VAL  22  -5.877 -12.495  21.187
  167   HG23  VAL  22          HG23      VAL  22  -6.671 -12.165  22.749
  168    H    MET  23           H        MET  23  -3.415  -8.545  23.073
  169    HA   MET  23           HA       MET  23  -5.764  -6.897  23.706
  170    HB2  MET  23           HB2      MET  23  -4.463  -5.078  23.497
  171    HB3  MET  23           HB3      MET  23  -3.252  -6.266  23.923
  172    HG2  MET  23           HG2      MET  23  -2.198  -5.159  22.224
  173    HG3  MET  23           HG3      MET  23  -2.897  -6.509  21.333
  174    HE1  MET  23           HE1      MET  23  -4.107  -2.051  21.254
  175    HE2  MET  23           HE2      MET  23  -4.375  -3.023  22.710
  176    HE3  MET  23           HE3      MET  23  -2.720  -2.790  22.116
  177    H    TRP  24           H        TRP  24  -7.179  -5.962  22.208
  178    HA   TRP  24           HA       TRP  24  -7.038  -6.785  19.365
  179    HB2  TRP  24           HB2      TRP  24  -8.161  -8.543  20.806
  180    HB3  TRP  24           HB3      TRP  24  -9.340  -7.333  21.280
  181    HD1  TRP  24           HD1      TRP  24  -8.079  -8.391  17.740
  182    HE1  TRP  24           HE1      TRP  24 -10.092  -9.174  16.362
  183    HE3  TRP  24           HE3      TRP  24 -11.738  -7.851  21.256
  184    HZ2  TRP  24           HZ2      TRP  24 -12.870  -9.754  16.801
  185    HZ3  TRP  24           HZ3      TRP  24 -14.092  -8.460  20.726
  186    HH2  TRP  24           HH2      TRP  24 -14.663  -9.361  18.498
  187    H    ALA  25           H        ALA  25  -8.317  -5.246  18.036
  188    HA   ALA  25           HA       ALA  25  -9.192  -2.827  19.538
  189    HB1  ALA  25           HB1      ALA  25  -7.822  -1.413  18.135
  190    HB2  ALA  25           HB2      ALA  25  -6.799  -2.564  18.982
  191    HB3  ALA  25           HB3      ALA  25  -7.185  -2.837  17.267
  192    H    ARG  26           H        ARG  26 -10.431  -1.312  18.292
  193    HA   ARG  26           HA       ARG  26 -12.133  -2.671  16.249
  194    HB2  ARG  26           HB2      ARG  26 -13.045  -2.038  18.580
  195    HB3  ARG  26           HB3      ARG  26 -12.908  -0.364  18.062
  196    HG2  ARG  26           HG2      ARG  26 -14.409  -0.943  16.079
  197    HG3  ARG  26           HG3      ARG  26 -14.585  -2.570  16.780
  198    HD2  ARG  26           HD2      ARG  26 -15.348  -1.413  18.940
  199    HD3  ARG  26           HD3      ARG  26 -15.372   0.093  18.011
  200    HE   ARG  26           HE       ARG  26 -16.908  -2.218  16.973
  201   HH11  ARG  26          HH11      ARG  26 -17.033   1.088  18.372
  202   HH12  ARG  26          HH12      ARG  26 -18.757   1.095  18.500
  203   HH21  ARG  26          HH21      ARG  26 -19.202  -2.172  17.170
  204   HH22  ARG  26          HH22      ARG  26 -20.017  -0.754  17.710
  205    H    ARG  27           H        ARG  27 -11.871  -1.721  14.148
  206    HA   ARG  27           HA       ARG  27 -10.095   0.593  14.063
  207    HB2  ARG  27           HB2      ARG  27  -9.894  -1.292  12.511
  208    HB3  ARG  27           HB3      ARG  27 -11.356  -0.762  11.691
  209    HG2  ARG  27           HG2      ARG  27 -10.311   1.371  11.081
  210    HG3  ARG  27           HG3      ARG  27  -8.915   1.016  12.102
  211    HD2  ARG  27           HD2      ARG  27  -9.672  -0.434   9.550
  212    HD3  ARG  27           HD3      ARG  27  -8.336   0.698   9.766
  213    HE   ARG  27           HE       ARG  27  -8.390  -2.111  10.451
  214   HH11  ARG  27          HH11      ARG  27  -6.700   0.979  11.248
  215   HH12  ARG  27          HH12      ARG  27  -5.431   0.138  12.096
  216   HH21  ARG  27          HH21      ARG  27  -6.761  -3.093  11.664
  217   HH22  ARG  27          HH22      ARG  27  -5.428  -2.123  12.307
  218    H    PHE  28           H        PHE  28 -10.480   2.605  13.038
  219    HA   PHE  28           HA       PHE  28 -12.835   3.776  14.200
  220    HB2  PHE  28           HB2      PHE  28 -10.652   4.859  14.223
  221    HB3  PHE  28           HB3      PHE  28 -10.616   4.920  12.465
  222    HD1  PHE  28           HD1      PHE  28 -12.493   6.142  15.472
  223    HD2  PHE  28           HD2      PHE  28 -11.545   6.790  11.315
  224    HE1  PHE  28           HE1      PHE  28 -13.555   8.379  15.579
  225    HE2  PHE  28           HE2      PHE  28 -12.587   9.046  11.434
  226    HZ   PHE  28           HZ       PHE  28 -13.597   9.841  13.565
  227    H    GLY  29           H        GLY  29 -14.514   4.878  13.129
  228    HA2  GLY  29           HA2      GLY  29 -16.083   5.271  11.529
  229    HA3  GLY  29           HA3      GLY  29 -14.869   4.900  10.294
  230    H    GLN  30           H        GLN  30 -15.072   2.188  12.356
  231    HA   GLN  30           HA       GLN  30 -17.262   0.922  10.842
  232    HB2  GLN  30           HB2      GLN  30 -15.920  -0.831  10.087
  233    HB3  GLN  30           HB3      GLN  30 -14.978   0.656   9.781
  234    HG2  GLN  30           HG2      GLN  30 -13.469   0.204  11.508
  235    HG3  GLN  30           HG3      GLN  30 -14.409  -1.180  12.117
  236   HE21  GLN  30          HE22      GLN  30 -12.859   0.004   9.021
  237   HE22  GLN  30          HE21      GLN  30 -12.329  -1.580   8.511
  238    H    HIS  31           H        HIS  31 -18.021  -1.087  11.839
  239    HA   HIS  31           HA       HIS  31 -17.912  -0.860  14.784
  240    HB2  HIS  31           HB2      HIS  31 -19.701  -2.531  12.981
  241    HB3  HIS  31           HB3      HIS  31 -19.886  -2.314  14.720
  242    HD1  HIS  31           HD1      HIS  31 -21.794  -1.220  12.063
  243    HD2  HIS  31           HD2      HIS  31 -19.562   0.857  14.976
  244    HE1  HIS  31           HE1      HIS  31 -22.787   1.118  12.197
  245    H    SER  32           H        SER  32 -16.660  -2.965  12.268
  246    HA   SER  32           HA       SER  32 -16.524  -5.339  13.809
  247    HB2  SER  32           HB2      SER  32 -14.849  -4.606  11.385
  248    HB3  SER  32           HB3      SER  32 -15.322  -6.222  11.931
  249    HG   SER  32           HG       SER  32 -16.664  -5.481  10.203
  250    H    TRP  33           H        TRP  33 -14.616  -6.491  14.550
  251    HA   TRP  33           HA       TRP  33 -12.521  -4.685  15.646
  252    HB2  TRP  33           HB2      TRP  33 -13.718  -7.293  16.587
  253    HB3  TRP  33           HB3      TRP  33 -12.256  -6.566  17.267
  254    HD1  TRP  33           HD1      TRP  33 -16.031  -5.721  16.923
  255    HE1  TRP  33           HE1      TRP  33 -16.717  -4.302  18.928
  256    HE3  TRP  33           HE3      TRP  33 -11.450  -5.215  19.105
  257    HZ2  TRP  33           HZ2      TRP  33 -15.391  -2.987  21.179
  258    HZ3  TRP  33           HZ3      TRP  33 -11.174  -3.873  21.147
  259    HH2  TRP  33           HH2      TRP  33 -13.130  -2.729  22.192
  260    H    GLN  34           H        GLN  34 -10.336  -5.470  15.681
  261    HA   GLN  34           HA       GLN  34  -9.619  -7.590  13.754
  262    HB2  GLN  34           HB2      GLN  34  -8.700  -4.678  13.523
  263    HB3  GLN  34           HB3      GLN  34  -8.111  -6.028  12.559
  264    HG2  GLN  34           HG2      GLN  34 -10.409  -6.282  11.580
  265    HG3  GLN  34           HG3      GLN  34 -10.905  -4.832  12.463
  266   HE21  GLN  34          HE22      GLN  34 -11.366  -4.300   9.992
  267   HE22  GLN  34          HE21      GLN  34 -10.046  -3.584   9.101
  268    H    PHE  35           H        PHE  35  -7.352  -8.113  13.847
  269    HA   PHE  35           HA       PHE  35  -6.002  -7.448  16.398
  270    HB2  PHE  35           HB2      PHE  35  -5.296  -9.227  14.039
  271    HB3  PHE  35           HB3      PHE  35  -4.160  -8.876  15.342
  272    HD1  PHE  35           HD1      PHE  35  -5.504  -9.159  17.826
  273    HD2  PHE  35           HD2      PHE  35  -6.057 -11.432  14.184
  274    HE1  PHE  35           HE1      PHE  35  -6.378 -11.061  19.139
  275    HE2  PHE  35           HE2      PHE  35  -6.872 -13.348  15.527
  276    HZ   PHE  35           HZ       PHE  35  -7.061 -13.163  17.991
  277    HA   PRO  36           HA       PRO  36  -4.324  -3.859  14.442
  278    HB2  PRO  36           HB2      PRO  36  -1.759  -4.380  15.943
  279    HB3  PRO  36           HB3      PRO  36  -2.690  -2.868  15.817
  280    HG2  PRO  36           HG2      PRO  36  -2.842  -4.397  18.042
  281    HG3  PRO  36           HG3      PRO  36  -4.329  -3.654  17.374
  282    HD2  PRO  36           HD2      PRO  36  -3.355  -6.505  17.068
  283    HD3  PRO  36           HD3      PRO  36  -5.010  -5.884  17.374
  284    H    GLN  37           H        GLN  37  -3.133  -3.385  12.486
  285    HA   GLN  37           HA       GLN  37  -1.139  -5.288  11.518
  286    HB2  GLN  37           HB2      GLN  37  -2.477  -6.181   9.688
  287    HB3  GLN  37           HB3      GLN  37  -3.229  -6.591  11.221
  288    HG2  GLN  37           HG2      GLN  37  -4.846  -4.703  10.898
  289    HG3  GLN  37           HG3      GLN  37  -4.094  -4.365   9.324
  290   HE21  GLN  37          HE22      GLN  37  -6.964  -5.152   9.846
  291   HE22  GLN  37          HE21      GLN  37  -7.160  -6.606   8.897
  292    H    GLY  38           H        GLY  38  -0.639  -4.890   9.115
  293    HA2  GLY  38           HA2      GLY  38  -1.379  -2.387   7.929
  294    HA3  GLY  38           HA3      GLY  38   0.179  -2.237   8.733
  295    H    GLY  39           H        GLY  39   0.911  -1.821   6.398
  296    HA2  GLY  39           HA2      GLY  39   1.127  -4.258   4.728
  297    HA3  GLY  39           HA3      GLY  39   1.086  -2.597   4.151
  298    H    ILE  40           H        ILE  40   3.136  -4.624   3.785
  299    HA   ILE  40           HA       ILE  40   5.552  -3.453   5.083
  300    HB   ILE  40           HB       ILE  40   5.160  -5.751   3.127
  301   HG12  ILE  40          HG12      ILE  40   6.341  -5.975   5.915
  302   HG13  ILE  40          HG13      ILE  40   4.599  -6.025   5.689
  303   HG21  ILE  40          HG21      ILE  40   7.754  -4.709   4.361
  304   HG22  ILE  40          HG22      ILE  40   7.615  -6.207   3.425
  305   HG23  ILE  40          HG23      ILE  40   7.308  -4.664   2.642
  306   HD11  ILE  40          HD11      ILE  40   6.426  -7.942   4.187
  307   HD12  ILE  40          HD12      ILE  40   5.821  -8.298   5.807
  308   HD13  ILE  40          HD13      ILE  40   4.675  -8.045   4.480
  309    H    ASN  41           H        ASN  41   6.366  -1.640   4.139
  310    HA   ASN  41           HA       ASN  41   5.402  -0.777   1.510
  311    HB2  ASN  41           HB2      ASN  41   7.451   0.469   3.390
  312    HB3  ASN  41           HB3      ASN  41   6.908   1.184   1.886
  313   HD21  ASN  41          HD22      ASN  41   5.861   0.204   5.133
  314   HD22  ASN  41          HD21      ASN  41   4.362   1.147   5.143
  315    HA   PRO  42           HA       PRO  42   8.628  -2.520  -0.927
  316    HB2  PRO  42           HB2      PRO  42   9.286   0.238  -1.995
  317    HB3  PRO  42           HB3      PRO  42   9.037  -1.287  -2.899
  318    HG2  PRO  42           HG2      PRO  42   7.068   0.567  -2.784
  319    HG3  PRO  42           HG3      PRO  42   6.669  -1.169  -2.571
  320    HD2  PRO  42           HD2      PRO  42   7.043   0.948  -0.434
  321    HD3  PRO  42           HD3      PRO  42   5.761  -0.288  -0.574
  322    H    GLY  43           H        GLY  43  10.621  -3.150  -0.218
  323    HA2  GLY  43           HA2      GLY  43  12.840  -2.998   0.398
  324    HA3  GLY  43           HA3      GLY  43  12.696  -1.249   0.569
  325    H    GLU  44           H        GLU  44  10.126  -2.378   2.432
  326    HA   GLU  44           HA       GLU  44  11.673  -2.275   4.905
  327    HB2  GLU  44           HB2      GLU  44   8.758  -2.391   4.231
  328    HB3  GLU  44           HB3      GLU  44   9.265  -3.067   5.772
  329    HG2  GLU  44           HG2      GLU  44  10.048  -1.072   6.624
  330    HG3  GLU  44           HG3      GLU  44  10.180  -0.309   5.028
  331    H    SER  45           H        SER  45  11.931  -4.014   6.325
  332    HA   SER  45           HA       SER  45  11.616  -6.747   5.200
  333    HB2  SER  45           HB2      SER  45  12.937  -5.837   7.797
  334    HB3  SER  45           HB3      SER  45  13.002  -7.453   7.069
  335    HG   SER  45           HG       SER  45  14.896  -6.224   6.607
  336    H    ALA  46           H        ALA  46  10.369  -8.321   6.585
  337    HA   ALA  46           HA       ALA  46   7.833  -7.334   7.193
  338    HB1  ALA  46           HB1      ALA  46   7.458  -9.542   8.280
  339    HB2  ALA  46           HB2      ALA  46   8.311  -9.714   6.729
  340    HB3  ALA  46           HB3      ALA  46   9.212  -9.845   8.270
  341    H    GLU  47           H        GLU  47  10.516  -7.939   9.439
  342    HA   GLU  47           HA       GLU  47   9.072  -7.304  11.833
  343    HB2  GLU  47           HB2      GLU  47  11.015  -8.719  11.736
  344    HB3  GLU  47           HB3      GLU  47  12.022  -7.400  11.106
  345    HG2  GLU  47           HG2      GLU  47  11.591  -6.160  13.273
  346    HG3  GLU  47           HG3      GLU  47  10.779  -7.614  13.862
  347    H    GLN  48           H        GLN  48  10.969  -5.314   9.525
  348    HA   GLN  48           HA       GLN  48  10.980  -2.954  11.189
  349    HB2  GLN  48           HB2      GLN  48  11.325  -3.298   8.195
  350    HB3  GLN  48           HB3      GLN  48  11.470  -1.747   9.024
  351    HG2  GLN  48           HG2      GLN  48  13.090  -4.205   9.783
  352    HG3  GLN  48           HG3      GLN  48  13.666  -2.980   8.643
  353   HE21  GLN  48          HE22      GLN  48  13.756  -3.942  11.877
  354   HE22  GLN  48          HE21      GLN  48  14.200  -2.413  12.600
  355    H    ALA  49           H        ALA  49   8.761  -4.244   8.636
  356    HA   ALA  49           HA       ALA  49   7.027  -1.938   8.636
  357    HB1  ALA  49           HB1      ALA  49   5.479  -3.477   7.476
  358    HB2  ALA  49           HB2      ALA  49   7.118  -3.549   6.777
  359    HB3  ALA  49           HB3      ALA  49   6.549  -4.838   7.862
  360    H    MET  50           H        MET  50   7.113  -5.076  10.448
  361    HA   MET  50           HA       MET  50   4.665  -4.760  11.812
  362    HB2  MET  50           HB2      MET  50   5.809  -6.843  11.908
  363    HB3  MET  50           HB3      MET  50   7.269  -6.134  12.582
  364    HG2  MET  50           HG2      MET  50   4.612  -6.113  14.021
  365    HG3  MET  50           HG3      MET  50   5.769  -7.425  14.147
  366    HE1  MET  50           HE1      MET  50   8.130  -7.325  15.072
  367    HE2  MET  50           HE2      MET  50   8.697  -5.784  14.394
  368    HE3  MET  50           HE3      MET  50   8.739  -6.045  16.141
  369    H    TYR  51           H        TYR  51   7.981  -3.608  12.866
  370    HA   TYR  51           HA       TYR  51   6.891  -2.437  15.202
  371    HB2  TYR  51           HB2      TYR  51   9.430  -1.780  13.652
  372    HB3  TYR  51           HB3      TYR  51   8.992  -0.987  15.155
  373    HD1  TYR  51           HD2      TYR  51   8.302  -2.658  17.153
  374    HD2  TYR  51           HD1      TYR  51  10.993  -3.542  13.896
  375    HE1  TYR  51           HE2      TYR  51   9.610  -4.137  18.637
  376    HE2  TYR  51           HE1      TYR  51  12.302  -5.024  15.387
  377    HH   TYR  51           HH       TYR  51  11.530  -5.476  18.865
  378    H    ARG  52           H        ARG  52   7.391  -0.987  11.856
  379    HA   ARG  52           HA       ARG  52   6.684   1.659  12.640
  380    HB2  ARG  52           HB2      ARG  52   7.783   0.883  10.471
  381    HB3  ARG  52           HB3      ARG  52   6.202   0.250   9.987
  382    HG2  ARG  52           HG2      ARG  52   5.421   2.780  10.511
  383    HG3  ARG  52           HG3      ARG  52   7.142   3.101  10.295
  384    HD2  ARG  52           HD2      ARG  52   6.694   3.179   8.064
  385    HD3  ARG  52           HD3      ARG  52   6.578   1.420   8.161
  386    HE   ARG  52           HE       ARG  52   4.257   1.535   7.967
  387   HH11  ARG  52          HH11      ARG  52   5.456   4.885   8.461
  388   HH12  ARG  52          HH12      ARG  52   3.887   5.574   8.219
  389   HH21  ARG  52          HH21      ARG  52   2.326   2.421   7.739
  390   HH22  ARG  52          HH22      ARG  52   2.019   4.123   8.061
  391    H    GLU  53           H        GLU  53   4.697  -1.085  11.372
  392    HA   GLU  53           HA       GLU  53   2.337   0.502  11.275
  393    HB2  GLU  53           HB2      GLU  53   2.754  -2.485  11.132
  394    HB3  GLU  53           HB3      GLU  53   1.186  -1.701  10.914
  395    HG2  GLU  53           HG2      GLU  53   3.688  -1.049   9.310
  396    HG3  GLU  53           HG3      GLU  53   2.430  -2.144   8.750
  397    H    LEU  54           H        LEU  54   3.795  -1.625  13.777
  398    HA   LEU  54           HA       LEU  54   1.679  -1.612  15.652
  399    HB2  LEU  54           HB2      LEU  54   3.717  -2.945  15.930
  400    HB3  LEU  54           HB3      LEU  54   4.701  -1.477  15.995
  401    HG   LEU  54           HG       LEU  54   3.338  -0.857  18.110
  402   HD11  LEU  54          HD11      LEU  54   1.603  -2.678  17.689
  403   HD12  LEU  54          HD12      LEU  54   2.874  -3.868  18.066
  404   HD13  LEU  54          HD13      LEU  54   2.326  -2.713  19.302
  405   HD21  LEU  54          HD21      LEU  54   5.263  -3.226  18.126
  406   HD22  LEU  54          HD22      LEU  54   5.700  -1.502  18.163
  407   HD23  LEU  54          HD23      LEU  54   4.825  -2.210  19.530
  408    H    PHE  55           H        PHE  55   4.332   0.856  15.109
  409    HA   PHE  55           HA       PHE  55   3.340   2.630  17.088
  410    HB2  PHE  55           HB2      PHE  55   5.587   2.814  16.124
  411    HB3  PHE  55           HB3      PHE  55   4.906   3.272  14.565
  412    HD1  PHE  55           HD1      PHE  55   5.260   4.337  18.126
  413    HD2  PHE  55           HD2      PHE  55   4.186   5.539  14.121
  414    HE1  PHE  55           HE1      PHE  55   5.172   6.701  18.860
  415    HE2  PHE  55           HE2      PHE  55   4.105   7.906  14.859
  416    HZ   PHE  55           HZ       PHE  55   4.601   8.498  17.230
  417    H    GLU  56           H        GLU  56   2.525   2.364  13.582
  418    HA   GLU  56           HA       GLU  56   0.867   4.615  13.490
  419    HB2  GLU  56           HB2      GLU  56   0.854   2.057  11.870
  420    HB3  GLU  56           HB3      GLU  56  -0.128   3.456  11.467
  421    HG2  GLU  56           HG2      GLU  56   2.854   3.870  11.827
  422    HG3  GLU  56           HG3      GLU  56   2.285   3.069  10.387
  423    H    GLU  57           H        GLU  57   0.199   1.378  14.768
  424    HA   GLU  57           HA       GLU  57  -2.711   1.743  14.704
  425    HB2  GLU  57           HB2      GLU  57  -0.861  -0.513  15.569
  426    HB3  GLU  57           HB3      GLU  57  -2.597  -0.589  15.741
  427    HG2  GLU  57           HG2      GLU  57  -1.292  -0.162  13.026
  428    HG3  GLU  57           HG3      GLU  57  -1.533  -1.753  13.747
  429    H    VAL  58           H        VAL  58  -0.206   1.032  17.186
  430    HA   VAL  58           HA       VAL  58  -2.118   1.832  19.338
  431    HB   VAL  58           HB       VAL  58  -0.432   0.289  20.680
  432   HG11  VAL  58          HG11      VAL  58  -2.861  -0.200  20.184
  433   HG12  VAL  58          HG12      VAL  58  -2.315  -1.090  18.747
  434   HG13  VAL  58          HG13      VAL  58  -1.785  -1.587  20.383
  435   HG21  VAL  58          HG21      VAL  58   0.533  -1.497  19.575
  436   HG22  VAL  58          HG22      VAL  58   0.022  -0.916  17.965
  437   HG23  VAL  58          HG23      VAL  58   1.209   0.009  18.921
  438    H    GLY  59           H        GLY  59   0.515   3.186  17.756
  439    HA2  GLY  59           HA2      GLY  59   1.881   4.942  18.321
  440    HA3  GLY  59           HA3      GLY  59   0.957   5.105  19.813
  441    H    LEU  60           H        LEU  60   2.145   1.976  19.681
  442    HA   LEU  60           HA       LEU  60   4.085   2.426  21.754
  443    HB2  LEU  60           HB2      LEU  60   2.294   0.685  21.632
  444    HB3  LEU  60           HB3      LEU  60   3.126  -0.024  20.244
  445    HG   LEU  60           HG       LEU  60   5.042  -0.673  21.685
  446   HD11  LEU  60          HD11      LEU  60   3.349   0.512  23.914
  447   HD12  LEU  60          HD12      LEU  60   4.785  -0.526  24.118
  448   HD13  LEU  60          HD13      LEU  60   4.950   1.080  23.392
  449   HD21  LEU  60          HD21      LEU  60   3.629  -2.346  22.969
  450   HD22  LEU  60          HD22      LEU  60   2.182  -1.362  22.630
  451   HD23  LEU  60          HD23      LEU  60   3.061  -2.144  21.308
  452    H    SER  61           H        SER  61   6.279   1.855  21.628
  453    HA   SER  61           HA       SER  61   7.438   1.596  18.889
  454    HB2  SER  61           HB2      SER  61   8.577   3.273  21.154
  455    HB3  SER  61           HB3      SER  61   9.136   3.183  19.468
  456    HG   SER  61           HG       SER  61   7.837   5.052  19.892
  457    H    ARG  62           H        ARG  62   9.746   0.866  18.999
  458    HA   ARG  62           HA       ARG  62   9.799  -1.765  19.773
  459    HB2  ARG  62           HB2      ARG  62  12.332  -0.088  19.471
  460    HB3  ARG  62           HB3      ARG  62  12.116  -1.820  19.201
  461    HG2  ARG  62           HG2      ARG  62  10.292  -0.941  17.449
  462    HG3  ARG  62           HG3      ARG  62  11.287   0.515  17.486
  463    HD2  ARG  62           HD2      ARG  62  12.188  -2.307  16.848
  464    HD3  ARG  62           HD3      ARG  62  11.990  -1.023  15.661
  465    HE   ARG  62           HE       ARG  62  14.224  -1.569  17.409
  466   HH11  ARG  62          HH11      ARG  62  12.691   1.072  15.563
  467   HH12  ARG  62          HH12      ARG  62  14.126   2.033  15.493
  468   HH21  ARG  62          HH21      ARG  62  16.116  -0.274  17.325
  469   HH22  ARG  62          HH22      ARG  62  16.116   1.233  16.488
  470    H    LYS  63           H        LYS  63  10.884   1.013  21.669
  471    HA   LYS  63           HA       LYS  63  12.500  -0.404  23.501
  472    HB2  LYS  63           HB2      LYS  63  10.927   2.139  24.126
  473    HB3  LYS  63           HB3      LYS  63  12.467   1.618  24.826
  474    HG2  LYS  63           HG2      LYS  63  11.987   2.670  22.027
  475    HG3  LYS  63           HG3      LYS  63  12.835   3.485  23.336
  476    HD2  LYS  63           HD2      LYS  63  13.701   0.815  22.213
  477    HD3  LYS  63           HD3      LYS  63  14.259   2.358  21.536
  478    HE2  LYS  63           HE2      LYS  63  15.170   2.988  23.791
  479    HE3  LYS  63           HE3      LYS  63  14.690   1.404  24.418
  480    HZ1  LYS  63           HZ1      LYS  63  16.672   1.853  22.249
  481    HZ2  LYS  63           HZ2      LYS  63  17.023   1.441  23.783
  482    HZ3  LYS  63           HZ3      LYS  63  16.229   0.385  22.827
  483    H    ASP  64           H        ASP  64   9.021  -0.122  23.368
  484    HA   ASP  64           HA       ASP  64   8.915  -1.331  26.094
  485    HB2  ASP  64           HB2      ASP  64   7.927   0.982  25.785
  486    HB3  ASP  64           HB3      ASP  64   6.619   0.188  24.934
  487    H    VAL  65           H        VAL  65   9.254  -2.638  23.405
  488    HA   VAL  65           HA       VAL  65   7.380  -4.833  24.040
  489    HB   VAL  65           HB       VAL  65   7.139  -5.259  21.554
  490   HG11  VAL  65          HG11      VAL  65   5.834  -2.747  22.627
  491   HG12  VAL  65          HG12      VAL  65   5.223  -3.787  21.317
  492   HG13  VAL  65          HG13      VAL  65   5.315  -4.406  22.977
  493   HG21  VAL  65          HG21      VAL  65   7.882  -2.334  21.235
  494   HG22  VAL  65          HG22      VAL  65   8.936  -3.686  20.787
  495   HG23  VAL  65          HG23      VAL  65   7.383  -3.456  19.961
  496    H    ARG  66           H        ARG  66   8.041  -6.915  23.100
  497    HA   ARG  66           HA       ARG  66  10.811  -7.067  22.092
  498    HB2  ARG  66           HB2      ARG  66  11.420  -8.940  23.447
  499    HB3  ARG  66           HB3      ARG  66  11.094  -7.539  24.443
  500    HG2  ARG  66           HG2      ARG  66   8.849  -9.561  24.124
  501    HG3  ARG  66           HG3      ARG  66  10.266 -10.049  25.025
  502    HD2  ARG  66           HD2      ARG  66   8.642  -7.545  25.646
  503    HD3  ARG  66           HD3      ARG  66   8.462  -9.077  26.478
  504    HE   ARG  66           HE       ARG  66  10.674  -7.151  26.711
  505   HH11  ARG  66          HH21      ARG  66   9.753 -10.530  27.509
  506   HH12  ARG  66          HH22      ARG  66  10.830 -10.582  28.878
  507   HH21  ARG  66          HH11      ARG  66  11.995  -7.302  28.597
  508   HH22  ARG  66          HH12      ARG  66  11.956  -8.753  29.562
  509    H    ILE  67           H        ILE  67  10.976  -8.774  20.485
  510    HA   ILE  67           HA       ILE  67   8.381  -9.821  19.564
  511    HB   ILE  67           HB       ILE  67  11.182 -10.327  18.501
  512   HG12  ILE  67          HG12      ILE  67   9.183  -8.508  17.133
  513   HG13  ILE  67          HG13      ILE  67  10.327  -7.869  18.317
  514   HG21  ILE  67          HG21      ILE  67   9.976 -11.138  16.454
  515   HG22  ILE  67          HG22      ILE  67   9.585 -12.098  17.870
  516   HG23  ILE  67          HG23      ILE  67   8.427 -10.883  17.278
  517   HD11  ILE  67          HD11      ILE  67  11.026  -9.287  15.728
  518   HD12  ILE  67          HD12      ILE  67  11.236  -7.573  16.122
  519   HD13  ILE  67          HD13      ILE  67  12.213  -8.787  16.961
  520    H    LEU  68           H        LEU  68   7.586 -11.550  20.466
  521    HA   LEU  68           HA       LEU  68   9.405 -13.488  21.864
  522    HB2  LEU  68           HB2      LEU  68   6.387 -13.354  21.711
  523    HB3  LEU  68           HB3      LEU  68   7.340 -14.495  22.648
  524    HG   LEU  68           HG       LEU  68   7.233 -11.488  23.190
  525   HD11  LEU  68          HD11      LEU  68   5.833 -13.935  24.313
  526   HD12  LEU  68          HD12      LEU  68   6.113 -12.494  25.291
  527   HD13  LEU  68          HD13      LEU  68   5.165 -12.357  23.786
  528   HD21  LEU  68          HD21      LEU  68   8.619 -13.748  24.690
  529   HD22  LEU  68          HD22      LEU  68   9.407 -12.394  23.834
  530   HD23  LEU  68          HD23      LEU  68   8.425 -12.075  25.271
  531    H    ALA  69           H        ALA  69   7.266 -13.046  19.042
  532    HA   ALA  69           HA       ALA  69   8.225 -15.455  17.759
  533    HB1  ALA  69           HB1      ALA  69   6.555 -16.379  19.445
  534    HB2  ALA  69           HB2      ALA  69   5.295 -15.501  18.565
  535    HB3  ALA  69           HB3      ALA  69   6.243 -16.767  17.754
  536    H    SER  70           H        SER  70   7.125 -15.824  15.767
  537    HA   SER  70           HA       SER  70   5.496 -13.834  14.546
  538    HB2  SER  70           HB2      SER  70   7.182 -13.142  12.785
  539    HB3  SER  70           HB3      SER  70   7.464 -12.512  14.414
  540    HG   SER  70           HG       SER  70   9.405 -13.307  13.472
  541    H    THR  71           H        THR  71   4.811 -14.478  12.312
  542    HA   THR  71           HA       THR  71   4.464 -17.330  12.346
  543    HB   THR  71           HB       THR  71   3.516 -16.711   9.957
  544    HG1  THR  71           HG1      THR  71   4.285 -14.695   9.746
  545   HG21  THR  71          HG21      THR  71   2.132 -15.922  12.513
  546   HG22  THR  71          HG22      THR  71   1.386 -15.781  10.913
  547   HG23  THR  71          HG23      THR  71   1.886 -17.362  11.524
  548    H    ARG  72           H        ARG  72   5.196 -18.914  11.238
  549    HA   ARG  72           HA       ARG  72   7.830 -18.575   9.924
  550    HB2  ARG  72           HB2      ARG  72   6.288 -21.070  10.729
  551    HB3  ARG  72           HB3      ARG  72   7.995 -20.999  10.324
  552    HG2  ARG  72           HG2      ARG  72   8.622 -19.989  12.334
  553    HG3  ARG  72           HG3      ARG  72   7.067 -19.250  12.629
  554    HD2  ARG  72           HD2      ARG  72   7.823 -22.106  13.108
  555    HD3  ARG  72           HD3      ARG  72   7.275 -20.843  14.249
  556    HE   ARG  72           HE       ARG  72   5.089 -20.952  12.811
  557   HH11  ARG  72          HH11      ARG  72   7.034 -23.743  13.899
  558   HH12  ARG  72          HH12      ARG  72   5.693 -24.830  13.943
  559   HH21  ARG  72          HH21      ARG  72   3.304 -22.360  12.973
  560   HH22  ARG  72          HH22      ARG  72   3.538 -24.042  13.348
  561    H    ASN  73           H        ASN  73   4.530 -19.571   9.246
  562    HA   ASN  73           HA       ASN  73   5.074 -19.758   6.368
  563    HB2  ASN  73           HB2      ASN  73   3.197 -21.157   6.109
  564    HB3  ASN  73           HB3      ASN  73   4.130 -21.869   7.433
  565   HD21  ASN  73          HD22      ASN  73   3.283 -21.412   9.755
  566   HD22  ASN  73          HD21      ASN  73   1.593 -21.089   9.954
  567    H    TRP  74           H        TRP  74   3.618 -18.459   5.065
  568    HA   TRP  74           HA       TRP  74   2.626 -16.117   6.600
  569    HB2  TRP  74           HB2      TRP  74   2.914 -16.573   3.593
  570    HB3  TRP  74           HB3      TRP  74   2.307 -15.108   4.330
  571    HD1  TRP  74           HD1      TRP  74   5.619 -17.172   4.439
  572    HE1  TRP  74           HE1      TRP  74   7.596 -15.555   4.380
  573    HE3  TRP  74           HE3      TRP  74   3.067 -12.744   4.542
  574    HZ2  TRP  74           HZ2      TRP  74   8.018 -12.730   4.269
  575    HZ3  TRP  74           HZ3      TRP  74   4.275 -10.585   4.397
  576    HH2  TRP  74           HH2      TRP  74   6.764 -10.561   4.260
  577    H    LEU  75           H        LEU  75   0.489 -15.459   6.642
  578    HA   LEU  75           HA       LEU  75  -1.475 -17.590   5.931
  579    HB2  LEU  75           HB2      LEU  75  -2.027 -15.035   7.482
  580    HB3  LEU  75           HB3      LEU  75  -3.049 -16.445   7.318
  581    HG   LEU  75           HG       LEU  75  -0.463 -16.141   8.897
  582   HD11  LEU  75          HD11      LEU  75  -1.851 -16.775  10.816
  583   HD12  LEU  75          HD12      LEU  75  -2.533 -15.386   9.975
  584   HD13  LEU  75          HD13      LEU  75  -3.267 -16.987   9.754
  585   HD21  LEU  75          HD21      LEU  75  -0.192 -18.305   7.932
  586   HD22  LEU  75          HD22      LEU  75  -0.690 -18.525   9.602
  587   HD23  LEU  75          HD23      LEU  75  -1.885 -18.756   8.299
  588    H    ARG  76           H        ARG  76  -0.971 -17.163   3.581
  589    HA   ARG  76           HA       ARG  76  -1.625 -14.492   2.639
  590    HB2  ARG  76           HB2      ARG  76  -0.989 -15.129   0.502
  591    HB3  ARG  76           HB3      ARG  76   0.102 -16.037   1.546
  592    HG2  ARG  76           HG2      ARG  76  -1.282 -18.086   1.194
  593    HG3  ARG  76           HG3      ARG  76  -2.416 -17.139   0.206
  594    HD2  ARG  76           HD2      ARG  76  -1.021 -18.227  -1.349
  595    HD3  ARG  76           HD3      ARG  76  -0.547 -16.531  -1.325
  596    HE   ARG  76           HE       ARG  76   1.524 -17.075  -0.517
  597   HH11  ARG  76          HH11      ARG  76  -0.503 -19.996  -0.254
  598   HH12  ARG  76          HH12      ARG  76   0.815 -21.045   0.109
  599   HH21  ARG  76          HH21      ARG  76   3.275 -18.478  -0.019
  600   HH22  ARG  76          HH22      ARG  76   3.003 -20.158   0.249
  601    H    TYR  77           H        TYR  77  -3.257 -13.993   1.115
  602    HA   TYR  77           HA       TYR  77  -5.823 -15.389   1.716
  603    HB2  TYR  77           HB2      TYR  77  -4.968 -13.196   3.085
  604    HB3  TYR  77           HB3      TYR  77  -5.607 -12.407   1.641
  605    HD1  TYR  77           HD1      TYR  77  -6.445 -14.758   4.400
  606    HD2  TYR  77           HD2      TYR  77  -7.948 -12.025   1.419
  607    HE1  TYR  77           HE1      TYR  77  -8.620 -14.739   5.548
  608    HE2  TYR  77           HE2      TYR  77 -10.154 -12.012   2.527
  609    HH   TYR  77           HH       TYR  77 -11.371 -12.669   4.392
  610    H    LYS  78           H        LYS  78  -7.433 -14.948   0.189
  611    HA   LYS  78           HA       LYS  78  -6.729 -13.550  -2.336
  612    HB2  LYS  78           HB2      LYS  78  -7.548 -16.446  -2.032
  613    HB3  LYS  78           HB3      LYS  78  -8.354 -15.509  -3.274
  614    HG2  LYS  78           HG2      LYS  78  -6.579 -16.562  -4.327
  615    HG3  LYS  78           HG3      LYS  78  -6.187 -14.843  -4.241
  616    HD2  LYS  78           HD2      LYS  78  -4.446 -15.170  -2.707
  617    HD3  LYS  78           HD3      LYS  78  -5.070 -16.715  -2.106
  618    HE2  LYS  78           HE2      LYS  78  -3.970 -16.281  -4.921
  619    HE3  LYS  78           HE3      LYS  78  -2.976 -16.805  -3.557
  620    HZ1  LYS  78           HZ1      LYS  78  -5.281 -18.329  -4.669
  621    HZ2  LYS  78           HZ2      LYS  78  -3.708 -18.701  -4.852
  622    HZ3  LYS  78           HZ3      LYS  78  -4.390 -18.796  -3.375
  623    H    LEU  79           H        LEU  79  -8.303 -12.186  -2.875
  624    HA   LEU  79           HA       LEU  79 -10.667 -11.893  -1.233
  625    HB2  LEU  79           HB2      LEU  79  -9.851 -10.527  -3.836
  626    HB3  LEU  79           HB3      LEU  79 -11.118  -9.994  -2.745
  627    HG   LEU  79           HG       LEU  79  -8.117  -9.954  -2.261
  628   HD11  LEU  79          HD11      LEU  79  -8.487  -7.521  -2.173
  629   HD12  LEU  79          HD12      LEU  79  -9.051  -8.207  -3.708
  630   HD13  LEU  79          HD13      LEU  79 -10.230  -7.768  -2.453
  631   HD21  LEU  79          HD21      LEU  79  -9.029 -10.639  -0.230
  632   HD22  LEU  79          HD22      LEU  79  -8.675  -8.900  -0.069
  633   HD23  LEU  79          HD23      LEU  79 -10.360  -9.437  -0.301
  634    HA   PRO  80           HA       PRO  80 -13.456 -13.905  -4.230
  635    HB2  PRO  80           HB2      PRO  80 -15.848 -12.936  -3.237
  636    HB3  PRO  80           HB3      PRO  80 -14.938 -14.260  -2.426
  637    HG2  PRO  80           HG2      PRO  80 -14.920 -11.318  -1.813
  638    HG3  PRO  80           HG3      PRO  80 -15.140 -12.673  -0.660
  639    HD2  PRO  80           HD2      PRO  80 -12.718 -11.486  -1.020
  640    HD3  PRO  80           HD3      PRO  80 -12.843 -13.251  -0.783
  641    H    LYS  81           H        LYS  81 -14.568 -12.862  -6.187
  642    HA   LYS  81           HA       LYS  81 -13.170 -10.441  -6.680
  643    HB2  LYS  81           HB2      LYS  81 -15.228 -11.631  -8.499
  644    HB3  LYS  81           HB3      LYS  81 -13.993 -10.371  -8.844
  645    HG2  LYS  81           HG2      LYS  81 -12.183 -11.875  -8.616
  646    HG3  LYS  81           HG3      LYS  81 -13.220 -13.164  -8.000
  647    HD2  LYS  81           HD2      LYS  81 -12.585 -13.517 -10.356
  648    HD3  LYS  81           HD3      LYS  81 -14.334 -13.430 -10.112
  649    HE2  LYS  81           HE2      LYS  81 -14.356 -11.104 -10.987
  650    HE3  LYS  81           HE3      LYS  81 -12.602 -11.160 -11.208
  651    HZ1  LYS  81           HZ1      LYS  81 -14.550 -12.905 -12.612
  652    HZ2  LYS  81           HZ2      LYS  81 -13.774 -11.632 -13.268
  653    HZ3  LYS  81           HZ3      LYS  81 -12.925 -12.950 -12.825
  654    H    ARG  82           H        ARG  82 -16.321 -10.788  -5.314
  655    HA   ARG  82           HA       ARG  82 -17.276  -8.209  -5.990
  656    HB2  ARG  82           HB2      ARG  82 -18.699  -8.334  -4.044
  657    HB3  ARG  82           HB3      ARG  82 -18.702  -9.846  -4.962
  658    HG2  ARG  82           HG2      ARG  82 -16.999 -10.705  -3.200
  659    HG3  ARG  82           HG3      ARG  82 -17.428  -9.272  -2.252
  660    HD2  ARG  82           HD2      ARG  82 -19.377 -11.363  -3.279
  661    HD3  ARG  82           HD3      ARG  82 -18.702 -11.327  -1.635
  662    HE   ARG  82           HE       ARG  82 -19.841  -8.814  -2.006
  663   HH11  ARG  82          HH11      ARG  82 -21.041 -12.164  -1.967
  664   HH12  ARG  82          HH12      ARG  82 -22.631 -11.733  -1.440
  665   HH21  ARG  82          HH21      ARG  82 -21.970  -8.244  -1.336
  666   HH22  ARG  82          HH22      ARG  82 -23.166  -9.461  -1.081
  667    H    LEU  83           H        LEU  83 -14.775  -9.155  -3.711
  668    HA   LEU  83           HA       LEU  83 -14.638  -6.452  -2.572
  669    HB2  LEU  83           HB2      LEU  83 -13.024  -8.931  -1.911
  670    HB3  LEU  83           HB3      LEU  83 -13.004  -7.409  -1.023
  671    HG   LEU  83           HG       LEU  83 -15.351  -9.322  -1.276
  672   HD11  LEU  83          HD11      LEU  83 -13.529 -10.059   0.243
  673   HD12  LEU  83          HD12      LEU  83 -13.746  -8.574   1.186
  674   HD13  LEU  83          HD13      LEU  83 -15.063  -9.777   1.065
  675   HD21  LEU  83          HD21      LEU  83 -16.322  -7.136  -1.194
  676   HD22  LEU  83          HD22      LEU  83 -16.520  -7.899   0.380
  677   HD23  LEU  83          HD23      LEU  83 -15.266  -6.661   0.163
  678    H    VAL  84           H        VAL  84 -13.133  -8.277  -5.092
  679    HA   VAL  84           HA       VAL  84 -10.565  -6.980  -5.100
  680    HB   VAL  84           HB       VAL  84 -12.211  -8.202  -7.372
  681   HG11  VAL  84          HG11      VAL  84  -9.302  -7.351  -7.287
  682   HG12  VAL  84          HG12      VAL  84  -9.962  -8.454  -8.509
  683   HG13  VAL  84          HG13      VAL  84 -10.564  -6.801  -8.407
  684   HG21  VAL  84          HG21      VAL  84 -11.484  -9.813  -5.499
  685   HG22  VAL  84          HG22      VAL  84 -11.037 -10.202  -7.169
  686   HG23  VAL  84          HG23      VAL  84  -9.822  -9.517  -6.049
  687    H    ARG  85           H        ARG  85  -9.997  -4.970  -5.825
  688    HA   ARG  85           HA       ARG  85 -12.075  -3.290  -7.057
  689    HB2  ARG  85           HB2      ARG  85  -9.932  -2.879  -5.127
  690    HB3  ARG  85           HB3      ARG  85  -9.707  -1.780  -6.493
  691    HG2  ARG  85           HG2      ARG  85 -12.311  -2.153  -5.019
  692    HG3  ARG  85           HG3      ARG  85 -11.125  -0.858  -4.691
  693    HD2  ARG  85           HD2      ARG  85 -11.342  -0.206  -7.158
  694    HD3  ARG  85           HD3      ARG  85 -12.753  -1.247  -7.259
  695    HE   ARG  85           HE       ARG  85 -12.443   1.349  -5.925
  696   HH11  ARG  85          HH21      ARG  85 -14.583  -1.511  -6.090
  697   HH12  ARG  85          HH22      ARG  85 -15.968  -0.660  -5.515
  698   HH21  ARG  85          HH11      ARG  85 -14.282   2.447  -5.153
  699   HH22  ARG  85          HH12      ARG  85 -15.789   1.629  -4.954
  700    H    TRP  86           H        TRP  86 -12.135  -4.132  -9.019
  701    HA   TRP  86           HA       TRP  86  -9.880  -4.403 -10.767
  702    HB2  TRP  86           HB2      TRP  86 -12.887  -4.190 -11.181
  703    HB3  TRP  86           HB3      TRP  86 -11.758  -4.526 -12.496
  704    HD1  TRP  86           HD1      TRP  86 -13.800  -6.322 -10.003
  705    HE1  TRP  86           HE1      TRP  86 -13.133  -8.764  -9.795
  706    HE3  TRP  86           HE3      TRP  86  -9.457  -6.177 -12.689
  707    HZ2  TRP  86           HZ2      TRP  86 -10.798 -10.407 -10.422
  708    HZ3  TRP  86           HZ3      TRP  86  -8.033  -8.207 -12.894
  709    HH2  TRP  86           HH2      TRP  86  -8.683 -10.316 -11.739
  710    H    ASP  87           H        ASP  87 -11.795  -1.649  -9.742
  711    HA   ASP  87           HA       ASP  87 -11.613  -0.133 -12.172
  712    HB2  ASP  87           HB2      ASP  87 -13.412   0.179 -10.554
  713    HB3  ASP  87           HB3      ASP  87 -12.256   0.707  -9.326
  714    H    THR  88           H        THR  88  -9.466  -0.440  -9.403
  715    HA   THR  88           HA       THR  88  -7.894   1.887 -10.280
  716    HB   THR  88           HB       THR  88  -8.773   1.706  -7.881
  717    HG1  THR  88           HG1      THR  88  -7.268   3.222  -8.250
  718   HG21  THR  88          HG21      THR  88  -8.056  -0.715  -7.556
  719   HG22  THR  88          HG22      THR  88  -6.379  -0.135  -7.517
  720   HG23  THR  88          HG23      THR  88  -7.550   0.414  -6.285
  721    H    LYS  89           H        LYS  89  -5.477   1.544 -10.167
  722    HA   LYS  89           HA       LYS  89  -4.692  -1.103 -11.146
  723    HB2  LYS  89           HB2      LYS  89  -3.966   1.535 -12.469
  724    HB3  LYS  89           HB3      LYS  89  -3.438  -0.067 -12.992
  725    HG2  LYS  89           HG2      LYS  89  -6.323   0.903 -12.933
  726    HG3  LYS  89           HG3      LYS  89  -5.273   0.953 -14.349
  727    HD2  LYS  89           HD2      LYS  89  -5.107  -1.501 -14.396
  728    HD3  LYS  89           HD3      LYS  89  -6.034  -1.620 -12.901
  729    HE2  LYS  89           HE2      LYS  89  -7.526  -2.140 -14.687
  730    HE3  LYS  89           HE3      LYS  89  -8.001  -0.579 -14.016
  731    HZ1  LYS  89           HZ1      LYS  89  -6.431  -0.951 -16.519
  732    HZ2  LYS  89           HZ2      LYS  89  -8.019  -0.601 -16.446
  733    HZ3  LYS  89           HZ3      LYS  89  -6.934   0.497 -15.920
  734    HA   PRO  90           HA       PRO  90  -3.058  -2.349 -11.263
  735    HB2  PRO  90           HB2      PRO  90  -1.611  -3.990  -9.701
  736    HB3  PRO  90           HB3      PRO  90  -0.866  -2.880 -10.905
  737    HG2  PRO  90           HG2      PRO  90  -1.299  -2.347  -7.930
  738    HG3  PRO  90           HG3      PRO  90   0.267  -2.263  -8.822
  739    HD2  PRO  90           HD2      PRO  90  -1.258  -0.060  -8.393
  740    HD3  PRO  90           HD3      PRO  90  -0.451  -0.300  -9.974
  741    H    VAL  91           H        VAL  91  -4.360  -4.199 -10.643
  742    HA   VAL  91           HA       VAL  91  -6.250  -3.688  -8.523
  743    HB   VAL  91           HB       VAL  91  -5.791  -6.025 -10.453
  744   HG11  VAL  91          HG11      VAL  91  -8.136  -6.699 -10.003
  745   HG12  VAL  91          HG12      VAL  91  -7.095  -6.878  -8.596
  746   HG13  VAL  91          HG13      VAL  91  -8.209  -5.501  -8.690
  747   HG21  VAL  91          HG21      VAL  91  -6.333  -3.967 -11.662
  748   HG22  VAL  91          HG22      VAL  91  -7.684  -5.084 -11.734
  749   HG23  VAL  91          HG23      VAL  91  -7.737  -3.697 -10.617
  750    H    CYS  92           H        CYS  92  -6.502  -4.683  -6.594
  751    HA   CYS  92           HA       CYS  92  -4.329  -6.431  -5.609
  752    HB2  CYS  92           HB2      CYS  92  -5.462  -6.038  -3.410
  753    HB3  CYS  92           HB3      CYS  92  -4.825  -4.579  -4.187
  754    HG   CYS  92           HG       CYS  92  -7.925  -5.672  -4.335
  755    H    ILE  93           H        ILE  93  -4.700  -8.652  -5.811
  756    HA   ILE  93           HA       ILE  93  -7.549  -9.519  -5.488
  757    HB   ILE  93           HB       ILE  93  -7.317 -11.338  -6.820
  758   HG12  ILE  93          HG12      ILE  93  -5.225 -12.320  -6.163
  759   HG13  ILE  93          HG13      ILE  93  -5.339 -12.205  -7.911
  760   HG21  ILE  93          HG21      ILE  93  -5.824  -9.134  -8.298
  761   HG22  ILE  93          HG22      ILE  93  -6.740 -10.474  -9.015
  762   HG23  ILE  93          HG23      ILE  93  -7.582  -9.252  -8.047
  763   HD11  ILE  93          HD11      ILE  93  -3.101 -11.687  -7.322
  764   HD12  ILE  93          HD12      ILE  93  -3.828 -10.137  -7.769
  765   HD13  ILE  93          HD13      ILE  93  -3.599 -10.572  -6.050
  766    H    GLY  94           H        GLY  94  -4.517  -9.566  -3.874
  767    HA2  GLY  94           HA2      GLY  94  -5.640 -10.948  -1.663
  768    HA3  GLY  94           HA3      GLY  94  -4.583 -12.033  -2.606
  769    H    GLN  95           H        GLN  95  -3.501 -11.836  -0.380
  770    HA   GLN  95           HA       GLN  95  -1.150 -10.184  -0.708
  771    HB2  GLN  95           HB2      GLN  95  -1.341  -9.271   1.665
  772    HB3  GLN  95           HB3      GLN  95  -2.270  -8.476   0.410
  773    HG2  GLN  95           HG2      GLN  95  -3.555 -10.577   2.166
  774    HG3  GLN  95           HG3      GLN  95  -3.321  -8.940   2.769
  775   HE21  GLN  95          HE21      GLN  95  -5.890 -10.287   2.298
  776   HE22  GLN  95          HE22      GLN  95  -6.730  -9.292   1.125
  777    H    LYS  96           H        LYS  96   0.529 -10.765   0.793
  778    HA   LYS  96           HA       LYS  96   0.077 -13.408   2.133
  779    HB2  LYS  96           HB2      LYS  96   2.531 -13.725   2.071
  780    HB3  LYS  96           HB3      LYS  96   1.766 -13.734   0.486
  781    HG2  LYS  96           HG2      LYS  96   2.499 -11.433   0.065
  782    HG3  LYS  96           HG3      LYS  96   3.277 -11.353   1.654
  783    HD2  LYS  96           HD2      LYS  96   4.031 -13.279  -0.587
  784    HD3  LYS  96           HD3      LYS  96   4.830 -11.737  -0.259
  785    HE2  LYS  96           HE2      LYS  96   5.463 -12.544   2.028
  786    HE3  LYS  96           HE3      LYS  96   4.728 -14.112   1.666
  787    HZ1  LYS  96           HZ1      LYS  96   7.111 -14.169   1.269
  788    HZ2  LYS  96           HZ2      LYS  96   6.342 -14.373  -0.157
  789    HZ3  LYS  96           HZ3      LYS  96   7.038 -12.931   0.208
  790    H    GLN  97           H        GLN  97   0.055 -13.265   4.405
  791    HA   GLN  97           HA       GLN  97   0.930 -10.630   5.496
  792    HB2  GLN  97           HB2      GLN  97  -1.489 -10.819   5.229
  793    HB3  GLN  97           HB3      GLN  97  -1.515 -12.205   6.334
  794    HG2  GLN  97           HG2      GLN  97  -0.800 -10.844   8.190
  795    HG3  GLN  97           HG3      GLN  97  -0.251  -9.552   7.140
  796   HE21  GLN  97          HE22      GLN  97  -1.527  -8.113   8.570
  797   HE22  GLN  97          HE21      GLN  97  -3.264  -8.018   8.320
  798    H    LYS  98           H        LYS  98   2.311 -10.631   7.050
  799    HA   LYS  98           HA       LYS  98   3.029 -13.087   8.574
  800    HB2  LYS  98           HB2      LYS  98   4.039 -10.195   8.464
  801    HB3  LYS  98           HB3      LYS  98   4.549 -11.280   9.743
  802    HG2  LYS  98           HG2      LYS  98   4.880 -12.331   7.001
  803    HG3  LYS  98           HG3      LYS  98   5.856 -10.906   7.450
  804    HD2  LYS  98           HD2      LYS  98   7.039 -11.992   9.072
  805    HD3  LYS  98           HD3      LYS  98   5.805 -13.242   9.332
  806    HE2  LYS  98           HE2      LYS  98   6.347 -14.227   7.086
  807    HE3  LYS  98           HE3      LYS  98   7.621 -13.023   6.884
  808    HZ1  LYS  98           HZ1      LYS  98   8.734 -13.984   8.854
  809    HZ2  LYS  98           HZ2      LYS  98   7.548 -15.115   9.029
  810    HZ3  LYS  98           HZ3      LYS  98   8.516 -15.125   7.709
  811    H    TRP  99           H        TRP  99   2.911 -13.073  10.884
  812    HA   TRP  99           HA       TRP  99   1.503 -10.813  12.151
  813    HB2  TRP  99           HB2      TRP  99   0.813 -13.733  12.608
  814    HB3  TRP  99           HB3      TRP  99   0.224 -12.370  13.554
  815    HD1  TRP  99           HD1      TRP  99  -0.121 -14.014  10.135
  816    HE1  TRP  99           HE1      TRP  99  -2.192 -13.126   8.915
  817    HE3  TRP  99           HE3      TRP  99  -1.519 -10.391  13.468
  818    HZ2  TRP  99           HZ2      TRP  99  -4.195 -11.109   9.326
  819    HZ3  TRP  99           HZ3      TRP  99  -3.409  -8.881  12.938
  820    HH2  TRP  99           HH2      TRP  99  -4.790  -9.252  10.902
  821    H    PHE 100           H        PHE 100   2.407 -10.363  14.187
  822    HA   PHE 100           HA       PHE 100   4.761 -11.983  15.060
  823    HB2  PHE 100           HB2      PHE 100   4.315  -8.991  14.768
  824    HB3  PHE 100           HB3      PHE 100   5.583  -9.661  15.776
  825    HD1  PHE 100           HD2      PHE 100   4.358  -9.751  12.143
  826    HD2  PHE 100           HD1      PHE 100   7.709  -9.995  14.904
  827    HE1  PHE 100           HE2      PHE 100   5.984  -9.659  10.274
  828    HE2  PHE 100           HE1      PHE 100   9.270 -10.011  13.013
  829    HZ   PHE 100           HZ       PHE 100   8.417  -9.853  10.692
  830    H    LEU 101           H        LEU 101   4.792 -12.405  17.247
  831    HA   LEU 101           HA       LEU 101   2.660 -11.219  18.972
  832    HB2  LEU 101           HB2      LEU 101   2.575 -13.589  19.181
  833    HB3  LEU 101           HB3      LEU 101   4.335 -13.723  19.208
  834    HG   LEU 101           HG       LEU 101   4.412 -12.673  21.434
  835   HD11  LEU 101          HD11      LEU 101   1.400 -12.609  21.260
  836   HD12  LEU 101          HD12      LEU 101   2.366 -12.336  22.741
  837   HD13  LEU 101          HD13      LEU 101   2.481 -11.202  21.399
  838   HD21  LEU 101          HD21      LEU 101   4.168 -15.181  21.219
  839   HD22  LEU 101          HD22      LEU 101   3.533 -14.522  22.732
  840   HD23  LEU 101          HD23      LEU 101   2.419 -14.971  21.427
  841    H    LEU 102           H        LEU 102   3.392  -9.439  20.076
  842    HA   LEU 102           HA       LEU 102   6.239  -9.503  20.916
  843    HB2  LEU 102           HB2      LEU 102   4.601  -6.959  20.770
  844    HB3  LEU 102           HB3      LEU 102   6.315  -7.168  20.993
  845    HG   LEU 102           HG       LEU 102   6.015  -6.192  18.938
  846   HD11  LEU 102          HD11      LEU 102   6.587  -9.117  18.379
  847   HD12  LEU 102          HD12      LEU 102   6.961  -7.751  17.307
  848   HD13  LEU 102          HD13      LEU 102   7.741  -7.845  18.892
  849   HD21  LEU 102          HD21      LEU 102   4.109  -8.305  17.927
  850   HD22  LEU 102          HD22      LEU 102   3.651  -6.704  18.561
  851   HD23  LEU 102          HD23      LEU 102   4.654  -6.817  17.115
  852    H    GLN 103           H        GLN 103   6.477  -9.264  23.236
  853    HA   GLN 103           HA       GLN 103   3.864  -9.097  24.697
  854    HB2  GLN 103           HB2      GLN 103   4.948 -10.750  25.584
  855    HB3  GLN 103           HB3      GLN 103   6.563 -10.018  25.536
  856    HG2  GLN 103           HG2      GLN 103   6.137  -8.766  27.523
  857    HG3  GLN 103           HG3      GLN 103   4.400  -8.681  27.216
  858   HE21  GLN 103          HE22      GLN 103   3.040 -10.596  27.534
  859   HE22  GLN 103          HE21      GLN 103   3.540 -11.772  28.746
  860    H    LEU 104           H        LEU 104   3.227  -7.146  25.569
  861    HA   LEU 104           HA       LEU 104   4.677  -4.684  25.192
  862    HB2  LEU 104           HB2      LEU 104   2.047  -5.605  26.124
  863    HB3  LEU 104           HB3      LEU 104   2.696  -4.477  27.286
  864    HG   LEU 104           HG       LEU 104   2.564  -3.900  24.311
  865   HD11  LEU 104          HD11      LEU 104   0.564  -2.614  24.700
  866   HD12  LEU 104          HD12      LEU 104   0.283  -4.269  25.238
  867   HD13  LEU 104          HD13      LEU 104   0.583  -3.000  26.438
  868   HD21  LEU 104          HD21      LEU 104   2.729  -1.500  25.254
  869   HD22  LEU 104          HD22      LEU 104   3.256  -2.244  26.777
  870   HD23  LEU 104          HD23      LEU 104   4.188  -2.496  25.299
  871    H    VAL 105           H        VAL 105   5.975  -3.551  26.685
  872    HA   VAL 105           HA       VAL 105   7.121  -5.290  28.735
  873    HB   VAL 105           HB       VAL 105   7.998  -2.670  27.529
  874   HG11  VAL 105          HG11      VAL 105  10.205  -3.059  28.586
  875   HG12  VAL 105          HG12      VAL 105   8.941  -2.756  29.778
  876   HG13  VAL 105          HG13      VAL 105   9.517  -4.415  29.509
  877   HG21  VAL 105          HG21      VAL 105   8.093  -4.823  26.104
  878   HG22  VAL 105          HG22      VAL 105   9.593  -3.910  26.257
  879   HG23  VAL 105          HG23      VAL 105   9.327  -5.385  27.237
  880    H    SER 106           H        SER 106   5.693  -1.979  28.604
  881    HA   SER 106           HA       SER 106   5.630  -1.881  31.564
  882    HB2  SER 106           HB2      SER 106   4.663   0.039  29.418
  883    HB3  SER 106           HB3      SER 106   4.595   0.352  31.161
  884    HG   SER 106           HG       SER 106   6.834   0.101  29.461
  885    H    GLY 107           H        GLY 107   3.562  -2.810  28.936
  886    HA2  GLY 107           HA2      GLY 107   1.629  -4.231  29.344
  887    HA3  GLY 107           HA3      GLY 107   1.329  -3.356  30.844
  888    H    ASP 108           H        ASP 108  -0.820  -3.213  29.801
  889    HA   ASP 108           HA       ASP 108  -1.460  -2.065  27.411
  890    HB2  ASP 108           HB2      ASP 108  -3.010  -3.348  28.583
  891    HB3  ASP 108           HB3      ASP 108  -2.876  -2.373  30.049
  892    H    ALA 109           H        ALA 109  -0.538  -0.420  30.328
  893    HA   ALA 109           HA       ALA 109  -1.596   2.141  30.010
  894    HB1  ALA 109           HB1      ALA 109   0.369   2.864  31.326
  895    HB2  ALA 109           HB2      ALA 109  -0.290   1.349  31.972
  896    HB3  ALA 109           HB3      ALA 109   1.184   1.325  30.969
  897    H    GLU 110           H        GLU 110   1.073   0.670  28.190
  898    HA   GLU 110           HA       GLU 110   1.855   3.280  27.199
  899    HB2  GLU 110           HB2      GLU 110   3.184   0.587  27.222
  900    HB3  GLU 110           HB3      GLU 110   3.750   1.790  26.064
  901    HG2  GLU 110           HG2      GLU 110   3.522   2.271  29.048
  902    HG3  GLU 110           HG3      GLU 110   5.010   1.814  28.205
  903    H    ILE 111           H        ILE 111  -0.586   1.952  26.349
  904    HA   ILE 111           HA       ILE 111  -0.197   1.936  23.389
  905    HB   ILE 111           HB       ILE 111  -2.651   1.128  24.998
  906   HG12  ILE 111          HG12      ILE 111  -0.988  -0.738  23.247
  907   HG13  ILE 111          HG13      ILE 111  -0.542  -0.478  24.953
  908   HG21  ILE 111          HG21      ILE 111  -2.005   1.132  22.024
  909   HG22  ILE 111          HG22      ILE 111  -3.391   0.260  22.713
  910   HG23  ILE 111          HG23      ILE 111  -3.321   2.018  22.840
  911   HD11  ILE 111          HD11      ILE 111  -1.973  -2.486  24.670
  912   HD12  ILE 111          HD12      ILE 111  -2.708  -1.258  25.717
  913   HD13  ILE 111          HD13      ILE 111  -3.295  -1.464  24.079
  914    H    ASN 112           H        ASN 112  -0.987   3.543  22.138
  915    HA   ASN 112           HA       ASN 112  -2.669   5.711  23.306
  916    HB2  ASN 112           HB2      ASN 112  -0.470   6.685  23.031
  917    HB3  ASN 112           HB3      ASN 112  -0.269   5.921  21.452
  918   HD21  ASN 112          HD22      ASN 112   0.175   8.102  20.525
  919   HD22  ASN 112          HD21      ASN 112  -1.214   9.102  20.129
  920    H    MET 113           H        MET 113  -4.520   6.027  22.098
  921    HA   MET 113           HA       MET 113  -4.916   4.298  19.707
  922    HB2  MET 113           HB2      MET 113  -6.792   5.661  21.679
  923    HB3  MET 113           HB3      MET 113  -7.366   4.816  20.241
  924    HG2  MET 113           HG2      MET 113  -5.466   3.347  22.069
  925    HG3  MET 113           HG3      MET 113  -7.142   3.574  22.587
  926    HE1  MET 113           HE1      MET 113  -4.730   1.353  20.772
  927    HE2  MET 113           HE2      MET 113  -5.676   0.703  22.139
  928    HE3  MET 113           HE3      MET 113  -5.863   0.008  20.512
  929    H    GLN 114           H        GLN 114  -4.044   7.490  20.259
  930    HA   GLN 114           HA       GLN 114  -5.276   8.444  17.779
  931    HB2  GLN 114           HB2      GLN 114  -5.258  10.709  18.643
  932    HB3  GLN 114           HB3      GLN 114  -6.466   9.646  19.354
  933    HG2  GLN 114           HG2      GLN 114  -5.082   9.388  21.402
  934    HG3  GLN 114           HG3      GLN 114  -3.889  10.508  20.734
  935   HE21  GLN 114          HE22      GLN 114  -4.822  12.758  20.066
  936   HE22  GLN 114          HE21      GLN 114  -6.052  13.427  21.111
  937    H    THR 115           H        THR 115  -3.568   7.421  16.898
  938    HA   THR 115           HA       THR 115  -0.820   8.057  17.430
  939    HB   THR 115           HB       THR 115  -0.722   6.616  15.239
  940    HG1  THR 115           HG1      THR 115  -2.599   5.482  14.809
  941   HG21  THR 115          HG21      THR 115  -1.185   4.561  16.615
  942   HG22  THR 115          HG22      THR 115  -0.293   5.769  17.549
  943   HG23  THR 115          HG23      THR 115  -2.037   5.555  17.819
  944    H    SER 116           H        SER 116  -2.782   8.299  14.531
  945    HA   SER 116           HA       SER 116  -1.439  10.695  13.513
  946    HB2  SER 116           HB2      SER 116  -3.884   9.203  12.473
  947    HB3  SER 116           HB3      SER 116  -2.937  10.420  11.604
  948    HG   SER 116           HG       SER 116  -2.318   8.281  11.023
  949    H    SER 117           H        SER 117  -3.089  12.518  12.697
  950    HA   SER 117           HA       SER 117  -4.350  13.772  14.868
  951    HB2  SER 117           HB2      SER 117  -5.115  14.048  11.936
  952    HB3  SER 117           HB3      SER 117  -5.268  15.269  13.215
  953    HG   SER 117           HG       SER 117  -3.409  15.643  11.912
  954    H    THR 118           H        THR 118  -5.586  11.380  12.542
  955    HA   THR 118           HA       THR 118  -8.230  11.271  13.781
  956    HB   THR 118           HB       THR 118  -8.153   9.214  12.073
  957    HG1  THR 118           HG1      THR 118  -7.059   9.816  10.192
  958   HG21  THR 118          HG21      THR 118  -9.377  10.635  10.508
  959   HG22  THR 118          HG22      THR 118  -9.865  10.866  12.189
  960   HG23  THR 118          HG23      THR 118  -8.824  12.085  11.402
  961    HA   PRO 119           HA       PRO 119  -6.469   7.913  16.280
  962    HB2  PRO 119           HB2      PRO 119  -8.811   7.053  17.457
  963    HB3  PRO 119           HB3      PRO 119  -7.863   8.443  18.041
  964    HG2  PRO 119           HG2      PRO 119 -10.339   8.458  16.333
  965    HG3  PRO 119           HG3      PRO 119  -9.883   9.569  17.671
  966    HD2  PRO 119           HD2      PRO 119  -9.578  10.164  14.974
  967    HD3  PRO 119           HD3      PRO 119  -8.518  10.854  16.242
  968    H    GLU 120           H        GLU 120  -5.955   6.091  15.188
  969    HA   GLU 120           HA       GLU 120  -7.575   5.226  12.981
  970    HB2  GLU 120           HB2      GLU 120  -4.905   4.576  14.010
  971    HB3  GLU 120           HB3      GLU 120  -5.763   3.106  13.571
  972    HG2  GLU 120           HG2      GLU 120  -5.301   5.528  11.788
  973    HG3  GLU 120           HG3      GLU 120  -4.492   3.969  11.672
  974    H    PHE 121           H        PHE 121  -7.781   4.484  16.328
  975    HA   PHE 121           HA       PHE 121  -9.567   2.188  15.713
  976    HB2  PHE 121           HB2      PHE 121  -7.849   2.698  18.140
  977    HB3  PHE 121           HB3      PHE 121  -9.069   1.435  18.041
  978    HD1  PHE 121           HD2      PHE 121  -8.685   0.142  15.466
  979    HD2  PHE 121           HD1      PHE 121  -5.737   1.650  18.210
  980    HE1  PHE 121           HE2      PHE 121  -7.059  -1.503  14.605
  981    HE2  PHE 121           HE1      PHE 121  -4.152  -0.071  17.436
  982    HZ   PHE 121           HZ       PHE 121  -4.795  -1.640  15.609
  983    H    ASP 122           H        ASP 122 -11.542   2.163  16.579
  984    HA   ASP 122           HA       ASP 122 -12.696   4.605  17.769
  985    HB2  ASP 122           HB2      ASP 122 -13.994   3.416  16.070
  986    HB3  ASP 122           HB3      ASP 122 -13.857   1.903  16.975
  987    H    GLY 123           H        GLY 123 -11.451   1.414  18.708
  988    HA2  GLY 123           HA2      GLY 123 -11.727   1.943  21.542
  989    HA3  GLY 123           HA3      GLY 123 -12.893   0.746  20.922
  990    H    TRP 124           H        TRP 124 -11.078  -0.075  22.813
  991    HA   TRP 124           HA       TRP 124  -9.882  -2.218  21.319
  992    HB2  TRP 124           HB2      TRP 124  -7.689  -2.009  21.783
  993    HB3  TRP 124           HB3      TRP 124  -8.082  -0.308  21.664
  994    HD1  TRP 124           HD1      TRP 124  -6.372  -2.709  23.796
  995    HE1  TRP 124           HE1      TRP 124  -5.910  -1.793  26.165
  996    HE3  TRP 124           HE3      TRP 124  -9.366   1.473  23.740
  997    HZ2  TRP 124           HZ2      TRP 124  -7.183  -0.015  27.968
  998    HZ3  TRP 124           HZ3      TRP 124  -9.734   2.749  25.835
  999    HH2  TRP 124           HH2      TRP 124  -8.683   2.009  27.966
 1000    H    ARG 125           H        ARG 125  -9.239  -4.017  22.809
 1001    HA   ARG 125           HA       ARG 125  -9.995  -3.807  25.588
 1002    HB2  ARG 125           HB2      ARG 125 -11.727  -5.511  25.635
 1003    HB3  ARG 125           HB3      ARG 125 -12.223  -4.194  24.588
 1004    HG2  ARG 125           HG2      ARG 125 -11.403  -5.629  22.613
 1005    HG3  ARG 125           HG3      ARG 125 -11.283  -6.966  23.741
 1006    HD2  ARG 125           HD2      ARG 125 -13.834  -5.329  23.323
 1007    HD3  ARG 125           HD3      ARG 125 -13.435  -6.778  22.395
 1008    HE   ARG 125           HE       ARG 125 -13.370  -7.114  25.313
 1009   HH11  ARG 125          HH11      ARG 125 -15.578  -7.163  22.520
 1010   HH12  ARG 125          HH12      ARG 125 -16.527  -8.480  23.133
 1011   HH21  ARG 125          HH21      ARG 125 -14.756  -8.740  26.187
 1012   HH22  ARG 125          HH22      ARG 125 -16.127  -9.283  25.290
 1013    H    TRP 126           H        TRP 126  -9.533  -5.935  26.698
 1014    HA   TRP 126           HA       TRP 126  -7.441  -7.503  25.261
 1015    HB2  TRP 126           HB2      TRP 126  -7.650  -6.571  28.129
 1016    HB3  TRP 126           HB3      TRP 126  -6.711  -7.999  27.688
 1017    HD1  TRP 126           HD1      TRP 126  -6.780  -4.182  27.089
 1018    HE1  TRP 126           HE1      TRP 126  -4.456  -3.353  26.737
 1019    HE3  TRP 126           HE3      TRP 126  -4.366  -8.704  26.785
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.808  -4.450  26.438
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.912  -8.758  26.530
 1022    HH2  TRP 126           HH2      TRP 126  -0.609  -6.626  26.440
 1023    H    VAL 127           H        VAL 127  -7.850  -9.678  25.082
 1024    HA   VAL 127           HA       VAL 127 -10.261 -10.839  26.386
 1025    HB   VAL 127           HB       VAL 127 -10.647 -11.730  23.910
 1026   HG11  VAL 127          HG11      VAL 127 -12.335 -10.521  25.134
 1027   HG12  VAL 127          HG12      VAL 127 -11.477  -8.979  24.910
 1028   HG13  VAL 127          HG13      VAL 127 -12.221  -9.789  23.523
 1029   HG21  VAL 127          HG21      VAL 127 -10.228 -10.179  22.131
 1030   HG22  VAL 127          HG22      VAL 127  -9.438  -9.032  23.223
 1031   HG23  VAL 127          HG23      VAL 127  -8.688 -10.615  22.886
 1032    H    SER 128           H        SER 128 -10.304 -13.191  26.402
 1033    HA   SER 128           HA       SER 128  -7.813 -14.548  26.436
 1034    HB2  SER 128           HB2      SER 128 -10.637 -15.608  25.987
 1035    HB3  SER 128           HB3      SER 128  -9.243 -16.557  26.564
 1036    HG   SER 128           HG       SER 128 -10.645 -15.786  28.281
 1037    H    TYR 129           H        TYR 129  -6.767 -15.862  24.852
 1038    HA   TYR 129           HA       TYR 129  -6.716 -14.803  22.330
 1039    HB2  TYR 129           HB2      TYR 129  -5.680 -17.333  21.863
 1040    HB3  TYR 129           HB3      TYR 129  -4.822 -15.919  22.407
 1041    HD1  TYR 129           HD1      TYR 129  -6.838 -18.750  23.877
 1042    HD2  TYR 129           HD2      TYR 129  -3.394 -16.171  24.252
 1043    HE1  TYR 129           HE1      TYR 129  -6.174 -19.944  25.938
 1044    HE2  TYR 129           HE2      TYR 129  -2.726 -17.379  26.305
 1045    HH   TYR 129           HH       TYR 129  -3.266 -19.030  27.875
 1046    H    TRP 130           H        TRP 130  -8.823 -17.572  23.234
 1047    HA   TRP 130           HA       TRP 130  -9.417 -18.015  20.400
 1048    HB2  TRP 130           HB2      TRP 130 -10.636 -19.334  22.833
 1049    HB3  TRP 130           HB3      TRP 130 -10.737 -19.878  21.160
 1050    HD1  TRP 130           HD1      TRP 130  -9.033 -20.803  24.119
 1051    HE1  TRP 130           HE1      TRP 130  -6.791 -21.970  23.725
 1052    HE3  TRP 130           HE3      TRP 130  -8.343 -19.628  19.159
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.902 -22.274  21.601
 1054    HZ3  TRP 130           HZ3      TRP 130  -6.320 -20.432  17.971
 1055    HH2  TRP 130           HH2      TRP 130  -4.577 -21.721  19.189
 1056    H    TYR 131           H        TYR 131 -10.628 -15.744  22.611
 1057    HA   TYR 131           HA       TYR 131 -13.410 -15.863  21.782
 1058    HB2  TYR 131           HB2      TYR 131 -12.909 -15.134  23.963
 1059    HB3  TYR 131           HB3      TYR 131 -11.822 -13.872  23.396
 1060    HD1  TYR 131           HD1      TYR 131 -12.688 -11.801  22.340
 1061    HD2  TYR 131           HD2      TYR 131 -15.357 -14.819  23.890
 1062    HE1  TYR 131           HE1      TYR 131 -14.550 -10.175  22.308
 1063    HE2  TYR 131           HE2      TYR 131 -17.220 -13.198  23.857
 1064    HH   TYR 131           HH       TYR 131 -17.883 -10.990  23.376
 1065    HA   PRO 132           HA       PRO 132 -12.396 -11.860  19.288
 1066    HB2  PRO 132           HB2      PRO 132  -9.900 -11.619  18.108
 1067    HB3  PRO 132           HB3      PRO 132 -10.356 -10.927  19.697
 1068    HG2  PRO 132           HG2      PRO 132  -8.949 -13.556  19.185
 1069    HG3  PRO 132           HG3      PRO 132  -8.472 -12.234  20.308
 1070    HD2  PRO 132           HD2      PRO 132  -9.808 -14.340  21.192
 1071    HD3  PRO 132           HD3      PRO 132 -10.297 -12.725  21.768
 1072    H    VAL 133           H        VAL 133 -11.203 -15.037  18.531
 1073    HA   VAL 133           HA       VAL 133 -11.309 -14.950  15.666
 1074    HB   VAL 133           HB       VAL 133 -11.721 -17.345  17.512
 1075   HG11  VAL 133          HG11      VAL 133 -12.138 -17.766  15.096
 1076   HG12  VAL 133          HG12      VAL 133 -10.503 -17.183  14.716
 1077   HG13  VAL 133          HG13      VAL 133 -10.743 -18.651  15.699
 1078   HG21  VAL 133          HG21      VAL 133  -9.053 -16.169  16.594
 1079   HG22  VAL 133          HG22      VAL 133  -9.633 -16.282  18.268
 1080   HG23  VAL 133          HG23      VAL 133  -9.266 -17.752  17.378
 1081    H    ARG 134           H        ARG 134 -13.745 -15.435  18.274
 1082    HA   ARG 134           HA       ARG 134 -15.619 -16.820  16.586
 1083    HB2  ARG 134           HB2      ARG 134 -16.258 -15.249  19.109
 1084    HB3  ARG 134           HB3      ARG 134 -17.168 -16.579  18.416
 1085    HG2  ARG 134           HG2      ARG 134 -14.596 -16.640  19.992
 1086    HG3  ARG 134           HG3      ARG 134 -16.126 -17.420  20.344
 1087    HD2  ARG 134           HD2      ARG 134 -15.718 -18.963  18.386
 1088    HD3  ARG 134           HD3      ARG 134 -14.149 -18.179  18.167
 1089    HE   ARG 134           HE       ARG 134 -13.335 -19.003  20.176
 1090   HH11  ARG 134          HH11      ARG 134 -16.610 -20.283  19.560
 1091   HH12  ARG 134          HH12      ARG 134 -16.459 -21.596  20.668
 1092   HH21  ARG 134          HH21      ARG 134 -13.142 -20.789  21.650
 1093   HH22  ARG 134          HH22      ARG 134 -14.458 -21.874  21.880
 1094    H    GLN 135           H        GLN 135 -14.957 -13.384  17.067
 1095    HA   GLN 135           HA       GLN 135 -17.623 -12.598  16.170
 1096    HB2  GLN 135           HB2      GLN 135 -15.123 -11.089  16.969
 1097    HB3  GLN 135           HB3      GLN 135 -16.456 -10.255  16.187
 1098    HG2  GLN 135           HG2      GLN 135 -16.753 -10.058  18.581
 1099    HG3  GLN 135           HG3      GLN 135 -18.037 -11.041  17.906
 1100   HE21  GLN 135          HE22      GLN 135 -14.751 -11.424  19.436
 1101   HE22  GLN 135          HE21      GLN 135 -15.131 -12.938  20.215
 1102    H    VAL 136           H        VAL 136 -14.598 -13.230  14.457
 1103    HA   VAL 136           HA       VAL 136 -15.422 -11.508  12.237
 1104    HB   VAL 136           HB       VAL 136 -13.250 -12.126  11.301
 1105   HG11  VAL 136          HG11      VAL 136 -13.069 -11.086  14.156
 1106   HG12  VAL 136          HG12      VAL 136 -11.915 -10.800  12.837
 1107   HG13  VAL 136          HG13      VAL 136 -13.548 -10.122  12.738
 1108   HG21  VAL 136          HG21      VAL 136 -11.527 -13.234  12.558
 1109   HG22  VAL 136          HG22      VAL 136 -12.617 -13.517  13.927
 1110   HG23  VAL 136          HG23      VAL 136 -12.893 -14.342  12.376
 1111    H    VAL 137           H        VAL 137 -15.329 -12.413   9.946
 1112    HA   VAL 137           HA       VAL 137 -17.338 -14.468   9.757
 1113    HB   VAL 137           HB       VAL 137 -17.474 -13.967   7.482
 1114   HG11  VAL 137          HG11      VAL 137 -18.087 -12.034   8.946
 1115   HG12  VAL 137          HG12      VAL 137 -16.495 -11.314   8.610
 1116   HG13  VAL 137          HG13      VAL 137 -17.640 -11.594   7.292
 1117   HG21  VAL 137          HG21      VAL 137 -15.613 -12.614   6.287
 1118   HG22  VAL 137          HG22      VAL 137 -14.559 -13.138   7.637
 1119   HG23  VAL 137          HG23      VAL 137 -15.365 -14.335   6.594
 1120    H    SER 138           H        SER 138 -16.943 -16.247   7.890
 1121    HA   SER 138           HA       SER 138 -15.416 -18.238   9.050
 1122    HB2  SER 138           HB2      SER 138 -16.279 -17.993   6.148
 1123    HB3  SER 138           HB3      SER 138 -16.003 -19.503   7.055
 1124    HG   SER 138           HG       SER 138 -18.243 -18.923   6.973
 1125    H    PHE 139           H        PHE 139 -14.447 -16.262   6.156
 1126    HA   PHE 139           HA       PHE 139 -12.005 -17.693   5.753
 1127    HB2  PHE 139           HB2      PHE 139 -12.749 -14.856   4.946
 1128    HB3  PHE 139           HB3      PHE 139 -11.396 -15.789   4.308
 1129    HD1  PHE 139           HD2      PHE 139 -11.882 -17.949   3.051
 1130    HD2  PHE 139           HD1      PHE 139 -14.886 -14.981   3.928
 1131    HE1  PHE 139           HE2      PHE 139 -13.340 -18.906   1.273
 1132    HE2  PHE 139           HE1      PHE 139 -16.342 -15.928   2.147
 1133    HZ   PHE 139           HZ       PHE 139 -15.575 -17.891   0.818
 1134    H    LYS 140           H        LYS 140 -12.741 -14.681   7.558
 1135    HA   LYS 140           HA       LYS 140  -9.939 -14.235   8.248
 1136    HB2  LYS 140           HB2      LYS 140 -12.495 -13.011   9.339
 1137    HB3  LYS 140           HB3      LYS 140 -10.856 -12.496   9.791
 1138    HG2  LYS 140           HG2      LYS 140 -10.356 -12.040   7.381
 1139    HG3  LYS 140           HG3      LYS 140 -12.036 -12.412   6.979
 1140    HD2  LYS 140           HD2      LYS 140 -11.083 -10.146   8.771
 1141    HD3  LYS 140           HD3      LYS 140 -11.673 -10.014   7.103
 1142    HE2  LYS 140           HE2      LYS 140 -13.873 -10.959   7.826
 1143    HE3  LYS 140           HE3      LYS 140 -13.293 -10.982   9.503
 1144    HZ1  LYS 140           HZ1      LYS 140 -13.587  -8.532   7.797
 1145    HZ2  LYS 140           HZ2      LYS 140 -14.599  -8.942   9.008
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.053  -8.517   9.345
 1147    H    ARG 141           H        ARG 141 -12.734 -15.702   9.900
 1148    HA   ARG 141           HA       ARG 141 -11.606 -16.393  12.385
 1149    HB2  ARG 141           HB2      ARG 141 -13.500 -17.815  10.505
 1150    HB3  ARG 141           HB3      ARG 141 -12.836 -18.747  11.834
 1151    HG2  ARG 141           HG2      ARG 141 -13.869 -17.470  13.478
 1152    HG3  ARG 141           HG3      ARG 141 -14.111 -16.092  12.404
 1153    HD2  ARG 141           HD2      ARG 141 -16.227 -17.198  12.863
 1154    HD3  ARG 141           HD3      ARG 141 -15.805 -17.251  11.152
 1155    HE   ARG 141           HE       ARG 141 -14.990 -19.609  12.717
 1156   HH11  ARG 141          HH11      ARG 141 -17.689 -18.216  10.856
 1157   HH12  ARG 141          HH12      ARG 141 -18.368 -19.740  10.433
 1158   HH21  ARG 141          HH21      ARG 141 -15.925 -21.647  12.180
 1159   HH22  ARG 141          HH22      ARG 141 -17.382 -21.727  11.264
 1160    H    ASP 142           H        ASP 142 -11.067 -18.168   9.257
 1161    HA   ASP 142           HA       ASP 142  -9.381 -20.100  10.460
 1162    HB2  ASP 142           HB2      ASP 142 -10.311 -20.432   8.223
 1163    HB3  ASP 142           HB3      ASP 142  -9.283 -19.127   7.593
 1164    H    VAL 143           H        VAL 143  -8.549 -16.964   8.927
 1165    HA   VAL 143           HA       VAL 143  -5.724 -17.232   9.375
 1166    HB   VAL 143           HB       VAL 143  -7.534 -14.795   9.042
 1167   HG11  VAL 143          HG11      VAL 143  -5.514 -13.473   8.571
 1168   HG12  VAL 143          HG12      VAL 143  -5.494 -14.039  10.243
 1169   HG13  VAL 143          HG13      VAL 143  -4.491 -14.848   9.017
 1170   HG21  VAL 143          HG21      VAL 143  -5.613 -16.239   7.158
 1171   HG22  VAL 143          HG22      VAL 143  -7.387 -16.248   7.060
 1172   HG23  VAL 143          HG23      VAL 143  -6.489 -14.741   6.783
 1173    H    TYR 144           H        TYR 144  -8.334 -15.731  11.369
 1174    HA   TYR 144           HA       TYR 144  -6.551 -14.722  13.312
 1175    HB2  TYR 144           HB2      TYR 144  -9.541 -15.130  13.173
 1176    HB3  TYR 144           HB3      TYR 144  -8.784 -14.647  14.677
 1177    HD1  TYR 144           HD2      TYR 144  -7.688 -13.457  11.245
 1178    HD2  TYR 144           HD1      TYR 144  -9.715 -12.473  14.934
 1179    HE1  TYR 144           HE2      TYR 144  -7.533 -11.085  10.679
 1180    HE2  TYR 144           HE1      TYR 144  -9.606 -10.076  14.330
 1181    HH   TYR 144           HH       TYR 144  -8.012  -8.904  11.322
 1182    H    ARG 145           H        ARG 145  -8.243 -17.913  13.171
 1183    HA   ARG 145           HA       ARG 145  -7.259 -18.637  15.802
 1184    HB2  ARG 145           HB2      ARG 145  -8.142 -20.739  15.474
 1185    HB3  ARG 145           HB3      ARG 145  -9.162 -19.727  14.461
 1186    HG2  ARG 145           HG2      ARG 145  -7.407 -20.461  12.584
 1187    HG3  ARG 145           HG3      ARG 145  -7.132 -21.820  13.676
 1188    HD2  ARG 145           HD2      ARG 145  -9.604 -22.266  13.569
 1189    HD3  ARG 145           HD3      ARG 145  -9.748 -20.864  12.493
 1190    HE   ARG 145           HE       ARG 145  -8.566 -21.994  10.755
 1191   HH11  ARG 145          HH11      ARG 145  -9.165 -24.251  13.470
 1192   HH12  ARG 145          HH12      ARG 145  -8.946 -25.645  12.477
 1193   HH21  ARG 145          HH21      ARG 145  -8.342 -23.695   9.532
 1194   HH22  ARG 145          HH22      ARG 145  -8.452 -25.342  10.126
 1195    H    ARG 146           H        ARG 146  -5.868 -19.058  12.474
 1196    HA   ARG 146           HA       ARG 146  -3.512 -20.372  13.386
 1197    HB2  ARG 146           HB2      ARG 146  -4.265 -18.796  10.892
 1198    HB3  ARG 146           HB3      ARG 146  -2.564 -19.069  11.241
 1199    HG2  ARG 146           HG2      ARG 146  -3.038 -20.858   9.913
 1200    HG3  ARG 146           HG3      ARG 146  -3.122 -21.532  11.539
 1201    HD2  ARG 146           HD2      ARG 146  -5.646 -21.324  11.385
 1202    HD3  ARG 146           HD3      ARG 146  -5.441 -20.859   9.689
 1203    HE   ARG 146           HE       ARG 146  -4.637 -23.459  10.957
 1204   HH11  ARG 146          HH21      ARG 146  -5.970 -21.879   8.035
 1205   HH12  ARG 146          HH22      ARG 146  -5.482 -23.156   6.986
 1206   HH21  ARG 146          HH11      ARG 146  -4.197 -25.222   9.570
 1207   HH22  ARG 146          HH12      ARG 146  -4.622 -25.148   7.899
 1208    H    VAL 147           H        VAL 147  -4.155 -16.832  13.068
 1209    HA   VAL 147           HA       VAL 147  -1.641 -15.921  13.872
 1210    HB   VAL 147           HB       VAL 147  -4.422 -14.735  14.312
 1211   HG11  VAL 147          HG11      VAL 147  -3.312 -12.513  14.452
 1212   HG12  VAL 147          HG12      VAL 147  -2.938 -13.536  15.830
 1213   HG13  VAL 147          HG13      VAL 147  -1.731 -13.332  14.543
 1214   HG21  VAL 147          HG21      VAL 147  -3.776 -13.334  12.340
 1215   HG22  VAL 147          HG22      VAL 147  -2.270 -14.297  12.214
 1216   HG23  VAL 147          HG23      VAL 147  -3.828 -15.030  11.930
 1217    H    MET 148           H        MET 148  -4.090 -17.436  15.837
 1218    HA   MET 148           HA       MET 148  -2.861 -16.561  18.339
 1219    HB2  MET 148           HB2      MET 148  -5.250 -18.351  17.855
 1220    HB3  MET 148           HB3      MET 148  -4.625 -17.894  19.450
 1221    HG2  MET 148           HG2      MET 148  -5.660 -15.927  17.383
 1222    HG3  MET 148           HG3      MET 148  -6.610 -16.626  18.677
 1223    HE1  MET 148           HE1      MET 148  -4.569 -13.924  17.417
 1224    HE2  MET 148           HE2      MET 148  -4.054 -12.959  18.804
 1225    HE3  MET 148           HE3      MET 148  -3.097 -14.380  18.304
 1226    H    LYS 149           H        LYS 149  -3.640 -19.670  16.690
 1227    HA   LYS 149           HA       LYS 149  -2.216 -21.322  18.434
 1228    HB2  LYS 149           HB2      LYS 149  -3.901 -22.055  16.957
 1229    HB3  LYS 149           HB3      LYS 149  -2.979 -21.646  15.515
 1230    HG2  LYS 149           HG2      LYS 149  -2.072 -23.770  17.507
 1231    HG3  LYS 149           HG3      LYS 149  -3.207 -24.093  16.196
 1232    HD2  LYS 149           HD2      LYS 149  -1.395 -23.075  14.617
 1233    HD3  LYS 149           HD3      LYS 149  -0.271 -23.356  15.945
 1234    HE2  LYS 149           HE2      LYS 149  -2.050 -25.452  14.640
 1235    HE3  LYS 149           HE3      LYS 149  -0.353 -25.180  14.251
 1236    HZ1  LYS 149           HZ1      LYS 149  -0.577 -27.013  15.786
 1237    HZ2  LYS 149           HZ2      LYS 149   0.208 -25.810  16.551
 1238    HZ3  LYS 149           HZ3      LYS 149  -1.374 -26.117  16.886
 1239    H    GLU 150           H        GLU 150  -0.883 -19.539  15.567
 1240    HA   GLU 150           HA       GLU 150   1.525 -20.816  15.393
 1241    HB2  GLU 150           HB2      GLU 150   0.467 -19.077  13.845
 1242    HB3  GLU 150           HB3      GLU 150   0.943 -17.857  15.009
 1243    HG2  GLU 150           HG2      GLU 150   2.714 -17.854  13.547
 1244    HG3  GLU 150           HG3      GLU 150   3.321 -18.911  14.801
 1245    H    PHE 151           H        PHE 151   0.492 -18.282  17.667
 1246    HA   PHE 151           HA       PHE 151   3.188 -18.315  18.971
 1247    HB2  PHE 151           HB2      PHE 151   1.114 -16.182  19.377
 1248    HB3  PHE 151           HB3      PHE 151   2.866 -16.154  19.620
 1249    HD1  PHE 151           HD1      PHE 151   4.056 -17.052  17.108
 1250    HD2  PHE 151           HD2      PHE 151   0.601 -14.514  17.765
 1251    HE1  PHE 151           HE1      PHE 151   4.160 -16.272  14.820
 1252    HE2  PHE 151           HE2      PHE 151   0.836 -13.626  15.497
 1253    HZ   PHE 151           HZ       PHE 151   2.602 -14.516  14.002
 1254    H    ALA 152           H        ALA 152   0.001 -19.453  19.467
 1255    HA   ALA 152           HA       ALA 152  -0.583 -18.923  22.101
 1256    HB1  ALA 152           HB1      ALA 152  -1.936 -21.041  21.984
 1257    HB2  ALA 152           HB2      ALA 152  -2.142 -20.044  20.534
 1258    HB3  ALA 152           HB3      ALA 152  -1.094 -21.475  20.487
 1259    H    SER 153           H        SER 153   1.526 -21.459  20.804
 1260    HA   SER 153           HA       SER 153   1.910 -22.857  23.257
 1261    HB2  SER 153           HB2      SER 153   3.762 -22.726  20.846
 1262    HB3  SER 153           HB3      SER 153   3.641 -24.048  22.025
 1263    HG   SER 153           HG       SER 153   1.605 -24.554  21.206
 1264    H    VAL 154           H        VAL 154   3.464 -19.995  21.821
 1265    HA   VAL 154           HA       VAL 154   5.631 -19.952  23.792
 1266    HB   VAL 154           HB       VAL 154   4.592 -17.736  21.984
 1267   HG11  VAL 154          HG11      VAL 154   7.184 -17.949  23.581
 1268   HG12  VAL 154          HG12      VAL 154   6.740 -16.644  22.464
 1269   HG13  VAL 154          HG13      VAL 154   5.829 -16.867  23.978
 1270   HG21  VAL 154          HG21      VAL 154   6.917 -19.688  21.640
 1271   HG22  VAL 154          HG22      VAL 154   5.478 -19.560  20.603
 1272   HG23  VAL 154          HG23      VAL 154   6.663 -18.254  20.636
 1273    H    VAL 155           H        VAL 155   2.412 -18.416  23.311
 1274    HA   VAL 155           HA       VAL 155   2.608 -16.770  25.580
 1275    HB   VAL 155           HB       VAL 155   0.060 -17.919  24.389
 1276   HG11  VAL 155          HG11      VAL 155   0.651 -15.682  26.395
 1277   HG12  VAL 155          HG12      VAL 155  -0.901 -15.800  25.492
 1278   HG13  VAL 155          HG13      VAL 155  -0.417 -17.085  26.611
 1279   HG21  VAL 155          HG21      VAL 155   1.399 -16.565  22.781
 1280   HG22  VAL 155          HG22      VAL 155  -0.090 -15.749  23.246
 1281   HG23  VAL 155          HG23      VAL 155   1.470 -15.245  23.959
 1282    H    MET 156           H        MET 156   1.216 -20.187  25.482
 1283    HA   MET 156           HA       MET 156   0.528 -20.147  28.167
 1284    HB2  MET 156           HB2      MET 156   1.459 -22.372  26.312
 1285    HB3  MET 156           HB3      MET 156   0.968 -22.713  27.974
 1286    HG2  MET 156           HG2      MET 156  -1.227 -22.494  27.531
 1287    HG3  MET 156           HG3      MET 156  -0.980 -20.924  26.797
 1288    HE1  MET 156           HE1      MET 156  -2.998 -21.750  23.875
 1289    HE2  MET 156           HE2      MET 156  -3.238 -21.541  25.619
 1290    HE3  MET 156           HE3      MET 156  -2.134 -20.455  24.748
 1291    H    SER 157           H        SER 157   3.678 -20.926  26.696
 1292    HA   SER 157           HA       SER 157   4.881 -21.574  29.195
 1293    HB2  SER 157           HB2      SER 157   5.435 -22.329  26.844
 1294    HB3  SER 157           HB3      SER 157   6.239 -20.767  26.593
 1295    HG   SER 157           HG       SER 157   7.687 -22.469  27.298
 1296    H    LEU 158           H        LEU 158   4.535 -18.572  27.382
 1297    HA   LEU 158           HA       LEU 158   6.252 -16.892  28.875
 1298    HB2  LEU 158           HB2      LEU 158   5.133 -16.428  26.607
 1299    HB3  LEU 158           HB3      LEU 158   3.593 -16.306  27.456
 1300    HG   LEU 158           HG       LEU 158   4.537 -14.360  28.769
 1301   HD11  LEU 158          HD11      LEU 158   6.905 -14.704  28.280
 1302   HD12  LEU 158          HD12      LEU 158   6.615 -14.552  26.540
 1303   HD13  LEU 158          HD13      LEU 158   6.382 -13.149  27.621
 1304   HD21  LEU 158          HD21      LEU 158   4.058 -12.909  26.634
 1305   HD22  LEU 158          HD22      LEU 158   3.860 -14.460  25.819
 1306   HD23  LEU 158          HD23      LEU 158   2.826 -14.075  27.221
 1307    H    GLN 159           H        GLN 159   2.831 -17.792  29.288
 1308    HA   GLN 159           HA       GLN 159   2.425 -16.255  31.694
 1309    HB2  GLN 159           HB2      GLN 159   1.045 -18.874  30.948
 1310    HB3  GLN 159           HB3      GLN 159   0.507 -17.690  32.123
 1311    HG2  GLN 159           HG2      GLN 159   0.197 -16.043  30.163
 1312    HG3  GLN 159           HG3      GLN 159   0.530 -17.386  29.100
 1313   HE21  GLN 159          HE22      GLN 159  -1.558 -16.879  32.005
 1314   HE22  GLN 159          HE21      GLN 159  -2.948 -17.715  31.317
 1315    H    GLU 160           H        GLU 160   3.466 -19.613  31.144
 1316    HA   GLU 160           HA       GLU 160   3.305 -20.384  33.856
 1317    HB2  GLU 160           HB2      GLU 160   4.692 -21.583  31.434
 1318    HB3  GLU 160           HB3      GLU 160   4.818 -22.331  33.029
 1319    HG2  GLU 160           HG2      GLU 160   2.390 -22.502  33.218
 1320    HG3  GLU 160           HG3      GLU 160   2.177 -21.725  31.659
 1321    H    ASN 161           H        ASN 161   5.920 -19.012  31.969
 1322    HA   ASN 161           HA       ASN 161   7.923 -19.579  34.102
 1323    HB2  ASN 161           HB2      ASN 161   8.175 -18.424  31.291
 1324    HB3  ASN 161           HB3      ASN 161   9.480 -18.411  32.468
 1325   HD21  ASN 161          HD22      ASN 161   7.294 -20.601  30.666
 1326   HD22  ASN 161          HD21      ASN 161   8.346 -21.998  30.740
 1327    H    THR 162           H        THR 162   5.914 -17.026  32.731
 1328    HA   THR 162           HA       THR 162   5.948 -14.803  32.836
 1329    HB   THR 162           HB       THR 162   4.562 -15.412  34.635
 1330    HG1  THR 162           HG1      THR 162   4.615 -13.481  35.793
 1331   HG21  THR 162          HG21      THR 162   6.946 -15.360  36.493
 1332   HG22  THR 162          HG22      THR 162   5.238 -15.377  37.004
 1333   HG23  THR 162          HG23      THR 162   5.889 -16.736  36.090
 1334    HA   PRO 163           HA       PRO 163  10.480 -15.195  33.091
 1335    HB2  PRO 163           HB2      PRO 163  11.227 -14.724  30.509
 1336    HB3  PRO 163           HB3      PRO 163  10.486 -16.258  31.049
 1337    HG2  PRO 163           HG2      PRO 163   9.098 -13.881  29.765
 1338    HG3  PRO 163           HG3      PRO 163   8.980 -15.620  29.314
 1339    HD2  PRO 163           HD2      PRO 163   7.187 -14.337  30.959
 1340    HD3  PRO 163           HD3      PRO 163   7.576 -16.081  31.101
 1341    H    LYS 164           H        LYS 164  12.310 -13.555  32.164
 1342    HA   LYS 164           HA       LYS 164  11.520 -10.933  33.207
 1343    HB2  LYS 164           HB2      LYS 164  14.267 -11.759  32.208
 1344    HB3  LYS 164           HB3      LYS 164  13.872 -10.457  33.326
 1345    HG2  LYS 164           HG2      LYS 164  13.707 -13.450  33.879
 1346    HG3  LYS 164           HG3      LYS 164  14.903 -12.328  34.516
 1347    HD2  LYS 164           HD2      LYS 164  13.298 -11.229  35.918
 1348    HD3  LYS 164           HD3      LYS 164  11.926 -12.051  35.140
 1349    HE2  LYS 164           HE2      LYS 164  12.691 -14.226  35.928
 1350    HE3  LYS 164           HE3      LYS 164  14.136 -13.497  36.654
 1351    HZ1  LYS 164           HZ1      LYS 164  12.687 -12.282  38.180
 1352    HZ2  LYS 164           HZ2      LYS 164  11.347 -12.945  37.509
 1353    HZ3  LYS 164           HZ3      LYS 164  12.416 -13.882  38.308
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1  -0.047   0.390  -1.590
    2    H2   MET   1           H2       MET   1   0.581   1.894  -1.397
    3    H3   MET   1           H3       MET   1  -0.196   1.512  -2.779
    4    HA   MET   1           HA       MET   1   2.165   1.592  -3.132
    5    HB2  MET   1           HB2      MET   1   2.803   0.913  -0.774
    6    HB3  MET   1           HB3      MET   1   2.444  -0.755  -1.200
    7    HG2  MET   1           HG2      MET   1   4.113  -0.416  -3.183
    8    HG3  MET   1           HG3      MET   1   4.583   1.061  -2.346
    9    HE1  MET   1           HE1      MET   1   4.102  -2.836  -1.958
   10    HE2  MET   1           HE2      MET   1   5.505  -2.452  -2.990
   11    HE3  MET   1           HE3      MET   1   5.764  -3.233  -1.414
   12    H    ILE   2           H        ILE   2   1.140  -1.822  -2.485
   13    HA   ILE   2           HA       ILE   2   0.867  -3.613  -3.761
   14    HB   ILE   2           HB       ILE   2   0.366  -1.877  -6.161
   15   HG12  ILE   2          HG12      ILE   2  -1.207  -2.333  -3.779
   16   HG13  ILE   2          HG13      ILE   2  -1.568  -1.353  -5.205
   17   HG21  ILE   2          HG21      ILE   2  -0.685  -3.847  -7.117
   18   HG22  ILE   2          HG22      ILE   2   1.002  -4.186  -6.766
   19   HG23  ILE   2          HG23      ILE   2  -0.268  -4.806  -5.675
   20   HD11  ILE   2          HD11      ILE   2  -2.663  -3.365  -6.221
   21   HD12  ILE   2          HD12      ILE   2  -2.296  -4.241  -4.692
   22   HD13  ILE   2          HD13      ILE   2  -3.367  -2.817  -4.707
   23    H    ASP   3           H        ASP   3   2.309  -5.065  -4.504
   24    HA   ASP   3           HA       ASP   3   5.023  -4.264  -4.748
   25    HB2  ASP   3           HB2      ASP   3   4.388  -6.423  -3.791
   26    HB3  ASP   3           HB3      ASP   3   3.712  -6.912  -5.354
   27    H    ASP   4           H        ASP   4   3.089  -6.123  -7.092
   28    HA   ASP   4           HA       ASP   4   3.566  -4.301  -9.239
   29    HB2  ASP   4           HB2      ASP   4   5.760  -5.409  -9.272
   30    HB3  ASP   4           HB3      ASP   4   4.976  -6.985  -9.258
   31    H    ASP   5           H        ASP   5   2.841  -7.715  -8.552
   32    HA   ASP   5           HA       ASP   5   1.065  -7.865 -10.831
   33    HB2  ASP   5           HB2      ASP   5   2.860  -9.531 -10.377
   34    HB3  ASP   5           HB3      ASP   5   1.942 -10.083  -8.978
   35    H    GLY   6           H        GLY   6   0.284  -6.486  -8.249
   36    HA2  GLY   6           HA2      GLY   6  -1.873  -6.004  -7.478
   37    HA3  GLY   6           HA3      GLY   6  -2.480  -7.526  -8.124
   38    H    TYR   7           H        TYR   7   0.390  -7.930  -6.270
   39    HA   TYR   7           HA       TYR   7  -1.152  -8.632  -3.814
   40    HB2  TYR   7           HB2      TYR   7   1.638  -9.515  -4.658
   41    HB3  TYR   7           HB3      TYR   7   0.800  -9.974  -3.174
   42    HD1  TYR   7           HD1      TYR   7  -1.145 -11.504  -3.219
   43    HD2  TYR   7           HD2      TYR   7   1.035 -10.535  -6.808
   44    HE1  TYR   7           HE1      TYR   7  -2.294 -13.349  -4.417
   45    HE2  TYR   7           HE2      TYR   7  -0.078 -12.377  -8.003
   46    HH   TYR   7           HH       TYR   7  -1.648 -14.113  -7.881
   47    H    ARG   8           H        ARG   8  -0.195  -7.815  -1.767
   48    HA   ARG   8           HA       ARG   8   1.804  -5.666  -2.130
   49    HB2  ARG   8           HB2      ARG   8   0.508  -4.072  -0.760
   50    HB3  ARG   8           HB3      ARG   8  -0.248  -4.428  -2.308
   51    HG2  ARG   8           HG2      ARG   8  -1.218  -6.048   0.027
   52    HG3  ARG   8           HG3      ARG   8  -1.623  -4.335  -0.009
   53    HD2  ARG   8           HD2      ARG   8  -2.600  -4.550  -2.253
   54    HD3  ARG   8           HD3      ARG   8  -2.140  -6.240  -2.329
   55    HE   ARG   8           HE       ARG   8  -3.830  -6.876  -0.925
   56   HH11  ARG   8          HH11      ARG   8  -3.807  -3.288  -1.027
   57   HH12  ARG   8          HH12      ARG   8  -5.283  -3.143  -0.153
   58   HH21  ARG   8          HH21      ARG   8  -5.673  -6.626   0.398
   59   HH22  ARG   8          HH22      ARG   8  -6.407  -5.068   0.617
   60    HA   PRO   9           HA       PRO   9   3.164  -7.808   1.514
   61    HB2  PRO   9           HB2      PRO   9   5.065  -5.546   1.930
   62    HB3  PRO   9           HB3      PRO   9   5.416  -7.298   1.753
   63    HG2  PRO   9           HG2      PRO   9   5.971  -5.544  -0.216
   64    HG3  PRO   9           HG3      PRO   9   5.189  -7.117  -0.627
   65    HD2  PRO   9           HD2      PRO   9   3.842  -4.431  -0.129
   66    HD3  PRO   9           HD3      PRO   9   3.714  -5.482  -1.567
   67    H    ASN  10           H        ASN  10   2.542  -7.834   3.694
   68    HA   ASN  10           HA       ASN  10   1.621  -5.307   4.966
   69    HB2  ASN  10           HB2      ASN  10  -0.204  -6.322   3.589
   70    HB3  ASN  10           HB3      ASN  10   0.022  -7.843   4.422
   71   HD21  ASN  10          HD22      ASN  10  -1.662  -4.799   4.489
   72   HD22  ASN  10          HD21      ASN  10  -2.420  -5.052   6.041
   73    H    VAL  11           H        VAL  11   1.226  -5.622   7.335
   74    HA   VAL  11           HA       VAL  11   2.421  -8.045   8.432
   75    HB   VAL  11           HB       VAL  11   3.944  -6.905   9.934
   76   HG11  VAL  11          HG11      VAL  11   4.415  -5.902   7.181
   77   HG12  VAL  11          HG12      VAL  11   5.603  -6.048   8.492
   78   HG13  VAL  11          HG13      VAL  11   4.857  -7.502   7.800
   79   HG21  VAL  11          HG21      VAL  11   2.762  -4.819  10.369
   80   HG22  VAL  11          HG22      VAL  11   4.398  -4.515   9.800
   81   HG23  VAL  11          HG23      VAL  11   3.022  -4.282   8.685
   82    H    GLY  12           H        GLY  12   1.956  -8.265  10.791
   83    HA2  GLY  12           HA2      GLY  12  -0.174  -6.491  11.784
   84    HA3  GLY  12           HA3      GLY  12  -0.604  -8.179  11.559
   85    H    ILE  13           H        ILE  13  -0.742  -6.932  14.006
   86    HA   ILE  13           HA       ILE  13   1.670  -7.810  15.539
   87    HB   ILE  13           HB       ILE  13  -0.251  -5.478  15.822
   88   HG12  ILE  13          HG12      ILE  13   2.633  -4.846  15.907
   89   HG13  ILE  13          HG13      ILE  13   2.193  -5.661  14.402
   90   HG21  ILE  13          HG21      ILE  13   1.936  -6.319  17.754
   91   HG22  ILE  13          HG22      ILE  13   1.051  -4.766  17.782
   92   HG23  ILE  13          HG23      ILE  13   0.176  -6.263  18.061
   93   HD11  ILE  13          HD11      ILE  13   2.003  -3.269  14.139
   94   HD12  ILE  13          HD12      ILE  13   0.392  -4.004  14.016
   95   HD13  ILE  13          HD13      ILE  13   0.879  -3.164  15.513
   96    H    VAL  14           H        VAL  14   1.335  -9.022  17.328
   97    HA   VAL  14           HA       VAL  14  -1.456  -9.422  18.328
   98    HB   VAL  14           HB       VAL  14   0.803 -11.469  18.458
   99   HG11  VAL  14          HG11      VAL  14  -0.901 -11.697  20.228
  100   HG12  VAL  14          HG12      VAL  14  -2.189 -11.682  19.003
  101   HG13  VAL  14          HG13      VAL  14  -1.016 -13.028  19.081
  102   HG21  VAL  14          HG21      VAL  14  -1.486 -11.397  16.461
  103   HG22  VAL  14          HG22      VAL  14   0.256 -11.255  16.098
  104   HG23  VAL  14          HG23      VAL  14  -0.375 -12.767  16.750
  105    H    ILE  15           H        ILE  15  -1.591  -9.005  20.586
  106    HA   ILE  15           HA       ILE  15   0.986  -8.752  22.005
  107    HB   ILE  15           HB       ILE  15  -1.442  -7.129  22.830
  108   HG12  ILE  15          HG12      ILE  15  -0.654  -6.239  20.630
  109   HG13  ILE  15          HG13      ILE  15  -0.451  -5.120  21.967
  110   HG21  ILE  15          HG21      ILE  15   0.249  -5.913  24.147
  111   HG22  ILE  15          HG22      ILE  15   0.022  -7.594  24.654
  112   HG23  ILE  15          HG23      ILE  15   1.457  -7.128  23.710
  113   HD11  ILE  15          HD11      ILE  15   1.787  -6.885  20.914
  114   HD12  ILE  15          HD12      ILE  15   1.518  -5.205  20.403
  115   HD13  ILE  15          HD13      ILE  15   1.942  -5.558  22.092
  116    H    CYS  16           H        CYS  16   1.147 -10.127  23.766
  117    HA   CYS  16           HA       CYS  16  -1.443 -11.126  24.815
  118    HB2  CYS  16           HB2      CYS  16  -0.753 -13.362  25.035
  119    HB3  CYS  16           HB3      CYS  16  -0.268 -12.898  23.392
  120    HG   CYS  16           HG       CYS  16   1.450 -13.303  26.172
  121    H    ASN  17           H        ASN  17  -1.482 -11.740  27.016
  122    HA   ASN  17           HA       ASN  17   0.603 -10.402  28.687
  123    HB2  ASN  17           HB2      ASN  17  -1.061 -10.009  30.355
  124    HB3  ASN  17           HB3      ASN  17  -1.684  -9.428  28.824
  125   HD21  ASN  17          HD22      ASN  17  -3.699  -9.577  30.385
  126   HD22  ASN  17          HD21      ASN  17  -4.575 -11.089  30.306
  127    H    ARG  18           H        ARG  18   0.634 -11.696  31.018
  128    HA   ARG  18           HA       ARG  18   1.470 -14.415  30.250
  129    HB2  ARG  18           HB2      ARG  18   1.613 -12.817  32.861
  130    HB3  ARG  18           HB3      ARG  18   1.972 -14.546  32.811
  131    HG2  ARG  18           HG2      ARG  18   4.060 -13.780  32.519
  132    HG3  ARG  18           HG3      ARG  18   3.538 -14.012  30.855
  133    HD2  ARG  18           HD2      ARG  18   4.672 -12.008  30.836
  134    HD3  ARG  18           HD3      ARG  18   2.982 -11.477  30.845
  135    HE   ARG  18           HE       ARG  18   3.403 -11.312  33.427
  136   HH11  ARG  18          HH21      ARG  18   5.712 -10.307  30.856
  137   HH12  ARG  18          HH22      ARG  18   6.594  -9.247  31.926
  138   HH21  ARG  18          HH11      ARG  18   4.487  -9.761  34.722
  139   HH22  ARG  18          HH12      ARG  18   5.885  -8.949  34.114
  140    H    GLN  19           H        GLN  19  -1.538 -13.345  30.719
  141    HA   GLN  19           HA       GLN  19  -2.490 -15.742  32.131
  142    HB2  GLN  19           HB2      GLN  19  -4.219 -13.577  30.930
  143    HB3  GLN  19           HB3      GLN  19  -4.660 -14.757  32.155
  144    HG2  GLN  19           HG2      GLN  19  -2.799 -12.371  32.442
  145    HG3  GLN  19           HG3      GLN  19  -4.415 -12.514  33.093
  146   HE21  GLN  19          HE22      GLN  19  -2.021 -11.918  34.675
  147   HE22  GLN  19          HE21      GLN  19  -1.823 -13.230  35.811
  148    H    GLY  20           H        GLY  20  -1.445 -14.992  29.011
  149    HA2  GLY  20           HA2      GLY  20  -1.717 -16.099  27.025
  150    HA3  GLY  20           HA3      GLY  20  -2.810 -17.254  27.802
  151    H    GLN  21           H        GLN  21  -3.481 -13.763  28.108
  152    HA   GLN  21           HA       GLN  21  -5.790 -14.112  26.269
  153    HB2  GLN  21           HB2      GLN  21  -5.160 -11.801  28.129
  154    HB3  GLN  21           HB3      GLN  21  -6.588 -11.985  27.123
  155    HG2  GLN  21           HG2      GLN  21  -5.864 -13.839  29.435
  156    HG3  GLN  21           HG3      GLN  21  -6.999 -12.502  29.521
  157   HE21  GLN  21          HE22      GLN  21  -6.591 -15.857  28.594
  158   HE22  GLN  21          HE21      GLN  21  -8.189 -16.074  27.899
  159    H    VAL  22           H        VAL  22  -5.880 -12.846  24.406
  160    HA   VAL  22           HA       VAL  22  -3.430 -11.377  23.673
  161    HB   VAL  22           HB       VAL  22  -3.807 -11.997  21.372
  162   HG11  VAL  22          HG11      VAL  22  -3.830 -14.467  23.171
  163   HG12  VAL  22          HG12      VAL  22  -3.177 -14.340  21.510
  164   HG13  VAL  22          HG13      VAL  22  -2.427 -13.440  22.834
  165   HG21  VAL  22          HG21      VAL  22  -6.175 -13.698  22.289
  166   HG22  VAL  22          HG22      VAL  22  -6.262 -12.242  21.282
  167   HG23  VAL  22          HG23      VAL  22  -5.450 -13.688  20.673
  168    H    MET  23           H        MET  23  -3.693  -9.451  22.509
  169    HA   MET  23           HA       MET  23  -6.065  -7.862  22.992
  170    HB2  MET  23           HB2      MET  23  -3.931  -6.786  22.790
  171    HB3  MET  23           HB3      MET  23  -3.592  -7.557  21.238
  172    HG2  MET  23           HG2      MET  23  -5.332  -6.250  20.135
  173    HG3  MET  23           HG3      MET  23  -5.782  -5.491  21.665
  174    HE1  MET  23           HE1      MET  23  -3.441  -4.555  23.162
  175    HE2  MET  23           HE2      MET  23  -2.976  -3.024  22.401
  176    HE3  MET  23           HE3      MET  23  -4.699  -3.426  22.609
  177    H    TRP  24           H        TRP  24  -7.834  -7.545  21.697
  178    HA   TRP  24           HA       TRP  24  -7.866  -8.467  18.882
  179    HB2  TRP  24           HB2      TRP  24  -8.733 -10.233  20.384
  180    HB3  TRP  24           HB3      TRP  24  -9.873  -9.092  21.083
  181    HD1  TRP  24           HD1      TRP  24 -12.161  -9.754  20.382
  182    HE1  TRP  24           HE1      TRP  24 -13.317 -10.755  18.358
  183    HE3  TRP  24           HE3      TRP  24  -8.110 -10.134  17.267
  184    HZ2  TRP  24           HZ2      TRP  24 -12.559 -11.741  15.742
  185    HZ3  TRP  24           HZ3      TRP  24  -8.339 -11.208  15.054
  186    HH2  TRP  24           HH2      TRP  24 -10.581 -12.016  14.287
  187    H    ALA  25           H        ALA  25  -9.094  -6.881  17.606
  188    HA   ALA  25           HA       ALA  25 -10.212  -4.603  19.162
  189    HB1  ALA  25           HB1      ALA  25  -8.184  -4.352  16.914
  190    HB2  ALA  25           HB2      ALA  25  -8.909  -3.037  17.878
  191    HB3  ALA  25           HB3      ALA  25  -7.811  -4.179  18.645
  192    H    ARG  26           H        ARG  26 -11.580  -3.193  17.982
  193    HA   ARG  26           HA       ARG  26 -13.101  -4.535  15.785
  194    HB2  ARG  26           HB2      ARG  26 -14.072  -4.297  18.168
  195    HB3  ARG  26           HB3      ARG  26 -14.143  -2.571  17.855
  196    HG2  ARG  26           HG2      ARG  26 -15.627  -3.067  15.857
  197    HG3  ARG  26           HG3      ARG  26 -15.555  -4.788  16.306
  198    HD2  ARG  26           HD2      ARG  26 -16.395  -4.116  18.614
  199    HD3  ARG  26           HD3      ARG  26 -16.619  -2.491  17.991
  200    HE   ARG  26           HE       ARG  26 -17.944  -4.855  16.727
  201   HH11  ARG  26          HH11      ARG  26 -18.301  -1.561  18.126
  202   HH12  ARG  26          HH12      ARG  26 -20.026  -1.663  18.209
  203   HH21  ARG  26          HH21      ARG  26 -20.247  -4.941  16.853
  204   HH22  ARG  26          HH22      ARG  26 -21.149  -3.568  17.371
  205    H    ARG  27           H        ARG  27 -13.115  -3.179  13.772
  206    HA   ARG  27           HA       ARG  27 -11.331  -0.894  14.109
  207    HB2  ARG  27           HB2      ARG  27 -11.180  -2.590  12.234
  208    HB3  ARG  27           HB3      ARG  27 -12.535  -1.742  11.479
  209    HG2  ARG  27           HG2      ARG  27 -11.241   0.372  11.502
  210    HG3  ARG  27           HG3      ARG  27  -9.954  -0.429  12.423
  211    HD2  ARG  27           HD2      ARG  27  -9.668  -1.989  10.395
  212    HD3  ARG  27           HD3      ARG  27 -10.685  -0.845   9.517
  213    HE   ARG  27           HE       ARG  27  -9.027   0.795   9.664
  214   HH11  ARG  27          HH11      ARG  27  -7.835  -2.192  11.317
  215   HH12  ARG  27          HH12      ARG  27  -6.335  -1.431  11.768
  216   HH21  ARG  27          HH21      ARG  27  -7.097   1.757  10.543
  217   HH22  ARG  27          HH22      ARG  27  -5.913   0.699  11.266
  218    H    PHE  28           H        PHE  28 -11.734   1.294  13.531
  219    HA   PHE  28           HA       PHE  28 -14.139   2.244  14.652
  220    HB2  PHE  28           HB2      PHE  28 -12.013   3.457  14.597
  221    HB3  PHE  28           HB3      PHE  28 -12.153   3.659  12.853
  222    HD1  PHE  28           HD1      PHE  28 -13.746   4.494  16.145
  223    HD2  PHE  28           HD2      PHE  28 -13.380   5.527  11.970
  224    HE1  PHE  28           HE1      PHE  28 -14.959   6.615  16.563
  225    HE2  PHE  28           HE2      PHE  28 -14.577   7.658  12.399
  226    HZ   PHE  28           HZ       PHE  28 -15.380   8.201  14.688
  227    H    GLY  29           H        GLY  29 -16.104   2.597  13.827
  228    HA2  GLY  29           HA2      GLY  29 -17.793   3.020  12.317
  229    HA3  GLY  29           HA3      GLY  29 -16.626   3.020  10.990
  230    H    GLN  30           H        GLN  30 -16.078   0.147  12.729
  231    HA   GLN  30           HA       GLN  30 -17.839  -1.400  10.880
  232    HB2  GLN  30           HB2      GLN  30 -15.291  -2.371  12.211
  233    HB3  GLN  30           HB3      GLN  30 -16.207  -3.147  10.926
  234    HG2  GLN  30           HG2      GLN  30 -14.539  -0.625  10.720
  235    HG3  GLN  30           HG3      GLN  30 -14.167  -2.224  10.077
  236   HE21  GLN  30          HE22      GLN  30 -15.912  -3.125   8.426
  237   HE22  GLN  30          HE21      GLN  30 -16.559  -1.956   7.303
  238    H    HIS  31           H        HIS  31 -18.559  -3.464  11.693
  239    HA   HIS  31           HA       HIS  31 -18.978  -3.548  14.645
  240    HB2  HIS  31           HB2      HIS  31 -20.364  -5.105  12.438
  241    HB3  HIS  31           HB3      HIS  31 -20.754  -5.156  14.155
  242    HD1  HIS  31           HD1      HIS  31 -22.623  -4.003  11.584
  243    HD2  HIS  31           HD2      HIS  31 -20.695  -1.922  14.707
  244    HE1  HIS  31           HE1      HIS  31 -23.847  -1.783  11.836
  245    H    SER  32           H        SER  32 -17.297  -5.156  11.998
  246    HA   SER  32           HA       SER  32 -16.923  -7.654  13.339
  247    HB2  SER  32           HB2      SER  32 -15.430  -6.546  10.930
  248    HB3  SER  32           HB3      SER  32 -15.681  -8.251  11.362
  249    HG   SER  32           HG       SER  32 -17.162  -7.548   9.734
  250    H    TRP  33           H        TRP  33 -14.796  -8.635  13.795
  251    HA   TRP  33           HA       TRP  33 -12.958  -6.687  15.103
  252    HB2  TRP  33           HB2      TRP  33 -13.721  -9.509  15.864
  253    HB3  TRP  33           HB3      TRP  33 -12.473  -8.514  16.625
  254    HD1  TRP  33           HD1      TRP  33 -16.328  -8.380  16.138
  255    HE1  TRP  33           HE1      TRP  33 -17.347  -7.261  18.183
  256    HE3  TRP  33           HE3      TRP  33 -12.021  -7.245  18.621
  257    HZ2  TRP  33           HZ2      TRP  33 -16.391  -5.902  20.586
  258    HZ3  TRP  33           HZ3      TRP  33 -12.090  -6.034  20.772
  259    HH2  TRP  33           HH2      TRP  33 -14.263  -5.332  21.759
  260    H    GLN  34           H        GLN  34 -10.721  -7.238  15.245
  261    HA   GLN  34           HA       GLN  34  -9.532  -9.140  13.408
  262    HB2  GLN  34           HB2      GLN  34  -8.410  -7.294  12.074
  263    HB3  GLN  34           HB3      GLN  34 -10.130  -7.472  11.780
  264    HG2  GLN  34           HG2      GLN  34 -10.611  -5.493  13.190
  265    HG3  GLN  34           HG3      GLN  34  -8.900  -5.354  13.605
  266   HE21  GLN  34          HE22      GLN  34 -10.915  -5.636  10.557
  267   HE22  GLN  34          HE21      GLN  34 -10.033  -4.403   9.700
  268    H    PHE  35           H        PHE  35  -7.130  -8.952  13.445
  269    HA   PHE  35           HA       PHE  35  -6.102  -7.972  16.045
  270    HB2  PHE  35           HB2      PHE  35  -4.788  -9.467  13.759
  271    HB3  PHE  35           HB3      PHE  35  -3.976  -8.992  15.252
  272    HD1  PHE  35           HD1      PHE  35  -5.431  -9.790  17.462
  273    HD2  PHE  35           HD2      PHE  35  -5.165 -11.782  13.626
  274    HE1  PHE  35           HE1      PHE  35  -6.056 -11.932  18.532
  275    HE2  PHE  35           HE2      PHE  35  -5.779 -13.915  14.727
  276    HZ   PHE  35           HZ       PHE  35  -6.263 -13.997  17.155
  277    HA   PRO  36           HA       PRO  36  -4.815  -4.127  14.127
  278    HB2  PRO  36           HB2      PRO  36  -2.223  -4.426  15.652
  279    HB3  PRO  36           HB3      PRO  36  -3.303  -3.016  15.561
  280    HG2  PRO  36           HG2      PRO  36  -3.305  -4.607  17.756
  281    HG3  PRO  36           HG3      PRO  36  -4.860  -4.014  17.081
  282    HD2  PRO  36           HD2      PRO  36  -3.550  -6.722  16.703
  283    HD3  PRO  36           HD3      PRO  36  -5.257  -6.318  17.053
  284    H    GLN  37           H        GLN  37  -3.852  -3.653  12.099
  285    HA   GLN  37           HA       GLN  37  -1.407  -4.982  11.287
  286    HB2  GLN  37           HB2      GLN  37  -2.357  -6.390   9.528
  287    HB3  GLN  37           HB3      GLN  37  -3.051  -6.843  11.075
  288    HG2  GLN  37           HG2      GLN  37  -5.024  -5.238  10.414
  289    HG3  GLN  37           HG3      GLN  37  -4.332  -5.318   8.793
  290   HE21  GLN  37          HE22      GLN  37  -5.897  -7.168  11.406
  291   HE22  GLN  37          HE21      GLN  37  -6.411  -8.516  10.393
  292    H    GLY  38           H        GLY  38  -0.754  -4.447   9.047
  293    HA2  GLY  38           HA2      GLY  38  -2.169  -2.533   7.458
  294    HA3  GLY  38           HA3      GLY  38  -1.019  -1.684   8.477
  295    H    GLY  39           H        GLY  39  -0.551  -1.326   5.861
  296    HA2  GLY  39           HA2      GLY  39   0.905  -3.446   4.591
  297    HA3  GLY  39           HA3      GLY  39   0.561  -1.838   3.963
  298    H    ILE  40           H        ILE  40   2.973  -3.319   3.883
  299    HA   ILE  40           HA       ILE  40   4.958  -1.805   5.469
  300    HB   ILE  40           HB       ILE  40   5.355  -3.731   3.144
  301   HG12  ILE  40          HG12      ILE  40   5.389  -4.333   6.123
  302   HG13  ILE  40          HG13      ILE  40   4.136  -4.861   5.005
  303   HG21  ILE  40          HG21      ILE  40   7.353  -2.300   3.727
  304   HG22  ILE  40          HG22      ILE  40   7.334  -3.026   5.350
  305   HG23  ILE  40          HG23      ILE  40   7.633  -4.028   3.927
  306   HD11  ILE  40          HD11      ILE  40   5.352  -6.759   5.171
  307   HD12  ILE  40          HD12      ILE  40   6.074  -6.034   3.731
  308   HD13  ILE  40          HD13      ILE  40   6.919  -5.917   5.285
  309    H    ASN  41           H        ASN  41   5.835   0.106   4.703
  310    HA   ASN  41           HA       ASN  41   4.822   1.215   2.170
  311    HB2  ASN  41           HB2      ASN  41   6.671   2.312   4.324
  312    HB3  ASN  41           HB3      ASN  41   6.318   3.182   2.855
  313   HD21  ASN  41          HD22      ASN  41   4.854   1.772   5.768
  314   HD22  ASN  41          HD21      ASN  41   3.321   2.645   5.654
  315    HA   PRO  42           HA       PRO  42   8.044  -0.264  -0.342
  316    HB2  PRO  42           HB2      PRO  42   8.930   1.870  -1.901
  317    HB3  PRO  42           HB3      PRO  42   7.412   0.961  -2.166
  318    HG2  PRO  42           HG2      PRO  42   7.793   3.587  -0.716
  319    HG3  PRO  42           HG3      PRO  42   6.524   3.148  -1.904
  320    HD2  PRO  42           HD2      PRO  42   6.060   3.112   0.762
  321    HD3  PRO  42           HD3      PRO  42   5.345   1.868  -0.293
  322    H    GLY  43           H        GLY  43  10.042  -0.827   0.435
  323    HA2  GLY  43           HA2      GLY  43  12.278  -0.561   1.006
  324    HA3  GLY  43           HA3      GLY  43  12.052   1.179   1.196
  325    H    GLU  44           H        GLU  44   9.525  -0.042   3.040
  326    HA   GLU  44           HA       GLU  44  10.989   0.111   5.538
  327    HB2  GLU  44           HB2      GLU  44   8.198   0.084   4.683
  328    HB3  GLU  44           HB3      GLU  44   8.444  -1.110   5.952
  329    HG2  GLU  44           HG2      GLU  44   9.077   0.456   7.518
  330    HG3  GLU  44           HG3      GLU  44   9.525   1.661   6.288
  331    H    SER  45           H        SER  45  11.037  -1.725   7.094
  332    HA   SER  45           HA       SER  45  11.307  -4.371   5.743
  333    HB2  SER  45           HB2      SER  45  12.430  -5.102   7.777
  334    HB3  SER  45           HB3      SER  45  13.259  -3.694   7.085
  335    HG   SER  45           HG       SER  45  12.823  -3.686   9.444
  336    H    ALA  46           H        ALA  46  10.228  -6.174   7.046
  337    HA   ALA  46           HA       ALA  46   7.523  -5.559   7.578
  338    HB1  ALA  46           HB1      ALA  46   9.232  -7.900   8.526
  339    HB2  ALA  46           HB2      ALA  46   7.447  -7.872   8.489
  340    HB3  ALA  46           HB3      ALA  46   8.361  -7.796   6.969
  341    H    GLU  47           H        GLU  47  10.349  -5.750   9.725
  342    HA   GLU  47           HA       GLU  47   8.849  -5.564  12.160
  343    HB2  GLU  47           HB2      GLU  47  11.039  -6.613  11.865
  344    HB3  GLU  47           HB3      GLU  47  11.780  -5.023  11.564
  345    HG2  GLU  47           HG2      GLU  47  11.030  -4.300  13.851
  346    HG3  GLU  47           HG3      GLU  47  10.380  -5.920  14.116
  347    H    GLN  48           H        GLN  48  10.407  -3.101  10.029
  348    HA   GLN  48           HA       GLN  48   9.796  -0.906  11.859
  349    HB2  GLN  48           HB2      GLN  48  10.446  -0.993   8.892
  350    HB3  GLN  48           HB3      GLN  48  10.153   0.510   9.786
  351    HG2  GLN  48           HG2      GLN  48  12.003   0.070  11.299
  352    HG3  GLN  48           HG3      GLN  48  12.254  -1.530  10.583
  353   HE21  GLN  48          HE22      GLN  48  12.924  -1.667   8.360
  354   HE22  GLN  48          HE21      GLN  48  13.851  -0.367   7.606
  355    H    ALA  49           H        ALA  49   8.066  -2.499   9.129
  356    HA   ALA  49           HA       ALA  49   5.875  -0.643   9.086
  357    HB1  ALA  49           HB1      ALA  49   6.381  -2.242   7.290
  358    HB2  ALA  49           HB2      ALA  49   5.955  -3.610   8.371
  359    HB3  ALA  49           HB3      ALA  49   4.716  -2.438   7.889
  360    H    MET  50           H        MET  50   6.655  -3.569  11.005
  361    HA   MET  50           HA       MET  50   4.170  -3.751  12.359
  362    HB2  MET  50           HB2      MET  50   5.707  -5.592  12.268
  363    HB3  MET  50           HB3      MET  50   6.982  -4.691  13.051
  364    HG2  MET  50           HG2      MET  50   4.338  -5.340  14.355
  365    HG3  MET  50           HG3      MET  50   5.766  -6.356  14.452
  366    HE1  MET  50           HE1      MET  50   8.260  -4.256  14.982
  367    HE2  MET  50           HE2      MET  50   8.236  -4.715  16.695
  368    HE3  MET  50           HE3      MET  50   7.892  -5.934  15.456
  369    H    TYR  51           H        TYR  51   7.276  -2.103  13.461
  370    HA   TYR  51           HA       TYR  51   5.902  -1.068  15.736
  371    HB2  TYR  51           HB2      TYR  51   8.422  -0.051  14.380
  372    HB3  TYR  51           HB3      TYR  51   7.789   0.558  15.908
  373    HD1  TYR  51           HD1      TYR  51   7.117  -1.436  17.669
  374    HD2  TYR  51           HD2      TYR  51  10.260  -1.496  14.709
  375    HE1  TYR  51           HE1      TYR  51   8.473  -2.905  19.129
  376    HE2  TYR  51           HE2      TYR  51  11.615  -2.936  16.167
  377    HH   TYR  51           HH       TYR  51  11.772  -4.023  18.256
  378    H    ARG  52           H        ARG  52   6.105   0.250  12.384
  379    HA   ARG  52           HA       ARG  52   4.960   2.802  12.989
  380    HB2  ARG  52           HB2      ARG  52   5.910   2.398  10.808
  381    HB3  ARG  52           HB3      ARG  52   4.930   0.947  10.581
  382    HG2  ARG  52           HG2      ARG  52   2.854   2.420  10.582
  383    HG3  ARG  52           HG3      ARG  52   3.935   3.819  10.572
  384    HD2  ARG  52           HD2      ARG  52   4.137   1.533   8.574
  385    HD3  ARG  52           HD3      ARG  52   2.961   2.848   8.348
  386    HE   ARG  52           HE       ARG  52   5.798   2.899   7.852
  387   HH11  ARG  52          HH11      ARG  52   3.070   5.067   8.769
  388   HH12  ARG  52          HH12      ARG  52   3.829   6.451   8.058
  389   HH21  ARG  52          HH21      ARG  52   6.735   4.599   7.026
  390   HH22  ARG  52          HH22      ARG  52   6.029   6.207   7.018
  391    H    GLU  53           H        GLU  53   3.427  -0.376  12.051
  392    HA   GLU  53           HA       GLU  53   0.836   0.772  12.240
  393    HB2  GLU  53           HB2      GLU  53   1.757  -2.098  12.053
  394    HB3  GLU  53           HB3      GLU  53   0.053  -1.626  12.091
  395    HG2  GLU  53           HG2      GLU  53   2.110  -0.609  10.105
  396    HG3  GLU  53           HG3      GLU  53   0.928  -1.876   9.771
  397    H    LEU  54           H        LEU  54   2.920  -0.824  14.623
  398    HA   LEU  54           HA       LEU  54   1.005  -1.198  16.671
  399    HB2  LEU  54           HB2      LEU  54   3.397  -1.983  16.596
  400    HB3  LEU  54           HB3      LEU  54   3.909  -0.313  16.883
  401    HG   LEU  54           HG       LEU  54   2.442  -0.466  19.043
  402   HD11  LEU  54          HD11      LEU  54   1.276  -2.560  18.530
  403   HD12  LEU  54          HD12      LEU  54   2.823  -3.412  18.300
  404   HD13  LEU  54          HD13      LEU  54   2.348  -2.844  19.914
  405   HD21  LEU  54          HD21      LEU  54   4.990  -2.114  18.763
  406   HD22  LEU  54          HD22      LEU  54   4.914  -0.347  19.005
  407   HD23  LEU  54          HD23      LEU  54   4.338  -1.428  20.277
  408    H    PHE  55           H        PHE  55   2.908   1.745  15.724
  409    HA   PHE  55           HA       PHE  55   1.608   3.384  17.717
  410    HB2  PHE  55           HB2      PHE  55   3.817   3.921  16.763
  411    HB3  PHE  55           HB3      PHE  55   3.088   4.182  15.186
  412    HD1  PHE  55           HD1      PHE  55   3.030   5.368  18.744
  413    HD2  PHE  55           HD2      PHE  55   2.132   6.312  14.628
  414    HE1  PHE  55           HE1      PHE  55   2.554   7.725  19.381
  415    HE2  PHE  55           HE2      PHE  55   1.661   8.660  15.271
  416    HZ   PHE  55           HZ       PHE  55   1.867   9.368  17.647
  417    H    GLU  56           H        GLU  56   1.045   2.982  14.132
  418    HA   GLU  56           HA       GLU  56  -0.987   4.901  14.125
  419    HB2  GLU  56           HB2      GLU  56  -0.414   2.666  12.150
  420    HB3  GLU  56           HB3      GLU  56  -1.639   3.922  11.917
  421    HG2  GLU  56           HG2      GLU  56   0.218   5.653  12.272
  422    HG3  GLU  56           HG3      GLU  56   1.375   4.325  12.193
  423    H    GLU  57           H        GLU  57  -1.238   1.446  14.888
  424    HA   GLU  57           HA       GLU  57  -4.180   1.507  14.772
  425    HB2  GLU  57           HB2      GLU  57  -2.239  -0.710  15.555
  426    HB3  GLU  57           HB3      GLU  57  -3.961  -0.875  15.338
  427    HG2  GLU  57           HG2      GLU  57  -2.177  -0.056  13.031
  428    HG3  GLU  57           HG3      GLU  57  -2.456  -1.739  13.481
  429    H    VAL  58           H        VAL  58  -1.593   0.842  17.201
  430    HA   VAL  58           HA       VAL  58  -3.618   0.639  19.330
  431    HB   VAL  58           HB       VAL  58  -0.635   0.131  19.593
  432   HG11  VAL  58          HG11      VAL  58  -1.927   0.061  21.627
  433   HG12  VAL  58          HG12      VAL  58  -3.027  -1.158  20.910
  434   HG13  VAL  58          HG13      VAL  58  -1.314  -1.541  21.212
  435   HG21  VAL  58          HG21      VAL  58  -1.135  -1.096  17.608
  436   HG22  VAL  58          HG22      VAL  58  -1.050  -2.250  18.949
  437   HG23  VAL  58          HG23      VAL  58  -2.641  -1.760  18.316
  438    H    GLY  59           H        GLY  59  -0.940   2.632  18.290
  439    HA2  GLY  59           HA2      GLY  59  -0.322   4.805  18.963
  440    HA3  GLY  59           HA3      GLY  59  -1.482   4.736  20.293
  441    H    LEU  60           H        LEU  60   0.199   1.861  20.344
  442    HA   LEU  60           HA       LEU  60   1.953   2.560  22.542
  443    HB2  LEU  60           HB2      LEU  60   0.481   0.573  22.384
  444    HB3  LEU  60           HB3      LEU  60   1.330   0.059  20.926
  445    HG   LEU  60           HG       LEU  60   3.386  -0.384  22.263
  446   HD11  LEU  60          HD11      LEU  60   3.212  -0.414  24.697
  447   HD12  LEU  60          HD12      LEU  60   3.104   1.243  24.079
  448   HD13  LEU  60          HD13      LEU  60   1.633   0.404  24.610
  449   HD21  LEU  60          HD21      LEU  60   2.300  -2.333  23.414
  450   HD22  LEU  60          HD22      LEU  60   0.714  -1.519  23.318
  451   HD23  LEU  60          HD23      LEU  60   1.519  -2.058  21.841
  452    H    SER  61           H        SER  61   4.271   2.119  22.411
  453    HA   SER  61           HA       SER  61   5.432   2.376  19.673
  454    HB2  SER  61           HB2      SER  61   6.159   4.017  22.140
  455    HB3  SER  61           HB3      SER  61   6.854   4.178  20.517
  456    HG   SER  61           HG       SER  61   5.199   5.735  20.940
  457    H    ARG  62           H        ARG  62   7.748   1.940  19.644
  458    HA   ARG  62           HA       ARG  62   8.665  -0.491  20.248
  459    HB2  ARG  62           HB2      ARG  62  10.066   2.173  19.972
  460    HB3  ARG  62           HB3      ARG  62  11.020   0.761  20.453
  461    HG2  ARG  62           HG2      ARG  62  10.254  -0.517  18.580
  462    HG3  ARG  62           HG3      ARG  62   9.149   0.772  18.071
  463    HD2  ARG  62           HD2      ARG  62  11.067   0.701  16.649
  464    HD3  ARG  62           HD3      ARG  62  11.074   2.208  17.612
  465    HE   ARG  62           HE       ARG  62  12.620   0.060  18.821
  466   HH11  ARG  62          HH11      ARG  62  12.838   2.536  16.272
  467   HH12  ARG  62          HH12      ARG  62  14.560   2.641  16.331
  468   HH21  ARG  62          HH21      ARG  62  14.911   0.218  18.911
  469   HH22  ARG  62          HH22      ARG  62  15.760   1.284  17.854
  470    H    LYS  63           H        LYS  63   8.901   2.304  22.428
  471    HA   LYS  63           HA       LYS  63  10.723   1.204  24.265
  472    HB2  LYS  63           HB2      LYS  63   8.569   3.268  24.938
  473    HB3  LYS  63           HB3      LYS  63  10.170   3.092  25.674
  474    HG2  LYS  63           HG2      LYS  63   9.528   4.150  22.909
  475    HG3  LYS  63           HG3      LYS  63  10.129   5.066  24.290
  476    HD2  LYS  63           HD2      LYS  63  11.614   2.735  23.062
  477    HD3  LYS  63           HD3      LYS  63  11.823   4.402  22.496
  478    HE2  LYS  63           HE2      LYS  63  12.502   5.089  24.816
  479    HE3  LYS  63           HE3      LYS  63  12.394   3.400  25.334
  480    HZ1  LYS  63           HZ1      LYS  63  14.171   2.876  23.741
  481    HZ2  LYS  63           HZ2      LYS  63  14.260   4.446  23.268
  482    HZ3  LYS  63           HZ3      LYS  63  14.669   4.029  24.786
  483    H    ASP  64           H        ASP  64   7.240   0.741  24.059
  484    HA   ASP  64           HA       ASP  64   7.369  -0.580  26.741
  485    HB2  ASP  64           HB2      ASP  64   6.007   1.545  26.525
  486    HB3  ASP  64           HB3      ASP  64   4.840   0.581  25.644
  487    H    VAL  65           H        VAL  65   7.913  -1.712  23.996
  488    HA   VAL  65           HA       VAL  65   6.371  -4.194  24.542
  489    HB   VAL  65           HB       VAL  65   6.235  -4.562  22.065
  490   HG11  VAL  65          HG11      VAL  65   4.194  -3.271  21.780
  491   HG12  VAL  65          HG12      VAL  65   4.292  -3.881  23.441
  492   HG13  VAL  65          HG13      VAL  65   4.663  -2.183  23.108
  493   HG21  VAL  65          HG21      VAL  65   7.941  -2.815  21.423
  494   HG22  VAL  65          HG22      VAL  65   6.434  -2.707  20.511
  495   HG23  VAL  65          HG23      VAL  65   6.744  -1.573  21.827
  496    H    ARG  66           H        ARG  66   7.315  -6.131  23.567
  497    HA   ARG  66           HA       ARG  66  10.095  -5.898  22.615
  498    HB2  ARG  66           HB2      ARG  66  10.913  -7.708  23.953
  499    HB3  ARG  66           HB3      ARG  66  10.406  -6.360  24.956
  500    HG2  ARG  66           HG2      ARG  66   8.494  -8.695  24.585
  501    HG3  ARG  66           HG3      ARG  66   9.909  -8.902  25.588
  502    HD2  ARG  66           HD2      ARG  66   7.904  -6.666  26.049
  503    HD3  ARG  66           HD3      ARG  66   7.850  -8.254  26.827
  504    HE   ARG  66           HE       ARG  66  10.367  -6.709  27.063
  505   HH11  ARG  66          HH11      ARG  66   7.405  -7.814  28.761
  506   HH12  ARG  66          HH12      ARG  66   8.089  -7.526  30.336
  507   HH21  ARG  66          HH21      ARG  66  11.128  -6.200  29.187
  508   HH22  ARG  66          HH22      ARG  66  10.067  -6.455  30.555
  509    H    ILE  67           H        ILE  67  10.297  -7.168  20.714
  510    HA   ILE  67           HA       ILE  67   8.080  -8.767  19.827
  511    HB   ILE  67           HB       ILE  67  10.936  -8.751  18.771
  512   HG12  ILE  67          HG12      ILE  67   8.661  -6.969  17.813
  513   HG13  ILE  67          HG13      ILE  67  10.005  -6.423  18.808
  514   HG21  ILE  67          HG21      ILE  67   8.284  -9.473  17.411
  515   HG22  ILE  67          HG22      ILE  67   9.903  -9.574  16.685
  516   HG23  ILE  67          HG23      ILE  67   9.484 -10.640  18.007
  517   HD11  ILE  67          HD11      ILE  67  10.204  -7.476  15.970
  518   HD12  ILE  67          HD12      ILE  67  10.502  -5.836  16.552
  519   HD13  ILE  67          HD13      ILE  67  11.599  -7.140  17.028
  520    H    LEU  68           H        LEU  68   7.616 -10.632  20.711
  521    HA   LEU  68           HA       LEU  68   9.738 -12.334  21.937
  522    HB2  LEU  68           HB2      LEU  68   6.719 -12.656  21.804
  523    HB3  LEU  68           HB3      LEU  68   7.851 -13.659  22.705
  524    HG   LEU  68           HG       LEU  68   7.248 -10.723  23.326
  525   HD11  LEU  68          HD11      LEU  68   6.337 -13.410  24.394
  526   HD12  LEU  68          HD12      LEU  68   6.338 -11.955  25.394
  527   HD13  LEU  68          HD13      LEU  68   5.377 -11.992  23.886
  528   HD21  LEU  68          HD21      LEU  68   8.562 -11.172  25.383
  529   HD22  LEU  68          HD22      LEU  68   9.037 -12.761  24.736
  530   HD23  LEU  68          HD23      LEU  68   9.566 -11.257  23.936
  531    H    ALA  69           H        ALA  69   7.587 -12.176  19.086
  532    HA   ALA  69           HA       ALA  69   8.833 -14.537  17.899
  533    HB1  ALA  69           HB1      ALA  69   7.026 -15.983  17.833
  534    HB2  ALA  69           HB2      ALA  69   6.931 -15.384  19.496
  535    HB3  ALA  69           HB3      ALA  69   5.851 -14.736  18.242
  536    H    SER  70           H        SER  70   8.020 -14.885  15.775
  537    HA   SER  70           HA       SER  70   6.274 -13.047  14.532
  538    HB2  SER  70           HB2      SER  70   7.953 -12.143  12.842
  539    HB3  SER  70           HB3      SER  70   8.044 -11.481  14.480
  540    HG   SER  70           HG       SER  70  10.136 -12.018  13.675
  541    H    THR  71           H        THR  71   5.846 -13.662  12.188
  542    HA   THR  71           HA       THR  71   5.707 -16.539  12.188
  543    HB   THR  71           HB       THR  71   4.855 -16.016   9.764
  544    HG1  THR  71           HG1      THR  71   5.434 -13.962   9.472
  545   HG21  THR  71          HG21      THR  71   2.711 -14.873  10.993
  546   HG22  THR  71          HG22      THR  71   3.036 -16.585  10.820
  547   HG23  THR  71          HG23      THR  71   3.475 -15.780  12.338
  548    H    ARG  72           H        ARG  72   6.644 -18.059  11.083
  549    HA   ARG  72           HA       ARG  72   9.393 -17.505  10.176
  550    HB2  ARG  72           HB2      ARG  72   7.840 -20.099  10.452
  551    HB3  ARG  72           HB3      ARG  72   9.584 -19.967  10.297
  552    HG2  ARG  72           HG2      ARG  72   9.897 -19.269  12.512
  553    HG3  ARG  72           HG3      ARG  72   8.310 -18.530  12.646
  554    HD2  ARG  72           HD2      ARG  72   7.441 -20.998  12.324
  555    HD3  ARG  72           HD3      ARG  72   9.029 -21.434  12.978
  556    HE   ARG  72           HE       ARG  72   6.678 -20.215  14.195
  557   HH11  ARG  72          HH11      ARG  72  10.169 -20.682  14.722
  558   HH12  ARG  72          HH12      ARG  72  10.101 -20.447  16.429
  559   HH21  ARG  72          HH21      ARG  72   6.564 -19.882  16.479
  560   HH22  ARG  72          HH22      ARG  72   7.992 -19.994  17.449
  561    H    ASN  73           H        ASN  73   6.263 -18.329   8.838
  562    HA   ASN  73           HA       ASN  73   7.307 -18.294   6.098
  563    HB2  ASN  73           HB2      ASN  73   5.702 -19.864   5.412
  564    HB3  ASN  73           HB3      ASN  73   6.367 -20.560   6.895
  565   HD21  ASN  73          HD22      ASN  73   4.961 -20.181   8.995
  566   HD22  ASN  73          HD21      ASN  73   3.249 -20.073   8.764
  567    H    TRP  74           H        TRP  74   5.847 -17.083   4.613
  568    HA   TRP  74           HA       TRP  74   4.484 -14.906   6.069
  569    HB2  TRP  74           HB2      TRP  74   5.054 -15.419   3.124
  570    HB3  TRP  74           HB3      TRP  74   4.001 -14.130   3.674
  571    HD1  TRP  74           HD1      TRP  74   7.702 -15.164   3.830
  572    HE1  TRP  74           HE1      TRP  74   9.141 -13.071   4.178
  573    HE3  TRP  74           HE3      TRP  74   3.987 -11.716   4.452
  574    HZ2  TRP  74           HZ2      TRP  74   8.736 -10.301   4.820
  575    HZ3  TRP  74           HZ3      TRP  74   4.533  -9.332   4.898
  576    HH2  TRP  74           HH2      TRP  74   6.899  -8.640   5.234
  577    H    LEU  75           H        LEU  75   2.340 -14.585   6.251
  578    HA   LEU  75           HA       LEU  75   0.612 -16.893   5.531
  579    HB2  LEU  75           HB2      LEU  75  -0.106 -14.448   7.188
  580    HB3  LEU  75           HB3      LEU  75  -1.002 -15.951   7.013
  581    HG   LEU  75           HG       LEU  75   1.560 -15.435   8.543
  582   HD11  LEU  75          HD11      LEU  75   0.266 -16.346  10.429
  583   HD12  LEU  75          HD12      LEU  75  -0.588 -15.001   9.659
  584   HD13  LEU  75          HD13      LEU  75  -1.117 -16.672   9.363
  585   HD21  LEU  75          HD21      LEU  75   0.459 -18.174   7.813
  586   HD22  LEU  75          HD22      LEU  75   2.076 -17.499   7.453
  587   HD23  LEU  75          HD23      LEU  75   1.636 -17.865   9.115
  588    H    ARG  76           H        ARG  76   0.443 -16.625   3.286
  589    HA   ARG  76           HA       ARG  76  -0.523 -14.020   2.235
  590    HB2  ARG  76           HB2      ARG  76   1.335 -15.479   1.146
  591    HB3  ARG  76           HB3      ARG  76   0.037 -16.587   0.699
  592    HG2  ARG  76           HG2      ARG  76  -1.034 -14.570  -0.543
  593    HG3  ARG  76           HG3      ARG  76   0.503 -13.731  -0.244
  594    HD2  ARG  76           HD2      ARG  76   1.639 -15.792  -1.279
  595    HD3  ARG  76           HD3      ARG  76   0.012 -16.283  -1.822
  596    HE   ARG  76           HE       ARG  76   0.361 -13.659  -2.708
  597   HH11  ARG  76          HH11      ARG  76   1.994 -16.778  -3.224
  598   HH12  ARG  76          HH12      ARG  76   2.595 -16.375  -4.792
  599   HH21  ARG  76          HH21      ARG  76   1.150 -13.135  -4.849
  600   HH22  ARG  76          HH22      ARG  76   2.120 -14.267  -5.713
  601    H    TYR  77           H        TYR  77  -2.548 -13.812   1.241
  602    HA   TYR  77           HA       TYR  77  -4.204 -16.177   0.907
  603    HB2  TYR  77           HB2      TYR  77  -6.097 -15.605   2.110
  604    HB3  TYR  77           HB3      TYR  77  -4.762 -15.569   3.243
  605    HD1  TYR  77           HD2      TYR  77  -3.814 -13.285   3.946
  606    HD2  TYR  77           HD1      TYR  77  -7.493 -13.734   1.734
  607    HE1  TYR  77           HE2      TYR  77  -4.528 -11.062   4.684
  608    HE2  TYR  77           HE1      TYR  77  -8.195 -11.478   2.433
  609    HH   TYR  77           HH       TYR  77  -6.242  -9.422   4.661
  610    H    LYS  78           H        LYS  78  -5.807 -15.906  -0.642
  611    HA   LYS  78           HA       LYS  78  -5.717 -13.352  -2.188
  612    HB2  LYS  78           HB2      LYS  78  -6.649 -16.175  -2.856
  613    HB3  LYS  78           HB3      LYS  78  -7.321 -14.782  -3.691
  614    HG2  LYS  78           HG2      LYS  78  -5.586 -15.611  -5.037
  615    HG3  LYS  78           HG3      LYS  78  -5.086 -14.046  -4.381
  616    HD2  LYS  78           HD2      LYS  78  -3.449 -14.999  -2.984
  617    HD3  LYS  78           HD3      LYS  78  -4.219 -16.588  -2.945
  618    HE2  LYS  78           HE2      LYS  78  -2.937 -15.423  -5.458
  619    HE3  LYS  78           HE3      LYS  78  -2.036 -16.386  -4.282
  620    HZ1  LYS  78           HZ1      LYS  78  -2.825 -17.757  -6.086
  621    HZ2  LYS  78           HZ2      LYS  78  -3.546 -18.242  -4.713
  622    HZ3  LYS  78           HZ3      LYS  78  -4.380 -17.366  -5.829
  623    H    LEU  79           H        LEU  79  -7.530 -12.155  -2.313
  624    HA   LEU  79           HA       LEU  79  -9.753 -12.764  -0.405
  625    HB2  LEU  79           HB2      LEU  79 -10.272 -10.488  -0.346
  626    HB3  LEU  79           HB3      LEU  79  -8.623 -10.815   0.122
  627    HG   LEU  79           HG       LEU  79  -7.767  -9.809  -1.920
  628   HD11  LEU  79          HD11      LEU  79 -10.693  -9.712  -2.660
  629   HD12  LEU  79          HD12      LEU  79  -9.567  -8.467  -3.289
  630   HD13  LEU  79          HD13      LEU  79  -9.294 -10.176  -3.642
  631   HD21  LEU  79          HD21      LEU  79  -8.437  -7.504  -1.384
  632   HD22  LEU  79          HD22      LEU  79  -9.872  -8.103  -0.522
  633   HD23  LEU  79          HD23      LEU  79  -8.248  -8.457   0.100
  634    HA   PRO  80           HA       PRO  80 -12.309 -13.860  -3.797
  635    HB2  PRO  80           HB2      PRO  80 -14.821 -13.351  -2.837
  636    HB3  PRO  80           HB3      PRO  80 -13.754 -14.624  -2.152
  637    HG2  PRO  80           HG2      PRO  80 -14.208 -11.823  -1.142
  638    HG3  PRO  80           HG3      PRO  80 -14.236 -13.356  -0.210
  639    HD2  PRO  80           HD2      PRO  80 -12.014 -11.729  -0.374
  640    HD3  PRO  80           HD3      PRO  80 -11.886 -13.508  -0.226
  641    H    LYS  81           H        LYS  81 -13.775 -12.981  -5.534
  642    HA   LYS  81           HA       LYS  81 -12.759 -10.462  -6.256
  643    HB2  LYS  81           HB2      LYS  81 -12.894 -11.678  -8.061
  644    HB3  LYS  81           HB3      LYS  81 -14.275 -12.647  -7.498
  645    HG2  LYS  81           HG2      LYS  81 -15.813 -10.944  -8.110
  646    HG3  LYS  81           HG3      LYS  81 -14.482  -9.874  -8.646
  647    HD2  LYS  81           HD2      LYS  81 -13.803 -11.587 -10.330
  648    HD3  LYS  81           HD3      LYS  81 -15.175 -12.615  -9.820
  649    HE2  LYS  81           HE2      LYS  81 -16.724 -10.763 -10.308
  650    HE3  LYS  81           HE3      LYS  81 -15.361  -9.750 -10.817
  651    HZ1  LYS  81           HZ1      LYS  81 -16.485 -10.753 -12.732
  652    HZ2  LYS  81           HZ2      LYS  81 -14.962 -11.330 -12.644
  653    HZ3  LYS  81           HZ3      LYS  81 -16.228 -12.259 -12.174
  654    H    ARG  82           H        ARG  82 -15.714 -11.187  -4.532
  655    HA   ARG  82           HA       ARG  82 -17.028  -8.743  -5.055
  656    HB2  ARG  82           HB2      ARG  82 -18.209  -9.062  -2.963
  657    HB3  ARG  82           HB3      ARG  82 -18.129 -10.549  -3.918
  658    HG2  ARG  82           HG2      ARG  82 -16.175 -11.243  -2.391
  659    HG3  ARG  82           HG3      ARG  82 -16.614  -9.875  -1.358
  660    HD2  ARG  82           HD2      ARG  82 -18.466 -12.132  -2.205
  661    HD3  ARG  82           HD3      ARG  82 -17.602 -12.081  -0.658
  662    HE   ARG  82           HE       ARG  82 -19.017  -9.678  -0.803
  663   HH11  ARG  82          HH11      ARG  82 -19.854 -13.140  -0.723
  664   HH12  ARG  82          HH12      ARG  82 -21.401 -12.888   0.011
  665   HH21  ARG  82          HH21      ARG  82 -21.081  -9.350   0.165
  666   HH22  ARG  82          HH22      ARG  82 -22.098 -10.694   0.535
  667    H    LEU  83           H        LEU  83 -14.199  -9.362  -3.068
  668    HA   LEU  83           HA       LEU  83 -14.309  -6.679  -1.883
  669    HB2  LEU  83           HB2      LEU  83 -12.247  -8.846  -1.458
  670    HB3  LEU  83           HB3      LEU  83 -12.428  -7.372  -0.524
  671    HG   LEU  83           HG       LEU  83 -14.326  -9.735  -0.596
  672   HD11  LEU  83          HD11      LEU  83 -13.664 -10.128   1.686
  673   HD12  LEU  83          HD12      LEU  83 -12.191 -10.041   0.709
  674   HD13  LEU  83          HD13      LEU  83 -12.661  -8.658   1.707
  675   HD21  LEU  83          HD21      LEU  83 -14.629  -7.146   0.967
  676   HD22  LEU  83          HD22      LEU  83 -15.696  -7.748  -0.322
  677   HD23  LEU  83          HD23      LEU  83 -15.602  -8.618   1.205
  678    H    VAL  84           H        VAL  84 -12.986  -8.135  -4.700
  679    HA   VAL  84           HA       VAL  84 -10.467  -6.738  -4.757
  680    HB   VAL  84           HB       VAL  84 -12.154  -8.029  -6.962
  681   HG11  VAL  84          HG11      VAL  84  -9.344  -6.902  -7.045
  682   HG12  VAL  84          HG12      VAL  84  -9.996  -7.989  -8.279
  683   HG13  VAL  84          HG13      VAL  84 -10.727  -6.394  -8.035
  684   HG21  VAL  84          HG21      VAL  84  -9.537  -9.035  -5.789
  685   HG22  VAL  84          HG22      VAL  84 -11.116  -9.589  -5.221
  686   HG23  VAL  84          HG23      VAL  84 -10.643  -9.875  -6.904
  687    H    ARG  85           H        ARG  85 -10.028  -4.664  -5.384
  688    HA   ARG  85           HA       ARG  85 -12.267  -3.002  -6.320
  689    HB2  ARG  85           HB2      ARG  85  -9.925  -2.576  -4.622
  690    HB3  ARG  85           HB3      ARG  85  -9.927  -1.405  -5.941
  691    HG2  ARG  85           HG2      ARG  85 -12.333  -1.986  -4.213
  692    HG3  ARG  85           HG3      ARG  85 -11.165  -0.668  -3.906
  693    HD2  ARG  85           HD2      ARG  85 -11.654   0.154  -6.274
  694    HD3  ARG  85           HD3      ARG  85 -13.018  -0.956  -6.333
  695    HE   ARG  85           HE       ARG  85 -12.712   1.541  -4.823
  696   HH11  ARG  85          HH21      ARG  85 -14.722  -1.403  -5.050
  697   HH12  ARG  85          HH22      ARG  85 -16.081  -0.682  -4.272
  698   HH21  ARG  85          HH11      ARG  85 -14.530   2.471  -3.792
  699   HH22  ARG  85          HH12      ARG  85 -15.965   1.551  -3.529
  700    H    TRP  86           H        TRP  86 -12.517  -3.715  -8.325
  701    HA   TRP  86           HA       TRP  86 -10.451  -3.825 -10.297
  702    HB2  TRP  86           HB2      TRP  86 -13.462  -3.515 -10.533
  703    HB3  TRP  86           HB3      TRP  86 -12.386  -3.966 -11.862
  704    HD1  TRP  86           HD1      TRP  86 -14.431  -5.460  -9.175
  705    HE1  TRP  86           HE1      TRP  86 -13.922  -7.918  -8.805
  706    HE3  TRP  86           HE3      TRP  86 -10.188  -5.820 -12.009
  707    HZ2  TRP  86           HZ2      TRP  86 -11.933  -9.868  -9.683
  708    HZ3  TRP  86           HZ3      TRP  86  -8.999  -7.994 -12.220
  709    HH2  TRP  86           HH2      TRP  86  -9.870 -10.020 -11.069
  710    H    ASP  87           H        ASP  87 -12.321  -1.192  -8.934
  711    HA   ASP  87           HA       ASP  87 -12.375   0.495 -11.251
  712    HB2  ASP  87           HB2      ASP  87 -14.061   0.500  -9.449
  713    HB3  ASP  87           HB3      ASP  87 -12.855   1.131  -8.322
  714    H    THR  88           H        THR  88  -9.788  -0.161  -9.100
  715    HA   THR  88           HA       THR  88  -8.482   2.396  -9.780
  716    HB   THR  88           HB       THR  88  -9.291   2.166  -7.356
  717    HG1  THR  88           HG1      THR  88  -7.576   3.387  -6.733
  718   HG21  THR  88          HG21      THR  88  -6.754   0.503  -7.063
  719   HG22  THR  88          HG22      THR  88  -7.929   0.955  -5.799
  720   HG23  THR  88          HG23      THR  88  -8.389  -0.197  -7.060
  721    H    LYS  89           H        LYS  89  -6.109   2.244  -9.770
  722    HA   LYS  89           HA       LYS  89  -5.167  -0.343 -10.837
  723    HB2  LYS  89           HB2      LYS  89  -4.655   2.371 -12.052
  724    HB3  LYS  89           HB3      LYS  89  -3.990   0.810 -12.576
  725    HG2  LYS  89           HG2      LYS  89  -6.503   0.045 -12.700
  726    HG3  LYS  89           HG3      LYS  89  -6.866   1.782 -12.656
  727    HD2  LYS  89           HD2      LYS  89  -5.376   2.083 -14.651
  728    HD3  LYS  89           HD3      LYS  89  -5.053   0.325 -14.622
  729    HE2  LYS  89           HE2      LYS  89  -7.456  -0.137 -14.997
  730    HE3  LYS  89           HE3      LYS  89  -7.813   1.596 -14.982
  731    HZ1  LYS  89           HZ1      LYS  89  -7.632   0.750 -17.240
  732    HZ2  LYS  89           HZ2      LYS  89  -6.443   1.834 -16.985
  733    HZ3  LYS  89           HZ3      LYS  89  -6.106   0.231 -16.994
  734    HA   PRO  90           HA       PRO  90  -3.566  -1.596 -10.925
  735    HB2  PRO  90           HB2      PRO  90  -1.996  -3.229  -9.486
  736    HB3  PRO  90           HB3      PRO  90  -1.378  -2.103 -10.745
  737    HG2  PRO  90           HG2      PRO  90  -1.469  -1.655  -7.739
  738    HG3  PRO  90           HG3      PRO  90  -0.058  -1.452  -8.830
  739    HD2  PRO  90           HD2      PRO  90  -1.659   0.642  -8.084
  740    HD3  PRO  90           HD3      PRO  90  -0.956   0.552  -9.729
  741    H    VAL  91           H        VAL  91  -4.977  -3.279 -10.375
  742    HA   VAL  91           HA       VAL  91  -6.547  -3.020  -7.975
  743    HB   VAL  91           HB       VAL  91  -7.696  -3.637  -9.945
  744   HG11  VAL  91          HG11      VAL  91  -7.181  -5.658 -11.321
  745   HG12  VAL  91          HG12      VAL  91  -5.936  -4.414 -11.426
  746   HG13  VAL  91          HG13      VAL  91  -5.665  -5.857 -10.419
  747   HG21  VAL  91          HG21      VAL  91  -7.341  -6.313  -8.534
  748   HG22  VAL  91          HG22      VAL  91  -8.324  -4.970  -7.910
  749   HG23  VAL  91          HG23      VAL  91  -8.743  -5.735  -9.455
  750    H    CYS  92           H        CYS  92  -6.594  -4.317  -6.157
  751    HA   CYS  92           HA       CYS  92  -4.277  -6.095  -5.742
  752    HB2  CYS  92           HB2      CYS  92  -5.040  -6.020  -3.358
  753    HB3  CYS  92           HB3      CYS  92  -4.565  -4.456  -4.035
  754    HG   CYS  92           HG       CYS  92  -7.651  -5.635  -3.866
  755    H    ILE  93           H        ILE  93  -4.533  -8.326  -5.597
  756    HA   ILE  93           HA       ILE  93  -7.311  -9.340  -5.145
  757    HB   ILE  93           HB       ILE  93  -7.078 -11.150  -6.539
  758   HG12  ILE  93          HG12      ILE  93  -4.872 -11.986  -6.150
  759   HG13  ILE  93          HG13      ILE  93  -5.148 -11.798  -7.866
  760   HG21  ILE  93          HG21      ILE  93  -5.927  -8.821  -8.119
  761   HG22  ILE  93          HG22      ILE  93  -6.820 -10.212  -8.757
  762   HG23  ILE  93          HG23      ILE  93  -7.633  -9.062  -7.685
  763   HD11  ILE  93          HD11      ILE  93  -3.813  -9.588  -7.697
  764   HD12  ILE  93          HD12      ILE  93  -3.343 -10.165  -6.074
  765   HD13  ILE  93          HD13      ILE  93  -2.933 -11.107  -7.505
  766    H    GLY  94           H        GLY  94  -4.092  -9.252  -3.899
  767    HA2  GLY  94           HA2      GLY  94  -4.861 -11.073  -1.769
  768    HA3  GLY  94           HA3      GLY  94  -3.583 -11.681  -2.829
  769    H    GLN  95           H        GLN  95  -2.738 -11.450  -0.443
  770    HA   GLN  95           HA       GLN  95  -0.796  -9.280  -0.424
  771    HB2  GLN  95           HB2      GLN  95  -1.422  -8.628   1.945
  772    HB3  GLN  95           HB3      GLN  95  -2.461  -8.025   0.669
  773    HG2  GLN  95           HG2      GLN  95  -3.197 -10.540   2.208
  774    HG3  GLN  95           HG3      GLN  95  -3.538  -8.936   2.856
  775   HE21  GLN  95          HE22      GLN  95  -4.930 -11.424   0.969
  776   HE22  GLN  95          HE21      GLN  95  -6.170 -10.435   0.244
  777    H    LYS  96           H        LYS  96   0.862  -9.676   1.199
  778    HA   LYS  96           HA       LYS  96   0.834 -12.454   2.331
  779    HB2  LYS  96           HB2      LYS  96   3.285 -12.498   2.156
  780    HB3  LYS  96           HB3      LYS  96   2.501 -12.396   0.584
  781    HG2  LYS  96           HG2      LYS  96   3.001  -9.973   0.472
  782    HG3  LYS  96           HG3      LYS  96   3.834 -10.061   2.032
  783    HD2  LYS  96           HD2      LYS  96   4.646 -11.639  -0.448
  784    HD3  LYS  96           HD3      LYS  96   5.296 -10.053  -0.021
  785    HE2  LYS  96           HE2      LYS  96   6.169 -10.959   2.137
  786    HE3  LYS  96           HE3      LYS  96   5.551 -12.563   1.711
  787    HZ1  LYS  96           HZ1      LYS  96   7.895 -12.367   1.154
  788    HZ2  LYS  96           HZ2      LYS  96   7.043 -12.556  -0.224
  789    HZ3  LYS  96           HZ3      LYS  96   7.630 -11.083   0.177
  790    H    GLN  97           H        GLN  97   0.829 -12.448   4.562
  791    HA   GLN  97           HA       GLN  97   1.383  -9.828   5.865
  792    HB2  GLN  97           HB2      GLN  97  -0.375 -12.069   6.865
  793    HB3  GLN  97           HB3      GLN  97  -0.113 -10.474   7.600
  794    HG2  GLN  97           HG2      GLN  97  -1.069  -9.499   5.412
  795    HG3  GLN  97           HG3      GLN  97  -1.598 -11.138   5.035
  796   HE21  GLN  97          HE22      GLN  97  -2.101  -8.313   7.137
  797   HE22  GLN  97          HE21      GLN  97  -3.635  -8.863   7.787
  798    H    LYS  98           H        LYS  98   3.065  -9.724   7.280
  799    HA   LYS  98           HA       LYS  98   4.119 -12.287   8.438
  800    HB2  LYS  98           HB2      LYS  98   5.744 -11.136   7.071
  801    HB3  LYS  98           HB3      LYS  98   5.489  -9.606   7.952
  802    HG2  LYS  98           HG2      LYS  98   6.631 -10.352   9.808
  803    HG3  LYS  98           HG3      LYS  98   6.439 -12.070   9.427
  804    HD2  LYS  98           HD2      LYS  98   8.101 -10.208   7.710
  805    HD3  LYS  98           HD3      LYS  98   8.786 -10.964   9.142
  806    HE2  LYS  98           HE2      LYS  98   7.437 -12.685   7.019
  807    HE3  LYS  98           HE3      LYS  98   9.033 -12.020   6.717
  808    HZ1  LYS  98           HZ1      LYS  98   9.865 -13.117   8.717
  809    HZ2  LYS  98           HZ2      LYS  98   8.405 -13.802   9.039
  810    HZ3  LYS  98           HZ3      LYS  98   9.230 -14.211   7.692
  811    H    TRP  99           H        TRP  99   3.809 -12.521  10.631
  812    HA   TRP  99           HA       TRP  99   2.478 -10.220  12.003
  813    HB2  TRP  99           HB2      TRP  99   2.047 -13.195  12.267
  814    HB3  TRP  99           HB3      TRP  99   1.381 -11.980  13.351
  815    HD1  TRP  99           HD1      TRP  99   1.131 -13.100   9.668
  816    HE1  TRP  99           HE1      TRP  99  -1.190 -12.425   8.793
  817    HE3  TRP  99           HE3      TRP  99  -0.457 -10.325  13.652
  818    HZ2  TRP  99           HZ2      TRP  99  -3.373 -10.733   9.641
  819    HZ3  TRP  99           HZ3      TRP  99  -2.558  -9.044  13.523
  820    HH2  TRP  99           HH2      TRP  99  -4.058  -9.277  11.544
  821    H    PHE 100           H        PHE 100   2.944  -9.868  14.208
  822    HA   PHE 100           HA       PHE 100   5.489 -11.082  15.198
  823    HB2  PHE 100           HB2      PHE 100   4.631  -8.156  15.108
  824    HB3  PHE 100           HB3      PHE 100   6.039  -8.767  15.963
  825    HD1  PHE 100           HD2      PHE 100   4.566  -8.288  12.529
  826    HD2  PHE 100           HD1      PHE 100   8.122  -9.052  14.880
  827    HE1  PHE 100           HE2      PHE 100   5.983  -7.959  10.532
  828    HE2  PHE 100           HE1      PHE 100   9.518  -8.721  12.873
  829    HZ   PHE 100           HZ       PHE 100   8.466  -8.199  10.702
  830    H    LEU 101           H        LEU 101   5.262 -11.785  17.293
  831    HA   LEU 101           HA       LEU 101   2.887 -10.915  18.886
  832    HB2  LEU 101           HB2      LEU 101   3.131 -13.298  19.018
  833    HB3  LEU 101           HB3      LEU 101   4.886 -13.155  19.243
  834    HG   LEU 101           HG       LEU 101   4.571 -12.207  21.465
  835   HD11  LEU 101          HD11      LEU 101   1.589 -12.706  21.174
  836   HD12  LEU 101          HD12      LEU 101   2.477 -12.042  22.571
  837   HD13  LEU 101          HD13      LEU 101   2.342 -11.089  21.117
  838   HD21  LEU 101          HD21      LEU 101   2.988 -14.794  21.216
  839   HD22  LEU 101          HD22      LEU 101   4.759 -14.705  21.164
  840   HD23  LEU 101          HD23      LEU 101   3.897 -14.201  22.623
  841    H    LEU 102           H        LEU 102   3.255  -9.173  20.138
  842    HA   LEU 102           HA       LEU 102   6.005  -8.685  21.128
  843    HB2  LEU 102           HB2      LEU 102   3.780  -6.898  20.106
  844    HB3  LEU 102           HB3      LEU 102   4.782  -6.313  21.436
  845    HG   LEU 102           HG       LEU 102   6.773  -6.570  20.085
  846   HD11  LEU 102          HD11      LEU 102   6.375  -8.378  18.621
  847   HD12  LEU 102          HD12      LEU 102   4.889  -7.628  17.960
  848   HD13  LEU 102          HD13      LEU 102   6.484  -6.957  17.571
  849   HD21  LEU 102          HD21      LEU 102   6.392  -4.670  18.685
  850   HD22  LEU 102          HD22      LEU 102   4.687  -5.125  18.398
  851   HD23  LEU 102          HD23      LEU 102   5.183  -4.512  19.973
  852    H    GLN 103           H        GLN 103   6.121  -8.740  23.419
  853    HA   GLN 103           HA       GLN 103   3.467  -8.960  24.805
  854    HB2  GLN 103           HB2      GLN 103   4.735 -10.538  25.619
  855    HB3  GLN 103           HB3      GLN 103   6.219  -9.571  25.764
  856    HG2  GLN 103           HG2      GLN 103   5.415  -8.520  27.758
  857    HG3  GLN 103           HG3      GLN 103   3.721  -8.718  27.308
  858   HE21  GLN 103          HE21      GLN 103   2.709 -10.841  27.411
  859   HE22  GLN 103          HE22      GLN 103   3.309 -12.008  28.584
  860    H    LEU 104           H        LEU 104   2.596  -7.168  25.806
  861    HA   LEU 104           HA       LEU 104   3.703  -4.536  25.588
  862    HB2  LEU 104           HB2      LEU 104   1.223  -5.863  26.373
  863    HB3  LEU 104           HB3      LEU 104   1.688  -4.784  27.674
  864    HG   LEU 104           HG       LEU 104   1.492  -3.972  24.749
  865   HD11  LEU 104          HD11      LEU 104  -0.720  -4.668  25.637
  866   HD12  LEU 104          HD12      LEU 104  -0.537  -3.509  26.966
  867   HD13  LEU 104          HD13      LEU 104  -0.633  -2.940  25.280
  868   HD21  LEU 104          HD21      LEU 104   1.965  -2.411  27.326
  869   HD22  LEU 104          HD22      LEU 104   2.923  -2.444  25.833
  870   HD23  LEU 104          HD23      LEU 104   1.347  -1.647  25.856
  871    H    VAL 105           H        VAL 105   4.791  -3.289  27.195
  872    HA   VAL 105           HA       VAL 105   6.198  -4.947  29.162
  873    HB   VAL 105           HB       VAL 105   6.628  -2.143  28.145
  874   HG11  VAL 105          HG11      VAL 105   8.368  -3.735  30.070
  875   HG12  VAL 105          HG12      VAL 105   8.849  -2.229  29.252
  876   HG13  VAL 105          HG13      VAL 105   7.520  -2.213  30.413
  877   HG21  VAL 105          HG21      VAL 105   8.462  -4.515  27.722
  878   HG22  VAL 105          HG22      VAL 105   7.138  -4.167  26.605
  879   HG23  VAL 105          HG23      VAL 105   8.416  -2.974  26.837
  880    H    SER 106           H        SER 106   4.311  -1.867  29.199
  881    HA   SER 106           HA       SER 106   4.182  -1.946  32.142
  882    HB2  SER 106           HB2      SER 106   2.929  -0.100  30.078
  883    HB3  SER 106           HB3      SER 106   2.812   0.110  31.834
  884    HG   SER 106           HG       SER 106   5.071   0.305  30.146
  885    H    GLY 107           H        GLY 107   2.235  -3.038  29.459
  886    HA2  GLY 107           HA2      GLY 107   0.498  -4.711  29.799
  887    HA3  GLY 107           HA3      GLY 107   0.109  -3.962  31.345
  888    H    ASP 108           H        ASP 108  -2.070  -4.025  30.319
  889    HA   ASP 108           HA       ASP 108  -2.738  -2.811  27.971
  890    HB2  ASP 108           HB2      ASP 108  -4.926  -3.303  28.523
  891    HB3  ASP 108           HB3      ASP 108  -4.006  -4.447  29.490
  892    H    ALA 109           H        ALA 109  -2.159  -1.285  30.969
  893    HA   ALA 109           HA       ALA 109  -3.524   1.149  30.810
  894    HB1  ALA 109           HB1      ALA 109  -0.653   0.651  31.724
  895    HB2  ALA 109           HB2      ALA 109  -1.636   2.067  32.133
  896    HB3  ALA 109           HB3      ALA 109  -2.114   0.460  32.729
  897    H    GLU 110           H        GLU 110  -0.737   0.104  28.880
  898    HA   GLU 110           HA       GLU 110  -0.340   2.821  27.945
  899    HB2  GLU 110           HB2      GLU 110   1.368   0.346  27.895
  900    HB3  GLU 110           HB3      GLU 110   1.752   1.664  26.785
  901    HG2  GLU 110           HG2      GLU 110   1.447   2.003  29.783
  902    HG3  GLU 110           HG3      GLU 110   2.987   1.773  28.945
  903    H    ILE 111           H        ILE 111  -2.615   1.261  27.097
  904    HA   ILE 111           HA       ILE 111  -2.246   1.197  24.137
  905    HB   ILE 111           HB       ILE 111  -4.589   0.143  25.773
  906   HG12  ILE 111          HG12      ILE 111  -2.496  -1.481  24.256
  907   HG13  ILE 111          HG13      ILE 111  -2.361  -1.177  25.985
  908   HG21  ILE 111          HG21      ILE 111  -3.891  -0.142  22.826
  909   HG22  ILE 111          HG22      ILE 111  -5.307  -0.860  23.646
  910   HG23  ILE 111          HG23      ILE 111  -5.191   0.881  23.496
  911   HD11  ILE 111          HD11      ILE 111  -4.484  -2.312  26.430
  912   HD12  ILE 111          HD12      ILE 111  -4.706  -2.654  24.720
  913   HD13  ILE 111          HD13      ILE 111  -3.347  -3.376  25.582
  914    H    ASN 112           H        ASN 112  -3.185   2.807  22.884
  915    HA   ASN 112           HA       ASN 112  -4.793   4.900  24.330
  916    HB2  ASN 112           HB2      ASN 112  -2.518   5.677  23.867
  917    HB3  ASN 112           HB3      ASN 112  -2.694   5.253  22.165
  918   HD21  ASN 112          HD22      ASN 112  -2.325   7.498  21.500
  919   HD22  ASN 112          HD21      ASN 112  -3.631   8.650  21.651
  920    H    MET 113           H        MET 113  -4.122   3.657  21.030
  921    HA   MET 113           HA       MET 113  -5.359   3.094  19.299
  922    HB2  MET 113           HB2      MET 113  -7.931   3.329  20.856
  923    HB3  MET 113           HB3      MET 113  -7.571   2.391  19.410
  924    HG2  MET 113           HG2      MET 113  -5.684   1.363  21.049
  925    HG3  MET 113           HG3      MET 113  -6.861   1.870  22.264
  926    HE1  MET 113           HE1      MET 113  -5.749  -1.237  21.434
  927    HE2  MET 113           HE2      MET 113  -6.722  -1.990  20.149
  928    HE3  MET 113           HE3      MET 113  -5.685  -0.584  19.774
  929    H    GLN 114           H        GLN 114  -5.098   6.144  20.245
  930    HA   GLN 114           HA       GLN 114  -6.436   7.215  17.932
  931    HB2  GLN 114           HB2      GLN 114  -7.605   8.968  19.242
  932    HB3  GLN 114           HB3      GLN 114  -8.348   7.368  19.169
  933    HG2  GLN 114           HG2      GLN 114  -7.688   6.814  21.420
  934    HG3  GLN 114           HG3      GLN 114  -6.744   8.293  21.577
  935   HE21  GLN 114          HE22      GLN 114  -7.981  10.416  21.499
  936   HE22  GLN 114          HE21      GLN 114  -9.634  10.432  22.076
  937    H    THR 115           H        THR 115  -4.355   7.393  17.498
  938    HA   THR 115           HA       THR 115  -2.549   9.300  18.740
  939    HB   THR 115           HB       THR 115  -1.454   8.774  16.397
  940    HG1  THR 115           HG1      THR 115  -2.169   6.797  15.537
  941   HG21  THR 115          HG21      THR 115  -0.661   7.888  18.630
  942   HG22  THR 115          HG22      THR 115  -1.876   6.591  18.518
  943   HG23  THR 115          HG23      THR 115  -0.514   6.655  17.370
  944    H    SER 116           H        SER 116  -4.140   8.929  15.633
  945    HA   SER 116           HA       SER 116  -4.353  11.727  14.954
  946    HB2  SER 116           HB2      SER 116  -5.980   9.354  13.946
  947    HB3  SER 116           HB3      SER 116  -5.803  10.930  13.155
  948    HG   SER 116           HG       SER 116  -4.370   9.339  12.274
  949    H    SER 117           H        SER 117  -6.540  12.851  14.679
  950    HA   SER 117           HA       SER 117  -7.870  13.034  17.169
  951    HB2  SER 117           HB2      SER 117  -8.912  13.944  14.455
  952    HB3  SER 117           HB3      SER 117  -9.300  14.621  16.048
  953    HG   SER 117           HG       SER 117  -7.714  15.876  14.928
  954    H    THR 118           H        THR 118  -8.570  11.179  14.209
  955    HA   THR 118           HA       THR 118 -11.007  10.017  15.281
  956    HB   THR 118           HB       THR 118 -10.216   8.568  13.105
  957    HG1  THR 118           HG1      THR 118  -9.797  10.100  11.501
  958   HG21  THR 118          HG21      THR 118 -12.199  10.819  13.362
  959   HG22  THR 118          HG22      THR 118 -12.181   9.580  12.069
  960   HG23  THR 118          HG23      THR 118 -12.440   9.095  13.757
  961    HA   PRO 119           HA       PRO 119  -8.600   6.628  17.044
  962    HB2  PRO 119           HB2      PRO 119 -11.319   5.364  17.199
  963    HB3  PRO 119           HB3      PRO 119 -10.086   5.516  18.490
  964    HG2  PRO 119           HG2      PRO 119 -12.340   7.072  18.454
  965    HG3  PRO 119           HG3      PRO 119 -10.755   7.760  18.947
  966    HD2  PRO 119           HD2      PRO 119 -12.147   7.971  16.264
  967    HD3  PRO 119           HD3      PRO 119 -11.285   9.233  17.203
  968    H    GLU 120           H        GLU 120  -7.823   4.786  15.946
  969    HA   GLU 120           HA       GLU 120  -9.105   4.049  13.384
  970    HB2  GLU 120           HB2      GLU 120  -6.536   3.160  14.735
  971    HB3  GLU 120           HB3      GLU 120  -7.200   2.299  13.353
  972    HG2  GLU 120           HG2      GLU 120  -6.430   5.237  13.397
  973    HG3  GLU 120           HG3      GLU 120  -5.522   3.930  12.640
  974    H    PHE 121           H        PHE 121  -9.399   3.029  16.678
  975    HA   PHE 121           HA       PHE 121 -10.913   0.642  15.743
  976    HB2  PHE 121           HB2      PHE 121  -9.384   0.967  18.333
  977    HB3  PHE 121           HB3      PHE 121 -10.465  -0.362  17.954
  978    HD1  PHE 121           HD1      PHE 121  -9.932  -1.474  15.491
  979    HD2  PHE 121           HD2      PHE 121  -7.101   0.434  18.103
  980    HE1  PHE 121           HE1      PHE 121  -8.106  -2.722  14.396
  981    HE2  PHE 121           HE2      PHE 121  -5.297  -0.946  17.136
  982    HZ   PHE 121           HZ       PHE 121  -5.781  -2.473  15.220
  983    H    ASP 122           H        ASP 122 -12.899   0.307  16.521
  984    HA   ASP 122           HA       ASP 122 -14.411   2.495  17.794
  985    HB2  ASP 122           HB2      ASP 122 -15.480   1.202  15.994
  986    HB3  ASP 122           HB3      ASP 122 -15.146  -0.307  16.839
  987    H    GLY 123           H        GLY 123 -12.839  -0.604  18.575
  988    HA2  GLY 123           HA2      GLY 123 -13.175  -0.262  21.433
  989    HA3  GLY 123           HA3      GLY 123 -14.212  -1.534  20.719
  990    H    TRP 124           H        TRP 124 -12.194  -2.154  22.596
  991    HA   TRP 124           HA       TRP 124 -10.969  -4.202  21.011
  992    HB2  TRP 124           HB2      TRP 124  -8.807  -3.693  21.058
  993    HB3  TRP 124           HB3      TRP 124  -9.303  -2.059  21.394
  994    HD1  TRP 124           HD1      TRP 124  -7.782  -5.135  23.002
  995    HE1  TRP 124           HE1      TRP 124  -6.801  -4.595  25.287
  996    HE3  TRP 124           HE3      TRP 124  -9.405  -0.298  23.414
  997    HZ2  TRP 124           HZ2      TRP 124  -6.755  -2.311  27.112
  998    HZ3  TRP 124           HZ3      TRP 124  -8.851   1.044  25.422
  999    HH2  TRP 124           HH2      TRP 124  -7.538   0.043  27.280
 1000    H    ARG 125           H        ARG 125 -10.137  -5.953  22.404
 1001    HA   ARG 125           HA       ARG 125 -10.830  -5.830  25.237
 1002    HB2  ARG 125           HB2      ARG 125 -12.345  -7.697  25.253
 1003    HB3  ARG 125           HB3      ARG 125 -12.972  -6.502  24.128
 1004    HG2  ARG 125           HG2      ARG 125 -11.926  -7.869  22.232
 1005    HG3  ARG 125           HG3      ARG 125 -11.563  -9.119  23.415
 1006    HD2  ARG 125           HD2      ARG 125 -14.342  -8.037  22.783
 1007    HD3  ARG 125           HD3      ARG 125 -13.665  -9.550  22.158
 1008    HE   ARG 125           HE       ARG 125 -13.466  -9.716  24.950
 1009   HH11  ARG 125          HH11      ARG 125 -16.098  -9.439  22.570
 1010   HH12  ARG 125          HH12      ARG 125 -17.253 -10.272  23.545
 1011   HH21  ARG 125          HH21      ARG 125 -15.001 -10.843  26.239
 1012   HH22  ARG 125          HH22      ARG 125 -16.599 -11.123  25.657
 1013    H    TRP 126           H        TRP 126 -10.126  -7.930  26.291
 1014    HA   TRP 126           HA       TRP 126  -7.815  -9.146  24.860
 1015    HB2  TRP 126           HB2      TRP 126  -8.318  -8.727  27.818
 1016    HB3  TRP 126           HB3      TRP 126  -7.066  -9.767  27.179
 1017    HD1  TRP 126           HD1      TRP 126  -7.956  -6.021  27.418
 1018    HE1  TRP 126           HE1      TRP 126  -5.806  -4.698  27.476
 1019    HE3  TRP 126           HE3      TRP 126  -4.678  -9.761  26.172
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.978  -5.166  27.055
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.262  -9.281  26.022
 1022    HH2  TRP 126           HH2      TRP 126  -1.390  -6.992  26.525
 1023    H    VAL 127           H        VAL 127  -7.934 -11.378  24.554
 1024    HA   VAL 127           HA       VAL 127 -10.202 -12.925  25.703
 1025    HB   VAL 127           HB       VAL 127 -10.320 -13.763  23.157
 1026   HG11  VAL 127          HG11      VAL 127 -12.288 -12.257  22.823
 1027   HG12  VAL 127          HG12      VAL 127 -12.258 -13.013  24.421
 1028   HG13  VAL 127          HG13      VAL 127 -11.771 -11.319  24.239
 1029   HG21  VAL 127          HG21      VAL 127  -9.696 -10.840  22.691
 1030   HG22  VAL 127          HG22      VAL 127  -8.637 -12.211  22.267
 1031   HG23  VAL 127          HG23      VAL 127 -10.224 -12.042  21.496
 1032    H    SER 128           H        SER 128  -9.889 -15.278  25.537
 1033    HA   SER 128           HA       SER 128  -7.188 -16.197  25.576
 1034    HB2  SER 128           HB2      SER 128  -9.747 -17.743  24.972
 1035    HB3  SER 128           HB3      SER 128  -8.212 -18.422  25.559
 1036    HG   SER 128           HG       SER 128  -9.798 -18.050  27.248
 1037    H    TYR 129           H        TYR 129  -5.935 -17.219  23.942
 1038    HA   TYR 129           HA       TYR 129  -6.041 -15.978  21.482
 1039    HB2  TYR 129           HB2      TYR 129  -4.457 -18.134  20.893
 1040    HB3  TYR 129           HB3      TYR 129  -3.956 -16.660  21.673
 1041    HD1  TYR 129           HD2      TYR 129  -5.574 -19.901  22.750
 1042    HD2  TYR 129           HD1      TYR 129  -2.482 -16.966  23.488
 1043    HE1  TYR 129           HE2      TYR 129  -4.913 -21.124  24.789
 1044    HE2  TYR 129           HE1      TYR 129  -1.792 -18.227  25.500
 1045    HH   TYR 129           HH       TYR 129  -3.483 -21.174  26.647
 1046    H    TRP 130           H        TRP 130  -7.741 -19.031  22.205
 1047    HA   TRP 130           HA       TRP 130  -8.170 -19.473  19.328
 1048    HB2  TRP 130           HB2      TRP 130  -9.312 -21.006  21.673
 1049    HB3  TRP 130           HB3      TRP 130  -9.266 -21.510  19.986
 1050    HD1  TRP 130           HD1      TRP 130  -7.621 -22.343  22.991
 1051    HE1  TRP 130           HE1      TRP 130  -5.197 -23.129  22.728
 1052    HE3  TRP 130           HE3      TRP 130  -6.772 -20.822  18.157
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.111 -22.950  20.774
 1054    HZ3  TRP 130           HZ3      TRP 130  -4.550 -21.162  17.121
 1055    HH2  TRP 130           HH2      TRP 130  -2.696 -22.171  18.428
 1056    H    TYR 131           H        TYR 131  -9.795 -17.637  21.770
 1057    HA   TYR 131           HA       TYR 131 -12.494 -17.936  20.906
 1058    HB2  TYR 131           HB2      TYR 131 -11.770 -16.990  23.070
 1059    HB3  TYR 131           HB3      TYR 131 -11.115 -15.592  22.250
 1060    HD1  TYR 131           HD2      TYR 131 -12.812 -14.117  20.819
 1061    HD2  TYR 131           HD1      TYR 131 -13.934 -16.881  23.951
 1062    HE1  TYR 131           HE2      TYR 131 -14.944 -12.924  21.097
 1063    HE2  TYR 131           HE1      TYR 131 -16.050 -15.634  24.276
 1064    HH   TYR 131           HH       TYR 131 -16.975 -12.802  22.259
 1065    HA   PRO 132           HA       PRO 132 -11.933 -14.045  18.190
 1066    HB2  PRO 132           HB2      PRO 132  -9.484 -13.378  17.142
 1067    HB3  PRO 132           HB3      PRO 132 -10.097 -12.784  18.724
 1068    HG2  PRO 132           HG2      PRO 132  -8.241 -15.126  18.238
 1069    HG3  PRO 132           HG3      PRO 132  -8.026 -13.748  19.374
 1070    HD2  PRO 132           HD2      PRO 132  -9.037 -16.064  20.222
 1071    HD3  PRO 132           HD3      PRO 132  -9.760 -14.534  20.785
 1072    H    VAL 133           H        VAL 133  -9.976 -16.942  17.532
 1073    HA   VAL 133           HA       VAL 133  -9.952 -16.735  14.707
 1074    HB   VAL 133           HB       VAL 133  -9.885 -19.230  16.462
 1075   HG11  VAL 133          HG11      VAL 133 -10.287 -19.790  14.083
 1076   HG12  VAL 133          HG12      VAL 133  -8.876 -18.814  13.607
 1077   HG13  VAL 133          HG13      VAL 133  -8.681 -20.284  14.600
 1078   HG21  VAL 133          HG21      VAL 133  -7.621 -17.459  15.414
 1079   HG22  VAL 133          HG22      VAL 133  -8.087 -17.679  17.113
 1080   HG23  VAL 133          HG23      VAL 133  -7.402 -19.031  16.218
 1081    H    ARG 134           H        ARG 134 -12.432 -18.241  16.918
 1082    HA   ARG 134           HA       ARG 134 -13.933 -19.154  14.633
 1083    HB2  ARG 134           HB2      ARG 134 -15.734 -19.724  16.184
 1084    HB3  ARG 134           HB3      ARG 134 -14.172 -20.453  16.521
 1085    HG2  ARG 134           HG2      ARG 134 -15.320 -19.826  18.575
 1086    HG3  ARG 134           HG3      ARG 134 -13.815 -18.921  18.409
 1087    HD2  ARG 134           HD2      ARG 134 -14.989 -16.968  17.684
 1088    HD3  ARG 134           HD3      ARG 134 -16.531 -17.819  17.611
 1089    HE   ARG 134           HE       ARG 134 -15.009 -16.954  20.015
 1090   HH11  ARG 134          HH11      ARG 134 -17.848 -18.778  18.833
 1091   HH12  ARG 134          HH12      ARG 134 -18.618 -18.839  20.372
 1092   HH21  ARG 134          HH21      ARG 134 -16.103 -16.995  22.063
 1093   HH22  ARG 134          HH22      ARG 134 -17.613 -17.814  22.232
 1094    H    GLN 135           H        GLN 135 -13.540 -15.956  15.532
 1095    HA   GLN 135           HA       GLN 135 -16.320 -15.210  15.121
 1096    HB2  GLN 135           HB2      GLN 135 -13.811 -13.565  15.448
 1097    HB3  GLN 135           HB3      GLN 135 -15.386 -12.845  15.173
 1098    HG2  GLN 135           HG2      GLN 135 -14.760 -14.765  17.436
 1099    HG3  GLN 135           HG3      GLN 135 -14.728 -13.012  17.612
 1100   HE21  GLN 135          HE22      GLN 135 -16.503 -15.274  18.838
 1101   HE22  GLN 135          HE21      GLN 135 -18.126 -14.693  18.562
 1102    H    VAL 136           H        VAL 136 -13.422 -15.592  13.108
 1103    HA   VAL 136           HA       VAL 136 -14.559 -13.869  11.005
 1104    HB   VAL 136           HB       VAL 136 -12.247 -14.141  10.067
 1105   HG11  VAL 136          HG11      VAL 136 -13.021 -12.151  11.359
 1106   HG12  VAL 136          HG12      VAL 136 -12.444 -12.921  12.850
 1107   HG13  VAL 136          HG13      VAL 136 -11.294 -12.484  11.562
 1108   HG21  VAL 136          HG21      VAL 136 -10.433 -14.915  11.374
 1109   HG22  VAL 136          HG22      VAL 136 -11.443 -15.147  12.818
 1110   HG23  VAL 136          HG23      VAL 136 -11.640 -16.213  11.408
 1111    H    VAL 137           H        VAL 137 -14.403 -14.436   8.746
 1112    HA   VAL 137           HA       VAL 137 -15.562 -17.016   8.187
 1113    HB   VAL 137           HB       VAL 137 -15.937 -16.275   6.052
 1114   HG11  VAL 137          HG11      VAL 137 -15.609 -13.557   7.372
 1115   HG12  VAL 137          HG12      VAL 137 -16.687 -14.008   6.048
 1116   HG13  VAL 137          HG13      VAL 137 -16.974 -14.668   7.667
 1117   HG21  VAL 137          HG21      VAL 137 -13.338 -14.714   6.254
 1118   HG22  VAL 137          HG22      VAL 137 -13.797 -16.049   5.161
 1119   HG23  VAL 137          HG23      VAL 137 -14.519 -14.442   4.934
 1120    H    SER 138           H        SER 138 -14.577 -18.446   6.421
 1121    HA   SER 138           HA       SER 138 -12.439 -19.728   7.560
 1122    HB2  SER 138           HB2      SER 138 -13.493 -19.814   4.714
 1123    HB3  SER 138           HB3      SER 138 -12.569 -21.123   5.506
 1124    HG   SER 138           HG       SER 138 -14.934 -21.344   5.602
 1125    H    PHE 139           H        PHE 139 -12.120 -17.568   4.613
 1126    HA   PHE 139           HA       PHE 139  -9.383 -18.339   4.320
 1127    HB2  PHE 139           HB2      PHE 139  -9.197 -16.640   2.646
 1128    HB3  PHE 139           HB3      PHE 139 -10.681 -17.537   2.450
 1129    HD1  PHE 139           HD2      PHE 139  -9.222 -14.263   3.427
 1130    HD2  PHE 139           HD1      PHE 139 -12.857 -16.420   2.561
 1131    HE1  PHE 139           HE2      PHE 139 -10.454 -12.121   3.223
 1132    HE2  PHE 139           HE1      PHE 139 -14.072 -14.278   2.343
 1133    HZ   PHE 139           HZ       PHE 139 -12.881 -12.125   2.696
 1134    H    LYS 140           H        LYS 140 -10.899 -15.708   6.143
 1135    HA   LYS 140           HA       LYS 140  -8.326 -14.517   6.951
 1136    HB2  LYS 140           HB2      LYS 140 -11.227 -14.160   7.788
 1137    HB3  LYS 140           HB3      LYS 140  -9.898 -13.391   8.677
 1138    HG2  LYS 140           HG2      LYS 140  -9.230 -12.065   6.858
 1139    HG3  LYS 140           HG3      LYS 140 -10.049 -13.076   5.673
 1140    HD2  LYS 140           HD2      LYS 140 -11.139 -10.863   6.051
 1141    HD3  LYS 140           HD3      LYS 140 -12.207 -12.261   6.261
 1142    HE2  LYS 140           HE2      LYS 140 -12.015 -12.131   8.696
 1143    HE3  LYS 140           HE3      LYS 140 -10.795 -10.848   8.573
 1144    HZ1  LYS 140           HZ1      LYS 140 -12.988  -9.892   9.045
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.486  -9.389   7.577
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.634 -10.549   7.688
 1147    H    ARG 141           H        ARG 141 -10.823 -16.599   8.548
 1148    HA   ARG 141           HA       ARG 141  -9.592 -17.220  10.869
 1149    HB2  ARG 141           HB2      ARG 141 -11.804 -18.081   9.711
 1150    HB3  ARG 141           HB3      ARG 141 -10.807 -19.429   9.126
 1151    HG2  ARG 141           HG2      ARG 141 -10.272 -19.988  11.451
 1152    HG3  ARG 141           HG3      ARG 141 -11.045 -18.466  11.937
 1153    HD2  ARG 141           HD2      ARG 141 -12.601 -20.274  12.441
 1154    HD3  ARG 141           HD3      ARG 141 -13.231 -19.298  11.118
 1155    HE   ARG 141           HE       ARG 141 -11.875 -21.959  10.828
 1156   HH11  ARG 141          HH11      ARG 141 -14.490 -19.761   9.796
 1157   HH12  ARG 141          HH12      ARG 141 -14.825 -20.665   8.343
 1158   HH21  ARG 141          HH21      ARG 141 -12.510 -23.243   9.013
 1159   HH22  ARG 141          HH22      ARG 141 -13.796 -22.719   7.986
 1160    H    ASP 142           H        ASP 142  -8.674 -18.735   7.703
 1161    HA   ASP 142           HA       ASP 142  -6.852 -20.504   8.929
 1162    HB2  ASP 142           HB2      ASP 142  -7.621 -20.770   6.596
 1163    HB3  ASP 142           HB3      ASP 142  -6.594 -19.380   6.150
 1164    H    VAL 143           H        VAL 143  -6.343 -17.180   7.747
 1165    HA   VAL 143           HA       VAL 143  -3.541 -17.155   8.464
 1166    HB   VAL 143           HB       VAL 143  -5.583 -14.884   8.202
 1167   HG11  VAL 143          HG11      VAL 143  -3.759 -14.115   9.675
 1168   HG12  VAL 143          HG12      VAL 143  -2.560 -14.699   8.496
 1169   HG13  VAL 143          HG13      VAL 143  -3.658 -13.356   8.098
 1170   HG21  VAL 143          HG21      VAL 143  -5.141 -16.053   6.075
 1171   HG22  VAL 143          HG22      VAL 143  -4.413 -14.447   6.061
 1172   HG23  VAL 143          HG23      VAL 143  -3.394 -15.882   6.321
 1173    H    TYR 144           H        TYR 144  -6.523 -16.086  10.279
 1174    HA   TYR 144           HA       TYR 144  -4.994 -15.269  12.508
 1175    HB2  TYR 144           HB2      TYR 144  -7.932 -15.903  12.175
 1176    HB3  TYR 144           HB3      TYR 144  -7.266 -15.339  13.694
 1177    HD1  TYR 144           HD1      TYR 144  -5.386 -13.655  11.130
 1178    HD2  TYR 144           HD2      TYR 144  -9.203 -13.642  13.139
 1179    HE1  TYR 144           HE1      TYR 144  -5.722 -11.332  10.448
 1180    HE2  TYR 144           HE2      TYR 144  -9.549 -11.280  12.433
 1181    HH   TYR 144           HH       TYR 144  -8.754  -9.542  11.050
 1182    H    ARG 145           H        ARG 145  -6.328 -18.557  11.897
 1183    HA   ARG 145           HA       ARG 145  -5.467 -19.500  14.498
 1184    HB2  ARG 145           HB2      ARG 145  -5.726 -21.745  13.675
 1185    HB3  ARG 145           HB3      ARG 145  -7.064 -20.747  13.097
 1186    HG2  ARG 145           HG2      ARG 145  -5.746 -20.455  10.957
 1187    HG3  ARG 145           HG3      ARG 145  -4.683 -21.762  11.494
 1188    HD2  ARG 145           HD2      ARG 145  -7.690 -22.056  11.290
 1189    HD3  ARG 145           HD3      ARG 145  -6.635 -22.235   9.895
 1190    HE   ARG 145           HE       ARG 145  -6.671 -23.999  12.277
 1191   HH11  ARG 145          HH11      ARG 145  -5.546 -23.464   8.864
 1192   HH12  ARG 145          HH12      ARG 145  -4.981 -25.086   8.724
 1193   HH21  ARG 145          HH21      ARG 145  -5.880 -26.115  11.992
 1194   HH22  ARG 145          HH22      ARG 145  -5.161 -26.611  10.502
 1195    H    ARG 146           H        ARG 146  -3.693 -19.336  11.289
 1196    HA   ARG 146           HA       ARG 146  -1.310 -20.467  12.348
 1197    HB2  ARG 146           HB2      ARG 146  -1.997 -18.704   9.959
 1198    HB3  ARG 146           HB3      ARG 146  -0.319 -18.795  10.491
 1199    HG2  ARG 146           HG2      ARG 146  -0.366 -20.464   8.941
 1200    HG3  ARG 146           HG3      ARG 146  -0.558 -21.329  10.461
 1201    HD2  ARG 146           HD2      ARG 146  -3.083 -21.339   9.956
 1202    HD3  ARG 146           HD3      ARG 146  -2.660 -20.758   8.343
 1203    HE   ARG 146           HE       ARG 146  -1.655 -23.298   9.614
 1204   HH11  ARG 146          HH21      ARG 146  -3.103 -21.854   6.674
 1205   HH12  ARG 146          HH22      ARG 146  -2.427 -23.047   5.628
 1206   HH21  ARG 146          HH11      ARG 146  -0.955 -24.961   8.222
 1207   HH22  ARG 146          HH12      ARG 146  -1.328 -24.921   6.544
 1208    H    VAL 147           H        VAL 147  -2.375 -17.018  12.286
 1209    HA   VAL 147           HA       VAL 147  -0.110 -15.886  13.433
 1210    HB   VAL 147           HB       VAL 147  -3.053 -15.132  13.692
 1211   HG11  VAL 147          HG11      VAL 147  -1.864 -13.916  15.449
 1212   HG12  VAL 147          HG12      VAL 147  -0.631 -13.386  14.282
 1213   HG13  VAL 147          HG13      VAL 147  -2.313 -12.818  14.153
 1214   HG21  VAL 147          HG21      VAL 147  -0.826 -14.105  11.902
 1215   HG22  VAL 147          HG22      VAL 147  -2.154 -15.120  11.370
 1216   HG23  VAL 147          HG23      VAL 147  -2.505 -13.493  11.924
 1217    H    MET 148           H        MET 148  -2.609 -17.790  15.041
 1218    HA   MET 148           HA       MET 148  -1.727 -16.978  17.701
 1219    HB2  MET 148           HB2      MET 148  -3.860 -18.941  16.811
 1220    HB3  MET 148           HB3      MET 148  -3.463 -18.594  18.501
 1221    HG2  MET 148           HG2      MET 148  -4.433 -16.516  16.497
 1222    HG3  MET 148           HG3      MET 148  -5.459 -17.407  17.605
 1223    HE1  MET 148           HE1      MET 148  -3.295 -13.558  18.385
 1224    HE2  MET 148           HE2      MET 148  -2.208 -14.821  17.752
 1225    HE3  MET 148           HE3      MET 148  -3.674 -14.360  16.850
 1226    H    LYS 149           H        LYS 149  -1.915 -20.075  15.828
 1227    HA   LYS 149           HA       LYS 149  -0.413 -21.567  17.723
 1228    HB2  LYS 149           HB2      LYS 149  -1.852 -22.655  16.339
 1229    HB3  LYS 149           HB3      LYS 149  -1.158 -21.999  14.845
 1230    HG2  LYS 149           HG2      LYS 149   0.490 -23.781  16.639
 1231    HG3  LYS 149           HG3      LYS 149  -0.702 -24.485  15.537
 1232    HD2  LYS 149           HD2      LYS 149   0.403 -23.819  13.604
 1233    HD3  LYS 149           HD3      LYS 149   1.112 -22.401  14.375
 1234    HE2  LYS 149           HE2      LYS 149   2.919 -23.819  13.984
 1235    HE3  LYS 149           HE3      LYS 149   2.573 -23.851  15.730
 1236    HZ1  LYS 149           HZ1      LYS 149   3.026 -26.084  14.841
 1237    HZ2  LYS 149           HZ2      LYS 149   1.498 -26.028  15.401
 1238    HZ3  LYS 149           HZ3      LYS 149   1.790 -25.975  13.786
 1239    H    GLU 150           H        GLU 150   0.809 -19.559  15.040
 1240    HA   GLU 150           HA       GLU 150   3.397 -20.463  14.989
 1241    HB2  GLU 150           HB2      GLU 150   1.997 -17.835  14.505
 1242    HB3  GLU 150           HB3      GLU 150   3.757 -17.788  14.577
 1243    HG2  GLU 150           HG2      GLU 150   2.346 -19.701  12.757
 1244    HG3  GLU 150           HG3      GLU 150   2.758 -18.018  12.373
 1245    H    PHE 151           H        PHE 151   1.890 -18.217  17.258
 1246    HA   PHE 151           HA       PHE 151   4.480 -17.835  18.702
 1247    HB2  PHE 151           HB2      PHE 151   2.060 -16.081  18.938
 1248    HB3  PHE 151           HB3      PHE 151   3.750 -15.740  19.300
 1249    HD1  PHE 151           HD1      PHE 151   5.021 -16.687  16.563
 1250    HD2  PHE 151           HD2      PHE 151   1.535 -14.287  17.508
 1251    HE1  PHE 151           HE1      PHE 151   5.090 -15.687  14.392
 1252    HE2  PHE 151           HE2      PHE 151   1.760 -13.146  15.341
 1253    HZ   PHE 151           HZ       PHE 151   3.552 -13.861  13.748
 1254    H    ALA 152           H        ALA 152   1.411 -19.373  19.008
 1255    HA   ALA 152           HA       ALA 152   0.702 -19.131  21.658
 1256    HB1  ALA 152           HB1      ALA 152  -0.320 -21.402  21.357
 1257    HB2  ALA 152           HB2      ALA 152  -0.632 -20.372  19.954
 1258    HB3  ALA 152           HB3      ALA 152   0.621 -21.625  19.866
 1259    H    SER 153           H        SER 153   3.169 -21.257  20.250
 1260    HA   SER 153           HA       SER 153   3.729 -22.737  22.603
 1261    HB2  SER 153           HB2      SER 153   5.620 -22.134  20.297
 1262    HB3  SER 153           HB3      SER 153   5.652 -23.549  21.371
 1263    HG   SER 153           HG       SER 153   4.639 -24.062  19.378
 1264    H    VAL 154           H        VAL 154   4.863 -19.564  21.476
 1265    HA   VAL 154           HA       VAL 154   6.947 -19.343  23.523
 1266    HB   VAL 154           HB       VAL 154   5.575 -17.201  21.846
 1267   HG11  VAL 154          HG11      VAL 154   7.466 -15.781  22.446
 1268   HG12  VAL 154          HG12      VAL 154   6.563 -16.243  23.904
 1269   HG13  VAL 154          HG13      VAL 154   8.108 -17.043  23.521
 1270   HG21  VAL 154          HG21      VAL 154   7.741 -17.233  20.551
 1271   HG22  VAL 154          HG22      VAL 154   8.219 -18.674  21.460
 1272   HG23  VAL 154          HG23      VAL 154   6.807 -18.724  20.377
 1273    H    VAL 155           H        VAL 155   3.528 -18.323  23.082
 1274    HA   VAL 155           HA       VAL 155   3.411 -16.809  25.436
 1275    HB   VAL 155           HB       VAL 155   1.102 -18.340  24.178
 1276   HG11  VAL 155          HG11      VAL 155  -0.202 -16.396  25.250
 1277   HG12  VAL 155          HG12      VAL 155   0.486 -17.563  26.392
 1278   HG13  VAL 155          HG13      VAL 155   1.307 -16.012  26.152
 1279   HG21  VAL 155          HG21      VAL 155   0.604 -16.088  23.116
 1280   HG22  VAL 155          HG22      VAL 155   2.229 -15.571  23.630
 1281   HG23  VAL 155          HG23      VAL 155   2.025 -16.896  22.476
 1282    H    MET 156           H        MET 156   2.811 -20.400  25.090
 1283    HA   MET 156           HA       MET 156   1.799 -20.812  27.606
 1284    HB2  MET 156           HB2      MET 156   3.897 -22.541  26.167
 1285    HB3  MET 156           HB3      MET 156   2.849 -23.104  27.476
 1286    HG2  MET 156           HG2      MET 156   2.025 -22.293  24.680
 1287    HG3  MET 156           HG3      MET 156   1.966 -23.898  25.370
 1288    HE1  MET 156           HE1      MET 156  -0.378 -22.940  23.766
 1289    HE2  MET 156           HE2      MET 156  -1.686 -22.058  24.583
 1290    HE3  MET 156           HE3      MET 156  -0.201 -21.205  24.130
 1291    H    SER 157           H        SER 157   5.189 -20.845  26.617
 1292    HA   SER 157           HA       SER 157   6.262 -21.235  29.231
 1293    HB2  SER 157           HB2      SER 157   7.265 -20.575  26.455
 1294    HB3  SER 157           HB3      SER 157   8.408 -20.759  27.830
 1295    HG   SER 157           HG       SER 157   8.087 -22.730  26.647
 1296    H    LEU 158           H        LEU 158   5.457 -18.384  27.315
 1297    HA   LEU 158           HA       LEU 158   6.936 -16.442  28.739
 1298    HB2  LEU 158           HB2      LEU 158   5.701 -16.185  26.509
 1299    HB3  LEU 158           HB3      LEU 158   4.179 -16.216  27.412
 1300    HG   LEU 158           HG       LEU 158   4.941 -14.166  28.657
 1301   HD11  LEU 158          HD11      LEU 158   7.363 -14.349  28.207
 1302   HD12  LEU 158          HD12      LEU 158   7.074 -14.166  26.474
 1303   HD13  LEU 158          HD13      LEU 158   6.721 -12.814  27.594
 1304   HD21  LEU 158          HD21      LEU 158   4.400 -12.775  26.514
 1305   HD22  LEU 158          HD22      LEU 158   4.416 -14.324  25.675
 1306   HD23  LEU 158          HD23      LEU 158   3.278 -14.084  27.027
 1307    H    GLN 159           H        GLN 159   3.706 -17.849  29.295
 1308    HA   GLN 159           HA       GLN 159   3.011 -16.333  31.615
 1309    HB2  GLN 159           HB2      GLN 159   2.278 -19.266  31.242
 1310    HB3  GLN 159           HB3      GLN 159   1.443 -18.036  32.169
 1311    HG2  GLN 159           HG2      GLN 159   0.971 -16.872  29.883
 1312    HG3  GLN 159           HG3      GLN 159   1.560 -18.378  29.169
 1313   HE21  GLN 159          HE22      GLN 159  -0.758 -17.493  31.806
 1314   HE22  GLN 159          HE21      GLN 159  -1.943 -18.722  31.353
 1315    H    GLU 160           H        GLU 160   4.805 -19.382  31.261
 1316    HA   GLU 160           HA       GLU 160   4.994 -19.963  34.002
 1317    HB2  GLU 160           HB2      GLU 160   6.638 -20.944  31.623
 1318    HB3  GLU 160           HB3      GLU 160   6.753 -21.625  33.248
 1319    HG2  GLU 160           HG2      GLU 160   4.313 -22.119  33.229
 1320    HG3  GLU 160           HG3      GLU 160   4.231 -21.546  31.566
 1321    H    ASN 161           H        ASN 161   6.963 -17.866  32.053
 1322    HA   ASN 161           HA       ASN 161   9.375 -18.193  33.713
 1323    HB2  ASN 161           HB2      ASN 161   8.632 -16.754  31.170
 1324    HB3  ASN 161           HB3      ASN 161  10.002 -16.166  32.100
 1325   HD21  ASN 161          HD22      ASN 161   8.724 -19.236  30.668
 1326   HD22  ASN 161          HD21      ASN 161  10.312 -19.946  30.410
 1327    H    THR 162           H        THR 162   6.482 -16.380  33.944
 1328    HA   THR 162           HA       THR 162   5.876 -14.355  34.628
 1329    HB   THR 162           HB       THR 162   6.091 -14.287  36.938
 1330    HG1  THR 162           HG1      THR 162   8.399 -14.683  37.159
 1331   HG21  THR 162          HG21      THR 162   6.220 -17.197  36.116
 1332   HG22  THR 162          HG22      THR 162   5.394 -16.522  37.546
 1333   HG23  THR 162          HG23      THR 162   4.812 -16.133  35.912
 1334    HA   PRO 163           HA       PRO 163   9.833 -12.686  33.291
 1335    HB2  PRO 163           HB2      PRO 163   8.327 -11.206  31.144
 1336    HB3  PRO 163           HB3      PRO 163   9.828 -12.163  31.020
 1337    HG2  PRO 163           HG2      PRO 163   7.418 -13.149  30.185
 1338    HG3  PRO 163           HG3      PRO 163   8.608 -14.211  31.020
 1339    HD2  PRO 163           HD2      PRO 163   6.253 -12.729  32.224
 1340    HD3  PRO 163           HD3      PRO 163   6.667 -14.445  32.371
 1341    H    LYS 164           H        LYS 164  10.432 -10.199  32.495
 1342    HA   LYS 164           HA       LYS 164   9.297  -8.355  34.528
 1343    HB2  LYS 164           HB2      LYS 164  11.724  -7.944  32.754
 1344    HB3  LYS 164           HB3      LYS 164  11.289  -7.056  34.209
 1345    HG2  LYS 164           HG2      LYS 164  12.219  -9.960  34.039
 1346    HG3  LYS 164           HG3      LYS 164  13.164  -8.594  34.615
 1347    HD2  LYS 164           HD2      LYS 164  11.724  -8.310  36.560
 1348    HD3  LYS 164           HD3      LYS 164  10.604  -9.562  35.973
 1349    HE2  LYS 164           HE2      LYS 164  12.374 -11.260  36.090
 1350    HE3  LYS 164           HE3      LYS 164  13.544 -10.044  36.624
 1351    HZ1  LYS 164           HZ1      LYS 164  12.665 -11.301  38.487
 1352    HZ2  LYS 164           HZ2      LYS 164  12.219  -9.742  38.641
 1353    HZ3  LYS 164           HZ3      LYS 164  11.130 -10.864  38.148
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1  -0.069   0.143  -2.213
    2    H2   MET   1           H2       MET   1   0.829  -0.593  -1.071
    3    H3   MET   1           H3       MET   1   1.296   0.866  -1.672
    4    HA   MET   1           HA       MET   1   1.630  -0.075  -3.865
    5    HB2  MET   1           HB2      MET   1   3.689  -1.213  -3.510
    6    HB3  MET   1           HB3      MET   1   3.592   0.039  -2.297
    7    HG2  MET   1           HG2      MET   1   3.275  -1.506  -0.535
    8    HG3  MET   1           HG3      MET   1   2.761  -2.808  -1.598
    9    HE1  MET   1           HE1      MET   1   5.996  -4.300  -3.065
   10    HE2  MET   1           HE2      MET   1   4.228  -4.413  -2.947
   11    HE3  MET   1           HE3      MET   1   4.979  -3.106  -3.894
   12    H    ILE   2           H        ILE   2   1.907  -2.060  -5.192
   13    HA   ILE   2           HA       ILE   2   0.661  -4.545  -4.160
   14    HB   ILE   2           HB       ILE   2   0.083  -3.244  -6.832
   15   HG12  ILE   2          HG12      ILE   2  -1.321  -3.334  -4.273
   16   HG13  ILE   2          HG13      ILE   2  -1.632  -2.346  -5.698
   17   HG21  ILE   2          HG21      ILE   2   0.448  -5.673  -7.138
   18   HG22  ILE   2          HG22      ILE   2  -0.787  -5.992  -5.885
   19   HG23  ILE   2          HG23      ILE   2  -1.208  -5.201  -7.426
   20   HD11  ILE   2          HD11      ILE   2  -3.045  -4.303  -6.550
   21   HD12  ILE   2          HD12      ILE   2  -2.717  -5.070  -4.949
   22   HD13  ILE   2          HD13      ILE   2  -3.593  -3.525  -5.081
   23    H    ASP   3           H        ASP   3   1.829  -6.396  -4.975
   24    HA   ASP   3           HA       ASP   3   4.590  -5.870  -5.349
   25    HB2  ASP   3           HB2      ASP   3   3.773  -7.843  -4.141
   26    HB3  ASP   3           HB3      ASP   3   3.063  -8.456  -5.646
   27    H    ASP   4           H        ASP   4   2.414  -7.755  -7.454
   28    HA   ASP   4           HA       ASP   4   3.109  -6.290  -9.804
   29    HB2  ASP   4           HB2      ASP   4   5.143  -7.666  -9.688
   30    HB3  ASP   4           HB3      ASP   4   4.157  -9.113  -9.477
   31    H    ASP   5           H        ASP   5   1.979  -9.487  -8.727
   32    HA   ASP   5           HA       ASP   5   0.140  -9.654 -10.953
   33    HB2  ASP   5           HB2      ASP   5   1.732 -11.470 -10.347
   34    HB3  ASP   5           HB3      ASP   5   0.796 -11.752  -8.881
   35    H    GLY   6           H        GLY   6  -0.386  -7.927  -8.510
   36    HA2  GLY   6           HA2      GLY   6  -2.457  -7.094  -7.787
   37    HA3  GLY   6           HA3      GLY   6  -3.252  -8.596  -8.245
   38    H    TYR   7           H        TYR   7  -0.457  -9.296  -6.424
   39    HA   TYR   7           HA       TYR   7  -1.999  -9.465  -3.886
   40    HB2  TYR   7           HB2      TYR   7   0.605 -10.844  -4.665
   41    HB3  TYR   7           HB3      TYR   7  -0.247 -11.016  -3.134
   42    HD1  TYR   7           HD1      TYR   7  -2.396 -12.233  -2.990
   43    HD2  TYR   7           HD2      TYR   7  -0.210 -11.971  -6.695
   44    HE1  TYR   7           HE1      TYR   7  -3.842 -13.997  -3.967
   45    HE2  TYR   7           HE2      TYR   7  -1.628 -13.741  -7.667
   46    HH   TYR   7           HH       TYR   7  -3.435 -15.185  -7.345
   47    H    ARG   8           H        ARG   8  -0.885  -8.613  -1.937
   48    HA   ARG   8           HA       ARG   8   1.457  -6.899  -2.526
   49    HB2  ARG   8           HB2      ARG   8   0.567  -4.979  -1.346
   50    HB3  ARG   8           HB3      ARG   8  -0.470  -5.391  -2.724
   51    HG2  ARG   8           HG2      ARG   8  -1.327  -6.538  -0.085
   52    HG3  ARG   8           HG3      ARG   8  -1.413  -4.782  -0.260
   53    HD2  ARG   8           HD2      ARG   8  -2.704  -4.965  -2.296
   54    HD3  ARG   8           HD3      ARG   8  -2.540  -6.718  -2.298
   55    HE   ARG   8           HE       ARG   8  -4.127  -6.981  -0.667
   56   HH11  ARG   8          HH21      ARG   8  -3.577  -3.463  -1.056
   57   HH12  ARG   8          HH22      ARG   8  -4.903  -3.026  -0.044
   58   HH21  ARG   8          HH11      ARG   8  -5.748  -6.386   0.788
   59   HH22  ARG   8          HH12      ARG   8  -6.201  -4.718   0.995
   60    HA   PRO   9           HA       PRO   9   2.702  -8.828   1.262
   61    HB2  PRO   9           HB2      PRO   9   4.980  -7.471   1.879
   62    HB3  PRO   9           HB3      PRO   9   4.833  -8.487   0.424
   63    HG2  PRO   9           HG2      PRO   9   4.569  -5.465   0.607
   64    HG3  PRO   9           HG3      PRO   9   5.489  -6.434  -0.574
   65    HD2  PRO   9           HD2      PRO   9   2.969  -5.414  -0.984
   66    HD3  PRO   9           HD3      PRO   9   3.593  -6.883  -1.797
   67    H    ASN  10           H        ASN  10   2.216  -8.672   3.497
   68    HA   ASN  10           HA       ASN  10   1.519  -6.014   4.632
   69    HB2  ASN  10           HB2      ASN  10  -0.434  -6.969   3.396
   70    HB3  ASN  10           HB3      ASN  10  -0.281  -8.457   4.305
   71   HD21  ASN  10          HD22      ASN  10  -1.819  -5.356   4.227
   72   HD22  ASN  10          HD21      ASN  10  -2.506  -5.459   5.827
   73    H    VAL  11           H        VAL  11   1.157  -6.170   7.044
   74    HA   VAL  11           HA       VAL  11   2.196  -8.603   8.256
   75    HB   VAL  11           HB       VAL  11   3.767  -7.464   9.733
   76   HG11  VAL  11          HG11      VAL  11   4.613  -8.334   7.623
   77   HG12  VAL  11          HG12      VAL  11   4.471  -6.694   6.978
   78   HG13  VAL  11          HG13      VAL  11   5.563  -7.013   8.338
   79   HG21  VAL  11          HG21      VAL  11   2.774  -5.237   9.927
   80   HG22  VAL  11          HG22      VAL  11   4.428  -5.116   9.325
   81   HG23  VAL  11          HG23      VAL  11   3.061  -4.910   8.200
   82    H    GLY  12           H        GLY  12   1.685  -8.702  10.591
   83    HA2  GLY  12           HA2      GLY  12  -0.330  -6.727  11.506
   84    HA3  GLY  12           HA3      GLY  12  -0.778  -8.424  11.453
   85    H    ILE  13           H        ILE  13  -0.679  -6.761  13.794
   86    HA   ILE  13           HA       ILE  13   1.699  -7.749  15.306
   87    HB   ILE  13           HB       ILE  13   0.044  -5.207  15.473
   88   HG12  ILE  13          HG12      ILE  13   2.939  -4.816  15.343
   89   HG13  ILE  13          HG13      ILE  13   2.385  -5.759  13.951
   90   HG21  ILE  13          HG21      ILE  13   1.556  -4.523  17.304
   91   HG22  ILE  13          HG22      ILE  13   0.558  -5.897  17.741
   92   HG23  ILE  13          HG23      ILE  13   2.276  -6.161  17.308
   93   HD11  ILE  13          HD11      ILE  13   0.704  -4.006  13.439
   94   HD12  ILE  13          HD12      ILE  13   1.290  -3.069  14.834
   95   HD13  ILE  13          HD13      ILE  13   2.364  -3.375  13.453
   96    H    VAL  14           H        VAL  14   1.328  -8.793  17.186
   97    HA   VAL  14           HA       VAL  14  -1.399  -8.765  18.405
   98    HB   VAL  14           HB       VAL  14   0.560 -11.106  18.251
   99   HG11  VAL  14          HG11      VAL  14  -1.188 -12.427  19.321
  100   HG12  VAL  14          HG12      VAL  14  -0.781 -11.073  20.357
  101   HG13  VAL  14          HG13      VAL  14  -2.268 -11.004  19.384
  102   HG21  VAL  14          HG21      VAL  14  -1.262 -12.195  16.907
  103   HG22  VAL  14          HG22      VAL  14  -2.034 -10.609  16.750
  104   HG23  VAL  14          HG23      VAL  14  -0.407 -10.884  16.079
  105    H    ILE  15           H        ILE  15  -1.271  -8.364  20.682
  106    HA   ILE  15           HA       ILE  15   1.453  -8.371  21.832
  107    HB   ILE  15           HB       ILE  15  -0.696  -6.542  22.918
  108   HG12  ILE  15          HG12      ILE  15  -0.279  -5.743  20.617
  109   HG13  ILE  15          HG13      ILE  15   0.274  -4.629  21.858
  110   HG21  ILE  15          HG21      ILE  15   1.137  -7.138  24.448
  111   HG22  ILE  15          HG22      ILE  15   2.343  -6.688  23.227
  112   HG23  ILE  15          HG23      ILE  15   1.299  -5.453  23.939
  113   HD11  ILE  15          HD11      ILE  15   2.139  -6.561  20.431
  114   HD12  ILE  15          HD12      ILE  15   1.856  -4.877  19.927
  115   HD13  ILE  15          HD13      ILE  15   2.582  -5.213  21.510
  116    H    CYS  16           H        CYS  16   1.624  -9.537  23.835
  117    HA   CYS  16           HA       CYS  16  -0.966 -10.510  24.963
  118    HB2  CYS  16           HB2      CYS  16   0.124 -12.557  25.720
  119    HB3  CYS  16           HB3      CYS  16   0.188 -12.423  23.954
  120    HG   CYS  16           HG       CYS  16   2.439 -13.468  24.869
  121    H    ASN  17           H        ASN  17  -1.099 -10.769  27.207
  122    HA   ASN  17           HA       ASN  17   0.975  -9.339  28.807
  123    HB2  ASN  17           HB2      ASN  17  -0.684  -8.571  30.310
  124    HB3  ASN  17           HB3      ASN  17  -1.243  -8.180  28.694
  125   HD21  ASN  17          HD22      ASN  17  -3.257  -7.941  30.268
  126   HD22  ASN  17          HD21      ASN  17  -4.252  -9.366  30.401
  127    H    ARG  18           H        ARG  18   0.945 -10.343  31.243
  128    HA   ARG  18           HA       ARG  18   1.491 -13.168  30.809
  129    HB2  ARG  18           HB2      ARG  18   1.737 -11.439  33.288
  130    HB3  ARG  18           HB3      ARG  18   1.987 -13.189  33.314
  131    HG2  ARG  18           HG2      ARG  18   4.074 -12.901  32.685
  132    HG3  ARG  18           HG3      ARG  18   3.467 -12.446  31.097
  133    HD2  ARG  18           HD2      ARG  18   3.383 -10.099  31.770
  134    HD3  ARG  18           HD3      ARG  18   4.044 -10.499  33.363
  135    HE   ARG  18           HE       ARG  18   5.446 -10.315  30.802
  136   HH11  ARG  18          HH11      ARG  18   5.760 -11.668  34.091
  137   HH12  ARG  18          HH12      ARG  18   7.446 -12.006  33.912
  138   HH21  ARG  18          HH21      ARG  18   7.607 -10.800  30.567
  139   HH22  ARG  18          HH22      ARG  18   8.490 -11.632  31.815
  140    H    GLN  19           H        GLN  19  -1.430 -11.782  31.175
  141    HA   GLN  19           HA       GLN  19  -2.595 -13.992  32.718
  142    HB2  GLN  19           HB2      GLN  19  -4.147 -11.811  31.321
  143    HB3  GLN  19           HB3      GLN  19  -4.673 -12.829  32.653
  144    HG2  GLN  19           HG2      GLN  19  -2.649 -10.566  32.708
  145    HG3  GLN  19           HG3      GLN  19  -4.260 -10.549  33.391
  146   HE21  GLN  19          HE22      GLN  19  -1.739 -10.008  34.837
  147   HE22  GLN  19          HE21      GLN  19  -1.619 -11.212  36.098
  148    H    GLY  20           H        GLY  20  -1.432 -13.575  29.590
  149    HA2  GLY  20           HA2      GLY  20  -1.672 -14.859  27.726
  150    HA3  GLY  20           HA3      GLY  20  -2.882 -15.864  28.546
  151    H    GLN  21           H        GLN  21  -3.365 -12.341  28.517
  152    HA   GLN  21           HA       GLN  21  -5.658 -12.737  26.693
  153    HB2  GLN  21           HB2      GLN  21  -4.889 -10.281  28.305
  154    HB3  GLN  21           HB3      GLN  21  -6.345 -10.498  27.345
  155    HG2  GLN  21           HG2      GLN  21  -5.671 -12.158  29.810
  156    HG3  GLN  21           HG3      GLN  21  -6.706 -10.743  29.805
  157   HE21  GLN  21          HE22      GLN  21  -6.548 -14.192  29.142
  158   HE22  GLN  21          HE21      GLN  21  -8.189 -14.358  28.540
  159    H    VAL  22           H        VAL  22  -5.704 -11.606  24.729
  160    HA   VAL  22           HA       VAL  22  -3.159 -10.408  23.853
  161    HB   VAL  22           HB       VAL  22  -3.614 -11.185  21.619
  162   HG11  VAL  22          HG11      VAL  22  -2.336 -12.616  23.183
  163   HG12  VAL  22          HG12      VAL  22  -3.821 -13.473  23.636
  164   HG13  VAL  22          HG13      VAL  22  -3.201 -13.567  21.959
  165   HG21  VAL  22          HG21      VAL  22  -6.063 -11.191  21.530
  166   HG22  VAL  22          HG22      VAL  22  -5.427 -12.780  21.093
  167   HG23  VAL  22          HG23      VAL  22  -6.146 -12.524  22.700
  168    H    MET  23           H        MET  23  -3.261  -8.574  22.539
  169    HA   MET  23           HA       MET  23  -5.414  -6.709  22.976
  170    HB2  MET  23           HB2      MET  23  -3.195  -5.902  22.574
  171    HB3  MET  23           HB3      MET  23  -3.020  -6.851  21.097
  172    HG2  MET  23           HG2      MET  23  -4.632  -5.468  19.916
  173    HG3  MET  23           HG3      MET  23  -4.957  -4.524  21.373
  174    HE1  MET  23           HE1      MET  23  -3.657  -2.459  22.037
  175    HE2  MET  23           HE2      MET  23  -2.605  -3.699  22.765
  176    HE3  MET  23           HE3      MET  23  -1.886  -2.348  21.867
  177    H    TRP  24           H        TRP  24  -7.230  -6.276  21.739
  178    HA   TRP  24           HA       TRP  24  -7.514  -7.398  19.014
  179    HB2  TRP  24           HB2      TRP  24  -8.415  -8.987  20.661
  180    HB3  TRP  24           HB3      TRP  24  -9.429  -7.725  21.352
  181    HD1  TRP  24           HD1      TRP  24 -11.794  -8.266  20.818
  182    HE1  TRP  24           HE1      TRP  24 -13.137  -9.275  18.908
  183    HE3  TRP  24           HE3      TRP  24  -7.975  -9.090  17.509
  184    HZ2  TRP  24           HZ2      TRP  24 -12.582 -10.532  16.352
  185    HZ3  TRP  24           HZ3      TRP  24  -8.399 -10.280  15.383
  186    HH2  TRP  24           HH2      TRP  24 -10.724 -10.991  14.806
  187    H    ALA  25           H        ALA  25  -8.823  -5.822  17.697
  188    HA   ALA  25           HA       ALA  25  -9.747  -3.424  19.193
  189    HB1  ALA  25           HB1      ALA  25  -7.332  -3.155  18.603
  190    HB2  ALA  25           HB2      ALA  25  -7.772  -3.313  16.891
  191    HB3  ALA  25           HB3      ALA  25  -8.389  -1.951  17.877
  192    H    ARG  26           H        ARG  26 -11.241  -2.109  18.183
  193    HA   ARG  26           HA       ARG  26 -12.851  -3.423  16.047
  194    HB2  ARG  26           HB2      ARG  26 -13.824  -3.088  18.346
  195    HB3  ARG  26           HB3      ARG  26 -13.679  -1.346  18.131
  196    HG2  ARG  26           HG2      ARG  26 -15.284  -1.376  16.293
  197    HG3  ARG  26           HG3      ARG  26 -15.211  -3.142  16.212
  198    HD2  ARG  26           HD2      ARG  26 -17.273  -2.611  17.286
  199    HD3  ARG  26           HD3      ARG  26 -16.181  -3.290  18.493
  200    HE   ARG  26           HE       ARG  26 -16.222  -0.337  18.351
  201   HH11  ARG  26          HH11      ARG  26 -17.819  -3.155  19.887
  202   HH12  ARG  26          HH12      ARG  26 -18.371  -2.231  21.234
  203   HH21  ARG  26          HH21      ARG  26 -16.998   0.811  19.980
  204   HH22  ARG  26          HH22      ARG  26 -17.904   0.119  21.317
  205    H    ARG  27           H        ARG  27 -12.634  -2.326  13.958
  206    HA   ARG  27           HA       ARG  27 -10.851  -0.017  14.152
  207    HB2  ARG  27           HB2      ARG  27 -10.496  -1.862  12.531
  208    HB3  ARG  27           HB3      ARG  27 -11.898  -1.315  11.625
  209    HG2  ARG  27           HG2      ARG  27 -10.801   0.939  11.355
  210    HG3  ARG  27           HG3      ARG  27  -9.454   0.345  12.347
  211    HD2  ARG  27           HD2      ARG  27  -9.148  -1.452  10.496
  212    HD3  ARG  27           HD3      ARG  27 -10.169  -0.401   9.509
  213    HE   ARG  27           HE       ARG  27  -8.542   1.330   9.648
  214   HH11  ARG  27          HH11      ARG  27  -7.243  -1.746  11.048
  215   HH12  ARG  27          HH12      ARG  27  -5.709  -1.009  11.419
  216   HH21  ARG  27          HH21      ARG  27  -6.506   2.231  10.350
  217   HH22  ARG  27          HH22      ARG  27  -5.277   1.123  10.906
  218    H    PHE  28           H        PHE  28 -11.230   2.077  13.275
  219    HA   PHE  28           HA       PHE  28 -13.549   3.159  14.376
  220    HB2  PHE  28           HB2      PHE  28 -11.388   4.286  14.042
  221    HB3  PHE  28           HB3      PHE  28 -11.680   4.363  12.309
  222    HD1  PHE  28           HD2      PHE  28 -13.192   5.367  15.622
  223    HD2  PHE  28           HD1      PHE  28 -12.645   6.352  11.452
  224    HE1  PHE  28           HE2      PHE  28 -14.244   7.584  16.001
  225    HE2  PHE  28           HE1      PHE  28 -13.671   8.574  11.845
  226    HZ   PHE  28           HZ       PHE  28 -14.488   9.187  14.116
  227    H    GLY  29           H        GLY  29 -15.558   3.444  13.690
  228    HA2  GLY  29           HA2      GLY  29 -17.395   3.691  12.382
  229    HA3  GLY  29           HA3      GLY  29 -16.350   3.873  10.971
  230    H    GLN  30           H        GLN  30 -15.428   0.891  12.251
  231    HA   GLN  30           HA       GLN  30 -16.970  -0.413  10.109
  232    HB2  GLN  30           HB2      GLN  30 -14.866  -1.656  11.920
  233    HB3  GLN  30           HB3      GLN  30 -15.495  -2.288  10.403
  234    HG2  GLN  30           HG2      GLN  30 -13.652   0.066  10.832
  235    HG3  GLN  30           HG3      GLN  30 -13.339  -1.421   9.962
  236   HE21  GLN  30          HE22      GLN  30 -14.167   1.859   9.543
  237   HE22  GLN  30          HE21      GLN  30 -14.768   1.748   7.898
  238    H    HIS  31           H        HIS  31 -16.828  -0.442  13.635
  239    HA   HIS  31           HA       HIS  31 -17.806  -1.672  15.244
  240    HB2  HIS  31           HB2      HIS  31 -20.185  -1.925  13.392
  241    HB3  HIS  31           HB3      HIS  31 -20.175  -2.021  15.150
  242    HD1  HIS  31           HD1      HIS  31 -20.351   0.532  12.361
  243    HD2  HIS  31           HD2      HIS  31 -19.631   0.354  16.509
  244    HE1  HIS  31           HE1      HIS  31 -20.557   2.917  13.225
  245    H    SER  32           H        SER  32 -16.050  -3.056  13.461
  246    HA   SER  32           HA       SER  32 -16.797  -5.847  14.045
  247    HB2  SER  32           HB2      SER  32 -15.727  -4.861  11.358
  248    HB3  SER  32           HB3      SER  32 -15.951  -6.557  11.826
  249    HG   SER  32           HG       SER  32 -17.722  -5.740  10.577
  250    H    TRP  33           H        TRP  33 -14.838  -7.197  14.274
  251    HA   TRP  33           HA       TRP  33 -12.661  -5.496  15.337
  252    HB2  TRP  33           HB2      TRP  33 -13.539  -8.302  16.027
  253    HB3  TRP  33           HB3      TRP  33 -12.201  -7.397  16.752
  254    HD1  TRP  33           HD1      TRP  33 -16.061  -7.252  16.560
  255    HE1  TRP  33           HE1      TRP  33 -16.945  -6.009  18.596
  256    HE3  TRP  33           HE3      TRP  33 -11.603  -5.955  18.670
  257    HZ2  TRP  33           HZ2      TRP  33 -15.831  -4.585  20.900
  258    HZ3  TRP  33           HZ3      TRP  33 -11.531  -4.595  20.742
  259    HH2  TRP  33           HH2      TRP  33 -13.643  -3.887  21.852
  260    H    GLN  34           H        GLN  34 -10.472  -6.189  15.306
  261    HA   GLN  34           HA       GLN  34  -9.523  -8.293  13.577
  262    HB2  GLN  34           HB2      GLN  34  -8.279  -6.746  12.026
  263    HB3  GLN  34           HB3      GLN  34 -10.018  -6.688  11.806
  264    HG2  GLN  34           HG2      GLN  34 -10.135  -4.561  13.090
  265    HG3  GLN  34           HG3      GLN  34  -8.395  -4.637  13.391
  266   HE21  GLN  34          HE22      GLN  34 -10.717  -4.699  10.572
  267   HE22  GLN  34          HE21      GLN  34  -9.690  -3.742   9.536
  268    H    PHE  35           H        PHE  35  -7.052  -8.166  13.504
  269    HA   PHE  35           HA       PHE  35  -5.947  -7.087  16.045
  270    HB2  PHE  35           HB2      PHE  35  -4.812  -8.817  13.832
  271    HB3  PHE  35           HB3      PHE  35  -3.866  -8.222  15.199
  272    HD1  PHE  35           HD2      PHE  35  -5.420  -8.726  17.559
  273    HD2  PHE  35           HD1      PHE  35  -4.933 -11.166  14.017
  274    HE1  PHE  35           HE2      PHE  35  -5.977 -10.744  18.873
  275    HE2  PHE  35           HE1      PHE  35  -5.389 -13.183  15.379
  276    HZ   PHE  35           HZ       PHE  35  -6.013 -12.975  17.776
  277    HA   PRO  36           HA       PRO  36  -4.497  -3.506  13.749
  278    HB2  PRO  36           HB2      PRO  36  -2.066  -2.954  14.984
  279    HB3  PRO  36           HB3      PRO  36  -3.673  -2.530  15.656
  280    HG2  PRO  36           HG2      PRO  36  -1.949  -4.926  16.322
  281    HG3  PRO  36           HG3      PRO  36  -2.848  -3.852  17.432
  282    HD2  PRO  36           HD2      PRO  36  -3.800  -6.282  16.649
  283    HD3  PRO  36           HD3      PRO  36  -4.902  -4.887  16.891
  284    H    GLN  37           H        GLN  37  -3.440  -3.253  11.785
  285    HA   GLN  37           HA       GLN  37  -1.179  -4.932  11.054
  286    HB2  GLN  37           HB2      GLN  37  -2.365  -6.294   9.397
  287    HB3  GLN  37           HB3      GLN  37  -3.052  -6.569  10.996
  288    HG2  GLN  37           HG2      GLN  37  -4.903  -4.927  10.399
  289    HG3  GLN  37           HG3      GLN  37  -4.213  -4.842   8.772
  290   HE21  GLN  37          HE22      GLN  37  -6.752  -5.524   8.696
  291   HE22  GLN  37          HE21      GLN  37  -6.966  -7.239   8.433
  292    H    GLY  38           H        GLY  38  -0.593  -4.654   8.684
  293    HA2  GLY  38           HA2      GLY  38  -1.905  -2.660   7.101
  294    HA3  GLY  38           HA3      GLY  38  -0.519  -1.949   7.925
  295    H    GLY  39           H        GLY  39  -0.434  -1.912   5.206
  296    HA2  GLY  39           HA2      GLY  39   0.730  -4.232   4.009
  297    HA3  GLY  39           HA3      GLY  39   0.621  -2.606   3.330
  298    H    ILE  40           H        ILE  40   2.805  -4.350   3.252
  299    HA   ILE  40           HA       ILE  40   4.946  -3.160   4.937
  300    HB   ILE  40           HB       ILE  40   4.927  -5.226   2.708
  301   HG12  ILE  40          HG12      ILE  40   5.888  -5.438   5.576
  302   HG13  ILE  40          HG13      ILE  40   4.211  -5.727   5.129
  303   HG21  ILE  40          HG21      ILE  40   7.034  -3.920   2.463
  304   HG22  ILE  40          HG22      ILE  40   7.399  -4.199   4.178
  305   HG23  ILE  40          HG23      ILE  40   7.356  -5.552   3.041
  306   HD11  ILE  40          HD11      ILE  40   6.414  -7.336   3.829
  307   HD12  ILE  40          HD12      ILE  40   5.770  -7.745   5.414
  308   HD13  ILE  40          HD13      ILE  40   4.675  -7.680   4.023
  309    H    ASN  41           H        ASN  41   5.895  -1.254   4.362
  310    HA   ASN  41           HA       ASN  41   4.904   0.157   2.011
  311    HB2  ASN  41           HB2      ASN  41   6.310   0.899   4.462
  312    HB3  ASN  41           HB3      ASN  41   7.229   1.465   3.072
  313   HD21  ASN  41          HD22      ASN  41   3.779   1.255   4.194
  314   HD22  ASN  41          HD21      ASN  41   3.339   2.844   3.611
  315    HA   PRO  42           HA       PRO  42   7.615  -1.603  -0.858
  316    HB2  PRO  42           HB2      PRO  42   8.387   0.443  -2.562
  317    HB3  PRO  42           HB3      PRO  42   6.783  -0.343  -2.575
  318    HG2  PRO  42           HG2      PRO  42   7.581   2.240  -1.210
  319    HG3  PRO  42           HG3      PRO  42   6.129   1.915  -2.213
  320    HD2  PRO  42           HD2      PRO  42   6.005   1.875   0.487
  321    HD3  PRO  42           HD3      PRO  42   5.100   0.667  -0.473
  322    H    GLY  43           H        GLY  43   9.649  -2.312  -0.503
  323    HA2  GLY  43           HA2      GLY  43  11.945  -2.255  -0.245
  324    HA3  GLY  43           HA3      GLY  43  11.908  -0.502  -0.044
  325    H    GLU  44           H        GLU  44   9.569  -1.689   2.137
  326    HA   GLU  44           HA       GLU  44  11.399  -1.537   4.375
  327    HB2  GLU  44           HB2      GLU  44   8.439  -2.107   4.179
  328    HB3  GLU  44           HB3      GLU  44   9.280  -2.407   5.678
  329    HG2  GLU  44           HG2      GLU  44   9.400   0.256   4.305
  330    HG3  GLU  44           HG3      GLU  44   8.145  -0.224   5.485
  331    H    SER  45           H        SER  45  11.282  -3.190   5.993
  332    HA   SER  45           HA       SER  45  11.476  -5.983   4.907
  333    HB2  SER  45           HB2      SER  45  12.827  -4.883   7.403
  334    HB3  SER  45           HB3      SER  45  12.969  -6.523   6.750
  335    HG   SER  45           HG       SER  45  14.752  -5.199   6.129
  336    H    ALA  46           H        ALA  46  10.339  -7.604   6.307
  337    HA   ALA  46           HA       ALA  46   7.771  -6.697   6.950
  338    HB1  ALA  46           HB1      ALA  46   7.408  -8.939   7.876
  339    HB2  ALA  46           HB2      ALA  46   8.378  -9.040   6.395
  340    HB3  ALA  46           HB3      ALA  46   9.167  -9.203   7.994
  341    H    GLU  47           H        GLU  47  10.505  -7.310   9.161
  342    HA   GLU  47           HA       GLU  47   9.098  -6.814  11.592
  343    HB2  GLU  47           HB2      GLU  47  11.248  -8.051  11.203
  344    HB3  GLU  47           HB3      GLU  47  12.061  -6.503  10.926
  345    HG2  GLU  47           HG2      GLU  47  11.387  -5.784  13.230
  346    HG3  GLU  47           HG3      GLU  47  10.626  -7.360  13.462
  347    H    GLN  48           H        GLN  48  10.749  -4.687   9.253
  348    HA   GLN  48           HA       GLN  48  10.647  -2.335  10.927
  349    HB2  GLN  48           HB2      GLN  48  10.994  -2.566   7.935
  350    HB3  GLN  48           HB3      GLN  48  11.131  -1.075   8.875
  351    HG2  GLN  48           HG2      GLN  48  12.767  -3.564   9.379
  352    HG3  GLN  48           HG3      GLN  48  13.333  -2.208   8.400
  353   HE21  GLN  48          HE22      GLN  48  14.397  -3.444  10.910
  354   HE22  GLN  48          HE21      GLN  48  14.527  -2.130  12.060
  355    H    ALA  49           H        ALA  49   8.493  -3.853   8.431
  356    HA   ALA  49           HA       ALA  49   6.611  -1.704   8.327
  357    HB1  ALA  49           HB1      ALA  49   5.155  -3.377   7.282
  358    HB2  ALA  49           HB2      ALA  49   6.810  -3.518   6.621
  359    HB3  ALA  49           HB3      ALA  49   6.200  -4.692   7.826
  360    H    MET  50           H        MET  50   7.028  -4.580  10.437
  361    HA   MET  50           HA       MET  50   4.551  -4.336  11.823
  362    HB2  MET  50           HB2      MET  50   5.877  -6.320  11.968
  363    HB3  MET  50           HB3      MET  50   7.253  -5.474  12.659
  364    HG2  MET  50           HG2      MET  50   4.557  -5.597  14.005
  365    HG3  MET  50           HG3      MET  50   5.796  -6.808  14.241
  366    HE1  MET  50           HE1      MET  50   8.509  -5.341  16.307
  367    HE2  MET  50           HE2      MET  50   7.984  -6.589  15.167
  368    HE3  MET  50           HE3      MET  50   8.612  -5.041  14.557
  369    H    TYR  51           H        TYR  51   7.815  -2.900  12.655
  370    HA   TYR  51           HA       TYR  51   6.668  -1.417  14.799
  371    HB2  TYR  51           HB2      TYR  51   9.189  -0.907  13.191
  372    HB3  TYR  51           HB3      TYR  51   8.744  -0.042  14.666
  373    HD1  TYR  51           HD2      TYR  51   7.985  -1.745  16.691
  374    HD2  TYR  51           HD1      TYR  51  10.802  -2.601  13.533
  375    HE1  TYR  51           HE2      TYR  51   9.243  -3.242  18.212
  376    HE2  TYR  51           HE1      TYR  51  12.058  -4.090  15.050
  377    HH   TYR  51           HH       TYR  51  12.247  -4.937  17.238
  378    H    ARG  52           H        ARG  52   7.126  -0.487  11.326
  379    HA   ARG  52           HA       ARG  52   6.315   2.176  11.474
  380    HB2  ARG  52           HB2      ARG  52   7.198   0.792   9.492
  381    HB3  ARG  52           HB3      ARG  52   5.593   0.107   9.327
  382    HG2  ARG  52           HG2      ARG  52   5.718   1.765   7.689
  383    HG3  ARG  52           HG3      ARG  52   4.732   2.477   8.970
  384    HD2  ARG  52           HD2      ARG  52   6.334   4.103   8.143
  385    HD3  ARG  52           HD3      ARG  52   6.737   3.651   9.826
  386    HE   ARG  52           HE       ARG  52   8.207   1.991   8.007
  387   HH11  ARG  52          HH21      ARG  52   8.223   5.390   9.091
  388   HH12  ARG  52          HH22      ARG  52   9.930   5.562   8.895
  389   HH21  ARG  52          HH12      ARG  52  10.330   2.176   7.800
  390   HH22  ARG  52          HH11      ARG  52  11.208   3.667   8.108
  391    H    GLU  53           H        GLU  53   4.283  -0.781  11.037
  392    HA   GLU  53           HA       GLU  53   1.869   0.741  11.022
  393    HB2  GLU  53           HB2      GLU  53   2.411  -2.230  11.171
  394    HB3  GLU  53           HB3      GLU  53   0.782  -1.550  11.146
  395    HG2  GLU  53           HG2      GLU  53   2.919  -1.006   9.061
  396    HG3  GLU  53           HG3      GLU  53   1.613  -2.179   8.874
  397    H    LEU  54           H        LEU  54   3.709  -0.960  13.585
  398    HA   LEU  54           HA       LEU  54   1.742  -1.002  15.575
  399    HB2  LEU  54           HB2      LEU  54   3.983  -2.056  15.705
  400    HB3  LEU  54           HB3      LEU  54   4.722  -0.450  15.833
  401    HG   LEU  54           HG       LEU  54   3.206  -0.186  17.962
  402   HD11  LEU  54          HD11      LEU  54   1.884  -2.245  17.495
  403   HD12  LEU  54          HD12      LEU  54   3.359  -3.214  17.659
  404   HD13  LEU  54          HD13      LEU  54   2.707  -2.336  19.066
  405   HD21  LEU  54          HD21      LEU  54   5.678  -0.341  18.017
  406   HD22  LEU  54          HD22      LEU  54   4.959  -1.256  19.349
  407   HD23  LEU  54          HD23      LEU  54   5.570  -2.116  17.912
  408    H    PHE  55           H        PHE  55   3.975   1.698  14.657
  409    HA   PHE  55           HA       PHE  55   2.782   3.481  16.606
  410    HB2  PHE  55           HB2      PHE  55   5.111   3.711  15.783
  411    HB3  PHE  55           HB3      PHE  55   4.511   4.053  14.158
  412    HD1  PHE  55           HD1      PHE  55   4.348   5.268  17.710
  413    HD2  PHE  55           HD2      PHE  55   4.001   6.304  13.535
  414    HE1  PHE  55           HE1      PHE  55   4.129   7.667  18.323
  415    HE2  PHE  55           HE2      PHE  55   3.790   8.704  14.149
  416    HZ   PHE  55           HZ       PHE  55   3.853   9.387  16.546
  417    H    GLU  56           H        GLU  56   1.995   2.777  13.158
  418    HA   GLU  56           HA       GLU  56   0.254   5.047  13.027
  419    HB2  GLU  56           HB2      GLU  56   0.623   2.636  11.234
  420    HB3  GLU  56           HB3      GLU  56  -0.599   3.886  10.945
  421    HG2  GLU  56           HG2      GLU  56   1.231   5.626  11.016
  422    HG3  GLU  56           HG3      GLU  56   2.421   4.331  11.102
  423    H    GLU  57           H        GLU  57  -0.210   1.708  14.028
  424    HA   GLU  57           HA       GLU  57  -3.132   1.899  14.003
  425    HB2  GLU  57           HB2      GLU  57  -1.167  -0.340  14.685
  426    HB3  GLU  57           HB3      GLU  57  -2.902  -0.526  14.683
  427    HG2  GLU  57           HG2      GLU  57  -1.346   0.226  12.186
  428    HG3  GLU  57           HG3      GLU  57  -1.660  -1.432  12.690
  429    H    VAL  58           H        VAL  58  -0.543   1.078  16.330
  430    HA   VAL  58           HA       VAL  58  -2.439   1.010  18.577
  431    HB   VAL  58           HB       VAL  58   0.509   0.234  18.575
  432   HG11  VAL  58          HG11      VAL  58  -1.884  -0.803  20.105
  433   HG12  VAL  58          HG12      VAL  58  -0.219  -1.448  20.209
  434   HG13  VAL  58          HG13      VAL  58  -0.549   0.206  20.727
  435   HG21  VAL  58          HG21      VAL  58  -0.298  -2.119  17.982
  436   HG22  VAL  58          HG22      VAL  58  -1.788  -1.354  17.398
  437   HG23  VAL  58          HG23      VAL  58  -0.205  -0.924  16.673
  438    H    GLY  59           H        GLY  59   0.235   2.810  17.308
  439    HA2  GLY  59           HA2      GLY  59   1.073   4.932  17.853
  440    HA3  GLY  59           HA3      GLY  59  -0.060   5.016  19.216
  441    H    LEU  60           H        LEU  60   1.428   2.109  19.529
  442    HA   LEU  60           HA       LEU  60   3.331   2.876  21.563
  443    HB2  LEU  60           HB2      LEU  60   1.747   0.947  21.555
  444    HB3  LEU  60           HB3      LEU  60   2.591   0.282  20.154
  445    HG   LEU  60           HG       LEU  60   4.620  -0.095  21.556
  446   HD11  LEU  60          HD11      LEU  60   2.846   0.897  23.821
  447   HD12  LEU  60          HD12      LEU  60   4.414   0.072  23.988
  448   HD13  LEU  60          HD13      LEU  60   4.333   1.683  23.251
  449   HD21  LEU  60          HD21      LEU  60   3.414  -1.873  22.944
  450   HD22  LEU  60          HD22      LEU  60   1.871  -1.077  22.560
  451   HD23  LEU  60          HD23      LEU  60   2.836  -1.815  21.271
  452    H    SER  61           H        SER  61   5.639   2.306  21.386
  453    HA   SER  61           HA       SER  61   6.697   2.201  18.604
  454    HB2  SER  61           HB2      SER  61   7.754   4.033  20.790
  455    HB3  SER  61           HB3      SER  61   8.266   3.952  19.091
  456    HG   SER  61           HG       SER  61   6.804   5.701  19.533
  457    H    ARG  62           H        ARG  62   9.062   1.692  18.618
  458    HA   ARG  62           HA       ARG  62   9.424  -0.902  19.411
  459    HB2  ARG  62           HB2      ARG  62  11.768   1.023  19.080
  460    HB3  ARG  62           HB3      ARG  62  11.725  -0.722  18.809
  461    HG2  ARG  62           HG2      ARG  62   9.798   0.008  17.079
  462    HG3  ARG  62           HG3      ARG  62  10.714   1.520  17.094
  463    HD2  ARG  62           HD2      ARG  62  11.738  -1.260  16.434
  464    HD3  ARG  62           HD3      ARG  62  11.499   0.034  15.266
  465    HE   ARG  62           HE       ARG  62  13.744  -0.466  17.011
  466   HH11  ARG  62          HH11      ARG  62  12.138   2.170  15.218
  467   HH12  ARG  62          HH12      ARG  62  13.544   3.166  15.167
  468   HH21  ARG  62          HH21      ARG  62  15.598   0.867  16.934
  469   HH22  ARG  62          HH22      ARG  62  15.560   2.395  16.130
  470    H    LYS  63           H        LYS  63  10.336   1.979  21.264
  471    HA   LYS  63           HA       LYS  63  12.118   0.678  23.036
  472    HB2  LYS  63           HB2      LYS  63  10.419   3.122  23.713
  473    HB3  LYS  63           HB3      LYS  63  12.016   2.696  24.350
  474    HG2  LYS  63           HG2      LYS  63  11.372   3.691  21.559
  475    HG3  LYS  63           HG3      LYS  63  12.202   4.581  22.831
  476    HD2  LYS  63           HD2      LYS  63  13.210   1.953  21.710
  477    HD3  LYS  63           HD3      LYS  63  13.647   3.525  21.011
  478    HE2  LYS  63           HE2      LYS  63  14.563   4.228  23.245
  479    HE3  LYS  63           HE3      LYS  63  14.216   2.613  23.880
  480    HZ1  LYS  63           HZ1      LYS  63  16.106   3.213  21.669
  481    HZ2  LYS  63           HZ2      LYS  63  16.523   2.809  23.192
  482    HZ3  LYS  63           HZ3      LYS  63  15.787   1.708  22.242
  483    H    ASP  64           H        ASP  64   8.640   0.724  22.987
  484    HA   ASP  64           HA       ASP  64   8.651  -0.420  25.734
  485    HB2  ASP  64           HB2      ASP  64   7.581   1.874  25.327
  486    HB3  ASP  64           HB3      ASP  64   6.248   0.971  24.629
  487    H    VAL  65           H        VAL  65   8.967  -1.772  23.080
  488    HA   VAL  65           HA       VAL  65   7.197  -4.032  23.773
  489    HB   VAL  65           HB       VAL  65   6.939  -4.530  21.319
  490   HG11  VAL  65          HG11      VAL  65   5.622  -1.993  22.300
  491   HG12  VAL  65          HG12      VAL  65   5.006  -3.087  21.037
  492   HG13  VAL  65          HG13      VAL  65   5.110  -3.630  22.729
  493   HG21  VAL  65          HG21      VAL  65   7.163  -2.761  19.661
  494   HG22  VAL  65          HG22      VAL  65   7.665  -1.605  20.898
  495   HG23  VAL  65          HG23      VAL  65   8.722  -2.962  20.470
  496    H    ARG  66           H        ARG  66   7.932  -6.098  22.767
  497    HA   ARG  66           HA       ARG  66  10.687  -6.195  21.817
  498    HB2  ARG  66           HB2      ARG  66  11.337  -8.025  23.265
  499    HB3  ARG  66           HB3      ARG  66  11.060  -6.535  24.152
  500    HG2  ARG  66           HG2      ARG  66   8.766  -8.504  24.094
  501    HG3  ARG  66           HG3      ARG  66  10.211  -9.001  24.948
  502    HD2  ARG  66           HD2      ARG  66   8.734  -6.401  25.499
  503    HD3  ARG  66           HD3      ARG  66   8.555  -7.867  26.442
  504    HE   ARG  66           HE       ARG  66  10.843  -6.013  26.398
  505   HH11  ARG  66          HH21      ARG  66   9.804  -9.247  27.512
  506   HH12  ARG  66          HH22      ARG  66  11.016  -9.334  28.738
  507   HH21  ARG  66          HH11      ARG  66  12.432  -6.165  28.028
  508   HH22  ARG  66          HH12      ARG  66  12.526  -7.563  29.035
  509    H    ILE  67           H        ILE  67  10.881  -7.983  20.276
  510    HA   ILE  67           HA       ILE  67   8.292  -9.109  19.481
  511    HB   ILE  67           HB       ILE  67  11.056  -9.492  18.283
  512   HG12  ILE  67          HG12      ILE  67   8.809  -7.809  17.115
  513   HG13  ILE  67          HG13      ILE  67  10.057  -7.106  18.148
  514   HG21  ILE  67          HG21      ILE  67   8.279 -10.224  17.203
  515   HG22  ILE  67          HG22      ILE  67   9.822 -10.433  16.336
  516   HG23  ILE  67          HG23      ILE  67   9.503 -11.370  17.782
  517   HD11  ILE  67          HD11      ILE  67  11.809  -7.908  16.596
  518   HD12  ILE  67          HD12      ILE  67  10.536  -8.504  15.495
  519   HD13  ILE  67          HD13      ILE  67  10.668  -6.776  15.843
  520    H    LEU  68           H        LEU  68   7.580 -10.773  20.495
  521    HA   LEU  68           HA       LEU  68   9.324 -12.623  22.027
  522    HB2  LEU  68           HB2      LEU  68   6.312 -12.389  21.670
  523    HB3  LEU  68           HB3      LEU  68   7.136 -13.569  22.687
  524    HG   LEU  68           HG       LEU  68   7.221 -10.529  23.135
  525   HD11  LEU  68          HD11      LEU  68   5.111 -11.065  23.747
  526   HD12  LEU  68          HD12      LEU  68   5.461 -12.785  24.025
  527   HD13  LEU  68          HD13      LEU  68   5.942 -11.600  25.224
  528   HD21  LEU  68          HD21      LEU  68   8.359 -12.840  24.776
  529   HD22  LEU  68          HD22      LEU  68   9.290 -11.568  23.948
  530   HD23  LEU  68          HD23      LEU  68   8.253 -11.137  25.300
  531    H    ALA  69           H        ALA  69   7.264 -12.488  19.083
  532    HA   ALA  69           HA       ALA  69   8.268 -15.050  18.097
  533    HB1  ALA  69           HB1      ALA  69   6.287 -16.285  18.181
  534    HB2  ALA  69           HB2      ALA  69   6.369 -15.565  19.799
  535    HB3  ALA  69           HB3      ALA  69   5.297 -14.871  18.577
  536    H    SER  70           H        SER  70   7.287 -15.503  16.012
  537    HA   SER  70           HA       SER  70   5.692 -13.592  14.705
  538    HB2  SER  70           HB2      SER  70   7.335 -12.920  12.910
  539    HB3  SER  70           HB3      SER  70   7.568 -12.196  14.506
  540    HG   SER  70           HG       SER  70   9.571 -12.932  13.608
  541    H    THR  71           H        THR  71   5.130 -14.307  12.400
  542    HA   THR  71           HA       THR  71   4.821 -17.149  12.632
  543    HB   THR  71           HB       THR  71   3.700 -16.832  10.310
  544    HG1  THR  71           HG1      THR  71   4.330 -14.887   9.661
  545   HG21  THR  71          HG21      THR  71   1.699 -15.712  11.382
  546   HG22  THR  71          HG22      THR  71   2.266 -17.223  12.090
  547   HG23  THR  71          HG23      THR  71   2.659 -15.684  12.890
  548    H    ARG  72           H        ARG  72   5.623 -18.807  11.591
  549    HA   ARG  72           HA       ARG  72   8.319 -18.497  10.435
  550    HB2  ARG  72           HB2      ARG  72   6.558 -20.928  10.984
  551    HB3  ARG  72           HB3      ARG  72   8.276 -20.996  10.594
  552    HG2  ARG  72           HG2      ARG  72   8.956 -20.261  12.702
  553    HG3  ARG  72           HG3      ARG  72   7.484 -19.347  13.004
  554    HD2  ARG  72           HD2      ARG  72   6.230 -21.565  13.111
  555    HD3  ARG  72           HD3      ARG  72   7.798 -22.361  13.184
  556    HE   ARG  72           HE       ARG  72   6.474 -20.604  15.170
  557   HH11  ARG  72          HH11      ARG  72   9.465 -22.369  14.379
  558   HH12  ARG  72          HH12      ARG  72  10.054 -22.397  16.000
  559   HH21  ARG  72          HH21      ARG  72   7.251 -20.661  17.346
  560   HH22  ARG  72          HH22      ARG  72   8.776 -21.388  17.713
  561    H    ASN  73           H        ASN  73   5.045 -19.086   9.380
  562    HA   ASN  73           HA       ASN  73   5.852 -19.374   6.576
  563    HB2  ASN  73           HB2      ASN  73   4.062 -20.824   6.171
  564    HB3  ASN  73           HB3      ASN  73   4.803 -21.459   7.640
  565   HD21  ASN  73          HD21      ASN  73   3.628 -20.695   9.847
  566   HD22  ASN  73          HD22      ASN  73   1.912 -20.547   9.727
  567    H    TRP  74           H        TRP  74   4.443 -18.156   5.091
  568    HA   TRP  74           HA       TRP  74   3.322 -15.752   6.418
  569    HB2  TRP  74           HB2      TRP  74   3.745 -16.492   3.488
  570    HB3  TRP  74           HB3      TRP  74   2.894 -15.054   4.012
  571    HD1  TRP  74           HD1      TRP  74   6.443 -16.562   4.141
  572    HE1  TRP  74           HE1      TRP  74   8.155 -14.658   4.236
  573    HE3  TRP  74           HE3      TRP  74   3.239 -12.599   4.474
  574    HZ2  TRP  74           HZ2      TRP  74   8.141 -11.818   4.640
  575    HZ3  TRP  74           HZ3      TRP  74   4.106 -10.286   4.715
  576    HH2  TRP  74           HH2      TRP  74   6.556  -9.901   4.962
  577    H    LEU  75           H        LEU  75   1.224 -15.202   6.528
  578    HA   LEU  75           HA       LEU  75  -0.713 -17.400   5.932
  579    HB2  LEU  75           HB2      LEU  75  -1.189 -14.857   7.527
  580    HB3  LEU  75           HB3      LEU  75  -2.230 -16.270   7.386
  581    HG   LEU  75           HG       LEU  75   0.376 -15.971   8.905
  582   HD11  LEU  75          HD11      LEU  75  -0.993 -16.716  10.798
  583   HD12  LEU  75          HD12      LEU  75  -1.710 -15.301  10.008
  584   HD13  LEU  75          HD13      LEU  75  -2.406 -16.912   9.732
  585   HD21  LEU  75          HD21      LEU  75   0.224 -18.378   9.530
  586   HD22  LEU  75          HD22      LEU  75  -1.006 -18.606   8.260
  587   HD23  LEU  75          HD23      LEU  75   0.668 -18.101   7.849
  588    H    ARG  76           H        ARG  76  -1.383 -17.256   3.824
  589    HA   ARG  76           HA       ARG  76  -1.838 -14.542   2.661
  590    HB2  ARG  76           HB2      ARG  76  -0.276 -16.305   1.580
  591    HB3  ARG  76           HB3      ARG  76  -1.745 -17.222   1.234
  592    HG2  ARG  76           HG2      ARG  76  -2.550 -15.129  -0.083
  593    HG3  ARG  76           HG3      ARG  76  -0.893 -14.521   0.123
  594    HD2  ARG  76           HD2      ARG  76  -0.123 -16.787  -0.816
  595    HD3  ARG  76           HD3      ARG  76  -1.829 -17.052  -1.281
  596    HE   ARG  76           HE       ARG  76  -1.131 -14.570  -2.350
  597   HH11  ARG  76          HH21      ARG  76   0.024 -17.920  -2.696
  598   HH12  ARG  76          HH22      ARG  76   0.653 -17.697  -4.288
  599   HH21  ARG  76          HH11      ARG  76  -0.334 -14.296  -4.534
  600   HH22  ARG  76          HH12      ARG  76   0.454 -15.607  -5.331
  601    H    TYR  77           H        TYR  77  -3.859 -14.060   1.742
  602    HA   TYR  77           HA       TYR  77  -5.874 -16.153   1.599
  603    HB2  TYR  77           HB2      TYR  77  -7.611 -15.187   2.796
  604    HB3  TYR  77           HB3      TYR  77  -6.253 -15.368   3.899
  605    HD1  TYR  77           HD2      TYR  77  -4.825 -13.250   4.402
  606    HD2  TYR  77           HD1      TYR  77  -8.711 -13.137   2.526
  607    HE1  TYR  77           HE2      TYR  77  -5.085 -10.911   5.078
  608    HE2  TYR  77           HE1      TYR  77  -8.971 -10.788   3.192
  609    HH   TYR  77           HH       TYR  77  -6.494  -9.010   5.121
  610    H    LYS  78           H        LYS  78  -7.523 -15.682   0.130
  611    HA   LYS  78           HA       LYS  78  -7.069 -13.295  -1.601
  612    HB2  LYS  78           HB2      LYS  78  -8.511 -15.942  -2.029
  613    HB3  LYS  78           HB3      LYS  78  -8.943 -14.507  -2.954
  614    HG2  LYS  78           HG2      LYS  78  -7.434 -15.735  -4.263
  615    HG3  LYS  78           HG3      LYS  78  -6.637 -14.250  -3.742
  616    HD2  LYS  78           HD2      LYS  78  -5.144 -15.390  -2.316
  617    HD3  LYS  78           HD3      LYS  78  -6.185 -16.802  -2.141
  618    HE2  LYS  78           HE2      LYS  78  -4.806 -16.055  -4.754
  619    HE3  LYS  78           HE3      LYS  78  -4.070 -17.103  -3.536
  620    HZ1  LYS  78           HZ1      LYS  78  -5.151 -18.404  -5.236
  621    HZ2  LYS  78           HZ2      LYS  78  -5.930 -18.652  -3.829
  622    HZ3  LYS  78           HZ3      LYS  78  -6.596 -17.696  -4.987
  623    H    LEU  79           H        LEU  79  -8.675 -11.803  -1.818
  624    HA   LEU  79           HA       LEU  79 -10.522 -11.413   0.424
  625    HB2  LEU  79           HB2      LEU  79 -10.148 -10.075  -2.279
  626    HB3  LEU  79           HB3      LEU  79 -11.197  -9.446  -1.035
  627    HG   LEU  79           HG       LEU  79  -8.265  -9.875  -0.388
  628   HD11  LEU  79          HD11      LEU  79  -7.808  -7.620  -1.294
  629   HD12  LEU  79          HD12      LEU  79  -8.310  -8.808  -2.522
  630   HD13  LEU  79          HD13      LEU  79  -9.470  -7.578  -1.966
  631   HD21  LEU  79          HD21      LEU  79  -8.626  -8.012   1.132
  632   HD22  LEU  79          HD22      LEU  79 -10.262  -7.750   0.488
  633   HD23  LEU  79          HD23      LEU  79  -9.893  -9.226   1.404
  634    HA   PRO  80           HA       PRO  80 -14.121 -13.112  -1.859
  635    HB2  PRO  80           HB2      PRO  80 -16.134 -11.767  -0.519
  636    HB3  PRO  80           HB3      PRO  80 -15.266 -13.161   0.204
  637    HG2  PRO  80           HG2      PRO  80 -14.704 -10.229   0.561
  638    HG3  PRO  80           HG3      PRO  80 -14.926 -11.456   1.846
  639    HD2  PRO  80           HD2      PRO  80 -12.444 -10.748   1.031
  640    HD3  PRO  80           HD3      PRO  80 -12.817 -12.468   1.334
  641    H    LYS  81           H        LYS  81 -15.446 -12.044  -3.661
  642    HA   LYS  81           HA       LYS  81 -13.891  -9.863  -4.590
  643    HB2  LYS  81           HB2      LYS  81 -16.386 -10.867  -5.903
  644    HB3  LYS  81           HB3      LYS  81 -15.071  -9.830  -6.571
  645    HG2  LYS  81           HG2      LYS  81 -13.493 -11.562  -6.572
  646    HG3  LYS  81           HG3      LYS  81 -14.523 -12.644  -5.629
  647    HD2  LYS  81           HD2      LYS  81 -14.484 -13.274  -8.002
  648    HD3  LYS  81           HD3      LYS  81 -16.109 -12.874  -7.432
  649    HE2  LYS  81           HE2      LYS  81 -15.949 -10.637  -8.530
  650    HE3  LYS  81           HE3      LYS  81 -14.327 -11.037  -9.103
  651    HZ1  LYS  81           HZ1      LYS  81 -16.804 -12.490  -9.863
  652    HZ2  LYS  81           HZ2      LYS  81 -15.994 -11.435 -10.805
  653    HZ3  LYS  81           HZ3      LYS  81 -15.303 -12.861 -10.398
  654    H    ARG  82           H        ARG  82 -16.727  -9.703  -2.632
  655    HA   ARG  82           HA       ARG  82 -17.470  -7.066  -3.352
  656    HB2  ARG  82           HB2      ARG  82 -18.501  -6.899  -1.145
  657    HB3  ARG  82           HB3      ARG  82 -18.849  -8.462  -1.903
  658    HG2  ARG  82           HG2      ARG  82 -16.886  -9.381  -0.452
  659    HG3  ARG  82           HG3      ARG  82 -16.979  -7.830   0.408
  660    HD2  ARG  82           HD2      ARG  82 -19.329  -8.253   0.933
  661    HD3  ARG  82           HD3      ARG  82 -19.277  -9.776   0.032
  662    HE   ARG  82           HE       ARG  82 -17.872  -9.128   2.593
  663   HH11  ARG  82          HH11      ARG  82 -19.101 -11.648   0.384
  664   HH12  ARG  82          HH12      ARG  82 -18.797 -12.943   1.479
  665   HH21  ARG  82          HH21      ARG  82 -17.530 -10.847   4.060
  666   HH22  ARG  82          HH22      ARG  82 -17.908 -12.472   3.618
  667    H    LEU  83           H        LEU  83 -14.742  -8.212  -1.459
  668    HA   LEU  83           HA       LEU  83 -14.060  -5.494  -0.589
  669    HB2  LEU  83           HB2      LEU  83 -12.723  -8.156  -0.058
  670    HB3  LEU  83           HB3      LEU  83 -12.293  -6.615   0.695
  671    HG   LEU  83           HG       LEU  83 -14.866  -8.174   1.060
  672   HD11  LEU  83          HD11      LEU  83 -14.116  -8.575   3.304
  673   HD12  LEU  83          HD12      LEU  83 -12.834  -9.068   2.193
  674   HD13  LEU  83          HD13      LEU  83 -12.687  -7.533   3.074
  675   HD21  LEU  83          HD21      LEU  83 -15.473  -6.518   2.798
  676   HD22  LEU  83          HD22      LEU  83 -14.138  -5.483   2.236
  677   HD23  LEU  83          HD23      LEU  83 -15.512  -5.870   1.157
  678    H    VAL  84           H        VAL  84 -13.252  -7.741  -3.110
  679    HA   VAL  84           HA       VAL  84 -10.679  -6.670  -3.854
  680    HB   VAL  84           HB       VAL  84 -12.896  -7.891  -5.577
  681   HG11  VAL  84          HG11      VAL  84 -11.416  -6.731  -7.056
  682   HG12  VAL  84          HG12      VAL  84  -9.981  -7.345  -6.208
  683   HG13  VAL  84          HG13      VAL  84 -11.001  -8.445  -7.152
  684   HG21  VAL  84          HG21      VAL  84 -11.934  -9.451  -3.781
  685   HG22  VAL  84          HG22      VAL  84 -11.853  -9.982  -5.467
  686   HG23  VAL  84          HG23      VAL  84 -10.396  -9.334  -4.653
  687    H    ARG  85           H        ARG  85 -10.184  -4.782  -4.880
  688    HA   ARG  85           HA       ARG  85 -12.406  -3.056  -5.796
  689    HB2  ARG  85           HB2      ARG  85  -9.904  -2.625  -4.324
  690    HB3  ARG  85           HB3      ARG  85  -9.973  -1.592  -5.762
  691    HG2  ARG  85           HG2      ARG  85 -12.218  -1.862  -3.767
  692    HG3  ARG  85           HG3      ARG  85 -10.977  -0.584  -3.716
  693    HD2  ARG  85           HD2      ARG  85 -11.665  -0.041  -6.150
  694    HD3  ARG  85           HD3      ARG  85 -13.102  -1.015  -5.887
  695    HE   ARG  85           HE       ARG  85 -12.399   1.611  -4.776
  696   HH11  ARG  85          HH21      ARG  85 -14.670  -1.124  -4.405
  697   HH12  ARG  85          HH22      ARG  85 -15.862  -0.184  -3.586
  698   HH21  ARG  85          HH11      ARG  85 -14.001   2.841  -3.691
  699   HH22  ARG  85          HH12      ARG  85 -15.468   2.102  -3.160
  700    H    TRP  86           H        TRP  86 -12.842  -3.917  -7.679
  701    HA   TRP  86           HA       TRP  86 -10.930  -4.544  -9.712
  702    HB2  TRP  86           HB2      TRP  86 -13.925  -4.034  -9.678
  703    HB3  TRP  86           HB3      TRP  86 -13.052  -4.587 -11.114
  704    HD1  TRP  86           HD1      TRP  86 -14.817  -5.958  -8.159
  705    HE1  TRP  86           HE1      TRP  86 -14.366  -8.435  -7.847
  706    HE3  TRP  86           HE3      TRP  86 -11.005  -6.491 -11.521
  707    HZ2  TRP  86           HZ2      TRP  86 -12.363 -10.378  -8.722
  708    HZ3  TRP  86           HZ3      TRP  86  -9.850  -8.682 -11.783
  709    HH2  TRP  86           HH2      TRP  86 -10.508 -10.621 -10.374
  710    H    ASP  87           H        ASP  87 -12.432  -1.539  -8.678
  711    HA   ASP  87           HA       ASP  87 -12.447  -0.258 -11.245
  712    HB2  ASP  87           HB2      ASP  87 -14.005   0.342  -9.470
  713    HB3  ASP  87           HB3      ASP  87 -12.672   0.858  -8.431
  714    H    THR  88           H        THR  88 -10.087  -0.360  -8.625
  715    HA   THR  88           HA       THR  88  -8.435   1.671  -9.939
  716    HB   THR  88           HB       THR  88  -8.973   1.764  -7.452
  717    HG1  THR  88           HG1      THR  88  -7.045   2.746  -7.123
  718   HG21  THR  88          HG21      THR  88  -8.391  -0.699  -7.031
  719   HG22  THR  88          HG22      THR  88  -6.693  -0.236  -7.211
  720   HG23  THR  88          HG23      THR  88  -7.689   0.474  -5.910
  721    H    LYS  89           H        LYS  89  -6.078   1.123 -10.129
  722    HA   LYS  89           HA       LYS  89  -5.680  -1.641 -11.012
  723    HB2  LYS  89           HB2      LYS  89  -4.847   0.762 -12.666
  724    HB3  LYS  89           HB3      LYS  89  -4.700  -0.933 -13.112
  725    HG2  LYS  89           HG2      LYS  89  -7.287   0.611 -12.735
  726    HG3  LYS  89           HG3      LYS  89  -6.523   0.253 -14.287
  727    HD2  LYS  89           HD2      LYS  89  -6.923  -2.140 -14.017
  728    HD3  LYS  89           HD3      LYS  89  -7.596  -1.888 -12.397
  729    HE2  LYS  89           HE2      LYS  89  -9.303  -0.315 -13.458
  730    HE3  LYS  89           HE3      LYS  89  -8.720  -0.859 -15.035
  731    HZ1  LYS  89           HZ1      LYS  89 -10.630  -2.127 -14.431
  732    HZ2  LYS  89           HZ2      LYS  89  -9.364  -3.153 -14.329
  733    HZ3  LYS  89           HZ3      LYS  89 -10.047  -2.518 -12.957
  734    HA   PRO  90           HA       PRO  90  -4.159  -2.997 -11.365
  735    HB2  PRO  90           HB2      PRO  90  -2.613  -4.694  -9.934
  736    HB3  PRO  90           HB3      PRO  90  -1.992  -3.711 -11.309
  737    HG2  PRO  90           HG2      PRO  90  -1.889  -3.008  -8.344
  738    HG3  PRO  90           HG3      PRO  90  -0.492  -3.081  -9.479
  739    HD2  PRO  90           HD2      PRO  90  -1.769  -0.763  -8.914
  740    HD3  PRO  90           HD3      PRO  90  -1.243  -1.117 -10.591
  741    H    VAL  91           H        VAL  91  -5.489  -4.704 -10.475
  742    HA   VAL  91           HA       VAL  91  -7.026  -3.952  -8.157
  743    HB   VAL  91           HB       VAL  91  -6.960  -6.424  -9.973
  744   HG11  VAL  91          HG11      VAL  91  -8.058  -7.048  -7.882
  745   HG12  VAL  91          HG12      VAL  91  -9.138  -5.650  -8.001
  746   HG13  VAL  91          HG13      VAL  91  -9.226  -6.957  -9.194
  747   HG21  VAL  91          HG21      VAL  91  -8.744  -3.961 -10.035
  748   HG22  VAL  91          HG22      VAL  91  -7.540  -4.428 -11.247
  749   HG23  VAL  91          HG23      VAL  91  -8.978  -5.418 -11.035
  750    H    CYS  92           H        CYS  92  -7.012  -4.749  -6.128
  751    HA   CYS  92           HA       CYS  92  -4.838  -6.597  -5.352
  752    HB2  CYS  92           HB2      CYS  92  -5.610  -6.016  -3.038
  753    HB3  CYS  92           HB3      CYS  92  -5.018  -4.647  -3.993
  754    HG   CYS  92           HG       CYS  92  -8.145  -5.577  -3.565
  755    H    ILE  93           H        ILE  93  -5.341  -8.778  -5.500
  756    HA   ILE  93           HA       ILE  93  -8.152  -9.533  -4.783
  757    HB   ILE  93           HB       ILE  93  -8.140 -11.403  -6.042
  758   HG12  ILE  93          HG12      ILE  93  -6.033 -12.451  -5.714
  759   HG13  ILE  93          HG13      ILE  93  -6.343 -12.293  -7.432
  760   HG21  ILE  93          HG21      ILE  93  -7.906 -10.585  -8.312
  761   HG22  ILE  93          HG22      ILE  93  -8.551  -9.326  -7.252
  762   HG23  ILE  93          HG23      ILE  93  -6.851  -9.263  -7.781
  763   HD11  ILE  93          HD11      ILE  93  -4.054 -11.809  -7.157
  764   HD12  ILE  93          HD12      ILE  93  -4.795 -10.220  -7.373
  765   HD13  ILE  93          HD13      ILE  93  -4.330 -10.789  -5.743
  766    H    GLY  94           H        GLY  94  -4.893  -9.738  -3.592
  767    HA2  GLY  94           HA2      GLY  94  -5.877 -11.063  -1.233
  768    HA3  GLY  94           HA3      GLY  94  -4.834 -12.111  -2.212
  769    H    GLN  95           H        GLN  95  -3.723 -11.785   0.002
  770    HA   GLN  95           HA       GLN  95  -1.415 -10.069  -0.419
  771    HB2  GLN  95           HB2      GLN  95  -1.640  -8.985   1.846
  772    HB3  GLN  95           HB3      GLN  95  -2.721  -8.382   0.606
  773    HG2  GLN  95           HG2      GLN  95  -3.654 -10.465   2.616
  774    HG3  GLN  95           HG3      GLN  95  -3.646  -8.746   2.995
  775   HE21  GLN  95          HE22      GLN  95  -5.624 -11.219   1.680
  776   HE22  GLN  95          HE21      GLN  95  -6.787 -10.143   0.955
  777    H    LYS  96           H        LYS  96   0.289 -10.571   1.105
  778    HA   LYS  96           HA       LYS  96  -0.088 -13.190   2.517
  779    HB2  LYS  96           HB2      LYS  96   2.330 -13.554   2.286
  780    HB3  LYS  96           HB3      LYS  96   1.505 -13.498   0.739
  781    HG2  LYS  96           HG2      LYS  96   2.289 -11.189   0.368
  782    HG3  LYS  96           HG3      LYS  96   3.153 -11.211   1.912
  783    HD2  LYS  96           HD2      LYS  96   3.710 -13.115  -0.398
  784    HD3  LYS  96           HD3      LYS  96   4.554 -11.581  -0.141
  785    HE2  LYS  96           HE2      LYS  96   5.371 -12.375   2.080
  786    HE3  LYS  96           HE3      LYS  96   4.559 -13.924   1.830
  787    HZ1  LYS  96           HZ1      LYS  96   5.989 -14.285  -0.118
  788    HZ2  LYS  96           HZ2      LYS  96   6.753 -12.855   0.126
  789    HZ3  LYS  96           HZ3      LYS  96   6.891 -14.057   1.224
  790    H    GLN  97           H        GLN  97   0.083 -13.040   4.741
  791    HA   GLN  97           HA       GLN  97   0.939 -10.408   5.837
  792    HB2  GLN  97           HB2      GLN  97  -0.957 -12.444   7.045
  793    HB3  GLN  97           HB3      GLN  97  -0.497 -10.875   7.724
  794    HG2  GLN  97           HG2      GLN  97  -1.490  -9.861   5.556
  795    HG3  GLN  97           HG3      GLN  97  -2.222 -11.447   5.288
  796   HE21  GLN  97          HE22      GLN  97  -2.159  -8.562   7.388
  797   HE22  GLN  97          HE21      GLN  97  -3.619  -8.946   8.296
  798    H    LYS  98           H        LYS  98   2.621 -10.374   7.260
  799    HA   LYS  98           HA       LYS  98   3.502 -12.958   8.495
  800    HB2  LYS  98           HB2      LYS  98   5.169 -11.963   7.014
  801    HB3  LYS  98           HB3      LYS  98   5.094 -10.421   7.909
  802    HG2  LYS  98           HG2      LYS  98   6.195 -11.292   9.720
  803    HG3  LYS  98           HG3      LYS  98   5.782 -12.981   9.348
  804    HD2  LYS  98           HD2      LYS  98   7.606 -11.370   7.551
  805    HD3  LYS  98           HD3      LYS  98   8.253 -12.106   9.008
  806    HE2  LYS  98           HE2      LYS  98   6.674 -13.799   7.019
  807    HE3  LYS  98           HE3      LYS  98   8.329 -13.342   6.659
  808    HZ1  LYS  98           HZ1      LYS  98   7.543 -14.895   9.089
  809    HZ2  LYS  98           HZ2      LYS  98   8.314 -15.465   7.764
  810    HZ3  LYS  98           HZ3      LYS  98   9.063 -14.393   8.725
  811    H    TRP  99           H        TRP  99   3.326 -13.045  10.717
  812    HA   TRP  99           HA       TRP  99   2.133 -10.630  12.001
  813    HB2  TRP  99           HB2      TRP  99   1.665 -13.591  12.398
  814    HB3  TRP  99           HB3      TRP  99   1.059 -12.333  13.472
  815    HD1  TRP  99           HD1      TRP  99   0.534 -13.692   9.916
  816    HE1  TRP  99           HE1      TRP  99  -1.743 -12.859   9.063
  817    HE3  TRP  99           HE3      TRP  99  -0.597 -10.452  13.691
  818    HZ2  TRP  99           HZ2      TRP  99  -3.749 -10.936   9.869
  819    HZ3  TRP  99           HZ3      TRP  99  -2.602  -9.039  13.570
  820    HH2  TRP  99           HH2      TRP  99  -4.212  -9.272  11.660
  821    H    PHE 100           H        PHE 100   2.674 -10.193  14.199
  822    HA   PHE 100           HA       PHE 100   5.206 -11.436  15.181
  823    HB2  PHE 100           HB2      PHE 100   4.464  -8.492  14.913
  824    HB3  PHE 100           HB3      PHE 100   5.874  -9.100  15.773
  825    HD1  PHE 100           HD1      PHE 100   4.300  -8.768  12.374
  826    HD2  PHE 100           HD2      PHE 100   7.873  -9.738  14.619
  827    HE1  PHE 100           HE1      PHE 100   5.641  -8.759  10.289
  828    HE2  PHE 100           HE2      PHE 100   9.196  -9.706  12.528
  829    HZ   PHE 100           HZ       PHE 100   8.080  -9.236  10.357
  830    H    LEU 101           H        LEU 101   5.005 -12.023  17.300
  831    HA   LEU 101           HA       LEU 101   2.762 -10.958  18.932
  832    HB2  LEU 101           HB2      LEU 101   3.556 -13.492  18.800
  833    HB3  LEU 101           HB3      LEU 101   4.834 -12.968  19.870
  834    HG   LEU 101           HG       LEU 101   1.924 -13.343  20.323
  835   HD11  LEU 101          HD11      LEU 101   4.149 -13.762  22.346
  836   HD12  LEU 101          HD12      LEU 101   2.615 -14.639  22.164
  837   HD13  LEU 101          HD13      LEU 101   3.926 -14.926  21.039
  838   HD21  LEU 101          HD21      LEU 101   2.163 -10.954  21.060
  839   HD22  LEU 101          HD22      LEU 101   1.788 -12.078  22.332
  840   HD23  LEU 101          HD23      LEU 101   3.449 -11.465  22.188
  841    H    LEU 102           H        LEU 102   3.307  -9.190  20.220
  842    HA   LEU 102           HA       LEU 102   6.138  -8.993  21.107
  843    HB2  LEU 102           HB2      LEU 102   4.355  -6.580  21.038
  844    HB3  LEU 102           HB3      LEU 102   6.097  -6.646  21.041
  845    HG   LEU 102           HG       LEU 102   4.317  -7.285  18.667
  846   HD11  LEU 102          HD11      LEU 102   4.957  -5.158  17.779
  847   HD12  LEU 102          HD12      LEU 102   4.340  -4.874  19.408
  848   HD13  LEU 102          HD13      LEU 102   6.094  -4.861  19.106
  849   HD21  LEU 102          HD21      LEU 102   6.448  -8.495  18.486
  850   HD22  LEU 102          HD22      LEU 102   6.429  -7.144  17.352
  851   HD23  LEU 102          HD23      LEU 102   7.349  -7.006  18.873
  852    H    GLN 103           H        GLN 103   6.370  -8.074  23.304
  853    HA   GLN 103           HA       GLN 103   3.829  -8.273  24.898
  854    HB2  GLN 103           HB2      GLN 103   4.950  -9.861  25.750
  855    HB3  GLN 103           HB3      GLN 103   6.568  -9.149  25.582
  856    HG2  GLN 103           HG2      GLN 103   6.331  -7.975  27.633
  857    HG3  GLN 103           HG3      GLN 103   4.610  -7.696  27.395
  858   HE21  GLN 103          HE22      GLN 103   3.059  -9.518  27.680
  859   HE22  GLN 103          HE21      GLN 103   3.454 -10.695  28.923
  860    H    LEU 104           H        LEU 104   3.130  -6.353  25.703
  861    HA   LEU 104           HA       LEU 104   4.321  -3.815  25.234
  862    HB2  LEU 104           HB2      LEU 104   1.867  -4.900  26.258
  863    HB3  LEU 104           HB3      LEU 104   2.556  -4.097  27.621
  864    HG   LEU 104           HG       LEU 104   1.213  -2.494  26.850
  865   HD11  LEU 104          HD11      LEU 104   3.452  -1.489  26.892
  866   HD12  LEU 104          HD12      LEU 104   3.646  -1.801  25.147
  867   HD13  LEU 104          HD13      LEU 104   2.386  -0.697  25.743
  868   HD21  LEU 104          HD21      LEU 104   1.735  -3.209  23.966
  869   HD22  LEU 104          HD22      LEU 104   0.291  -3.610  24.964
  870   HD23  LEU 104          HD23      LEU 104   0.639  -1.931  24.578
  871    H    VAL 105           H        VAL 105   5.857  -2.658  26.541
  872    HA   VAL 105           HA       VAL 105   7.169  -4.294  28.589
  873    HB   VAL 105           HB       VAL 105   7.890  -1.700  27.242
  874   HG11  VAL 105          HG11      VAL 105   9.577  -3.344  29.171
  875   HG12  VAL 105          HG12      VAL 105  10.176  -2.009  28.160
  876   HG13  VAL 105          HG13      VAL 105   8.987  -1.681  29.421
  877   HG21  VAL 105          HG21      VAL 105   9.445  -2.982  25.931
  878   HG22  VAL 105          HG22      VAL 105   9.210  -4.419  26.966
  879   HG23  VAL 105          HG23      VAL 105   7.930  -3.887  25.880
  880    H    SER 106           H        SER 106   5.821  -0.950  28.481
  881    HA   SER 106           HA       SER 106   5.927  -0.706  31.389
  882    HB2  SER 106           HB2      SER 106   4.590   0.957  29.213
  883    HB3  SER 106           HB3      SER 106   4.619   1.392  30.928
  884    HG   SER 106           HG       SER 106   6.763   1.201  29.093
  885    H    GLY 107           H        GLY 107   3.617  -1.923  29.060
  886    HA2  GLY 107           HA2      GLY 107   1.771  -3.352  29.888
  887    HA3  GLY 107           HA3      GLY 107   1.511  -2.182  31.182
  888    H    ASP 108           H        ASP 108  -0.625  -2.651  29.745
  889    HA   ASP 108           HA       ASP 108  -0.946  -1.651  27.218
  890    HB2  ASP 108           HB2      ASP 108  -3.195  -2.144  27.514
  891    HB3  ASP 108           HB3      ASP 108  -2.399  -3.197  28.672
  892    H    ALA 109           H        ALA 109  -0.816   0.140  30.136
  893    HA   ALA 109           HA       ALA 109  -2.182   2.519  29.582
  894    HB1  ALA 109           HB1      ALA 109  -0.499   3.604  31.036
  895    HB2  ALA 109           HB2      ALA 109  -1.020   2.050  31.714
  896    HB3  ALA 109           HB3      ALA 109   0.557   2.186  30.887
  897    H    GLU 110           H        GLU 110   0.772   1.311  28.049
  898    HA   GLU 110           HA       GLU 110   1.303   3.898  26.883
  899    HB2  GLU 110           HB2      GLU 110   2.880   1.347  27.100
  900    HB3  GLU 110           HB3      GLU 110   3.355   2.526  25.875
  901    HG2  GLU 110           HG2      GLU 110   3.005   3.152  28.822
  902    HG3  GLU 110           HG3      GLU 110   4.546   2.777  28.037
  903    H    ILE 111           H        ILE 111  -0.992   2.278  26.077
  904    HA   ILE 111           HA       ILE 111  -0.595   2.040  23.128
  905    HB   ILE 111           HB       ILE 111  -3.066   1.430  24.812
  906   HG12  ILE 111          HG12      ILE 111  -1.250  -0.593  23.413
  907   HG13  ILE 111          HG13      ILE 111  -1.022  -0.161  25.098
  908   HG21  ILE 111          HG21      ILE 111  -3.654   2.043  22.488
  909   HG22  ILE 111          HG22      ILE 111  -2.459   0.882  21.864
  910   HG23  ILE 111          HG23      ILE 111  -3.909   0.329  22.727
  911   HD11  ILE 111          HD11      ILE 111  -2.331  -2.203  24.964
  912   HD12  ILE 111          HD12      ILE 111  -3.315  -0.903  25.655
  913   HD13  ILE 111          HD13      ILE 111  -3.577  -1.411  23.997
  914    H    ASN 112           H        ASN 112  -1.574   3.532  21.688
  915    HA   ASN 112           HA       ASN 112  -3.258   5.708  22.798
  916    HB2  ASN 112           HB2      ASN 112  -1.093   6.789  22.751
  917    HB3  ASN 112           HB3      ASN 112  -0.720   6.107  21.167
  918   HD21  ASN 112          HD22      ASN 112  -0.397   8.332  20.290
  919   HD22  ASN 112          HD21      ASN 112  -1.836   9.234  19.838
  920    H    MET 113           H        MET 113  -5.131   5.171  21.718
  921    HA   MET 113           HA       MET 113  -5.029   4.054  19.035
  922    HB2  MET 113           HB2      MET 113  -7.249   4.653  21.022
  923    HB3  MET 113           HB3      MET 113  -7.590   4.077  19.386
  924    HG2  MET 113           HG2      MET 113  -5.689   2.644  21.280
  925    HG3  MET 113           HG3      MET 113  -7.411   2.243  21.113
  926    HE1  MET 113           HE1      MET 113  -5.136  -0.525  19.096
  927    HE2  MET 113           HE2      MET 113  -4.429   0.511  20.363
  928    HE3  MET 113           HE3      MET 113  -6.010  -0.275  20.640
  929    H    GLN 114           H        GLN 114  -4.536   7.165  19.834
  930    HA   GLN 114           HA       GLN 114  -5.852   8.196  17.417
  931    HB2  GLN 114           HB2      GLN 114  -5.582   9.660  20.048
  932    HB3  GLN 114           HB3      GLN 114  -5.873  10.414  18.462
  933    HG2  GLN 114           HG2      GLN 114  -7.946   9.102  18.200
  934    HG3  GLN 114           HG3      GLN 114  -7.717   8.400  19.808
  935   HE21  GLN 114          HE22      GLN 114  -8.310  11.534  18.043
  936   HE22  GLN 114          HE21      GLN 114  -9.016  12.329  19.426
  937    H    THR 115           H        THR 115  -4.032   7.294  16.664
  938    HA   THR 115           HA       THR 115  -1.348   8.288  16.998
  939    HB   THR 115           HB       THR 115  -1.256   7.021  14.710
  940    HG1  THR 115           HG1      THR 115  -3.000   5.635  14.358
  941   HG21  THR 115          HG21      THR 115  -2.233   5.641  17.292
  942   HG22  THR 115          HG22      THR 115  -1.363   4.816  15.978
  943   HG23  THR 115          HG23      THR 115  -0.548   6.072  16.909
  944    H    SER 116           H        SER 116  -3.626   8.390  14.330
  945    HA   SER 116           HA       SER 116  -2.976  11.110  13.470
  946    HB2  SER 116           HB2      SER 116  -5.287   9.276  12.711
  947    HB3  SER 116           HB3      SER 116  -4.796  10.753  11.862
  948    HG   SER 116           HG       SER 116  -3.942   8.835  10.880
  949    H    SER 117           H        SER 117  -4.869  12.804  13.406
  950    HA   SER 117           HA       SER 117  -5.881  13.286  15.993
  951    HB2  SER 117           HB2      SER 117  -7.059  14.283  13.366
  952    HB3  SER 117           HB3      SER 117  -7.141  15.068  14.959
  953    HG   SER 117           HG       SER 117  -5.501  15.994  13.611
  954    H    THR 118           H        THR 118  -7.312  11.668  13.152
  955    HA   THR 118           HA       THR 118  -9.802  10.945  14.365
  956    HB   THR 118           HB       THR 118  -9.237   9.177  12.356
  957    HG1  THR 118           HG1      THR 118  -8.509  10.440  10.628
  958   HG21  THR 118          HG21      THR 118 -11.362  10.123  12.813
  959   HG22  THR 118          HG22      THR 118 -10.823  11.742  12.292
  960   HG23  THR 118          HG23      THR 118 -10.950  10.401  11.117
  961    HA   PRO 119           HA       PRO 119  -7.988   7.425  16.539
  962    HB2  PRO 119           HB2      PRO 119 -10.800   6.400  16.508
  963    HB3  PRO 119           HB3      PRO 119  -9.693   6.602  17.897
  964    HG2  PRO 119           HG2      PRO 119 -11.818   8.293  17.442
  965    HG3  PRO 119           HG3      PRO 119 -10.277   8.866  18.147
  966    HD2  PRO 119           HD2      PRO 119 -11.255   9.125  15.293
  967    HD3  PRO 119           HD3      PRO 119 -10.319  10.287  16.290
  968    H    GLU 120           H        GLU 120  -7.116   5.643  15.455
  969    HA   GLU 120           HA       GLU 120  -8.280   4.787  12.894
  970    HB2  GLU 120           HB2      GLU 120  -5.847   3.870  14.473
  971    HB3  GLU 120           HB3      GLU 120  -6.452   2.950  13.106
  972    HG2  GLU 120           HG2      GLU 120  -5.545   5.848  13.029
  973    HG3  GLU 120           HG3      GLU 120  -4.676   4.452  12.396
  974    H    PHE 121           H        PHE 121  -8.581   3.867  16.257
  975    HA   PHE 121           HA       PHE 121 -10.418   1.697  15.405
  976    HB2  PHE 121           HB2      PHE 121  -8.611   1.679  17.827
  977    HB3  PHE 121           HB3      PHE 121  -9.860   0.503  17.484
  978    HD1  PHE 121           HD1      PHE 121  -9.617  -1.128  15.610
  979    HD2  PHE 121           HD2      PHE 121  -6.494   1.684  16.548
  980    HE1  PHE 121           HE1      PHE 121  -8.016  -2.440  14.247
  981    HE2  PHE 121           HE2      PHE 121  -4.871   0.246  15.421
  982    HZ   PHE 121           HZ       PHE 121  -5.635  -1.768  14.158
  983    H    ASP 122           H        ASP 122 -12.338   1.581  16.423
  984    HA   ASP 122           HA       ASP 122 -13.332   4.010  17.783
  985    HB2  ASP 122           HB2      ASP 122 -14.804   3.092  16.150
  986    HB3  ASP 122           HB3      ASP 122 -14.560   1.442  16.733
  987    H    GLY 123           H        GLY 123 -12.241   0.704  18.503
  988    HA2  GLY 123           HA2      GLY 123 -12.324   1.226  21.376
  989    HA3  GLY 123           HA3      GLY 123 -13.435  -0.036  20.783
  990    H    TRP 124           H        TRP 124 -11.251  -0.561  22.564
  991    HA   TRP 124           HA       TRP 124 -10.215  -2.756  21.040
  992    HB2  TRP 124           HB2      TRP 124  -8.065  -2.274  20.827
  993    HB3  TRP 124           HB3      TRP 124  -8.464  -0.604  21.145
  994    HD1  TRP 124           HD1      TRP 124  -6.929  -3.701  22.721
  995    HE1  TRP 124           HE1      TRP 124  -5.744  -3.136  24.897
  996    HE3  TRP 124           HE3      TRP 124  -8.304   1.212  23.093
  997    HZ2  TRP 124           HZ2      TRP 124  -5.447  -0.804  26.640
  998    HZ3  TRP 124           HZ3      TRP 124  -7.531   2.595  25.010
  999    HH2  TRP 124           HH2      TRP 124  -6.113   1.590  26.788
 1000    H    ARG 125           H        ARG 125  -9.377  -4.447  22.464
 1001    HA   ARG 125           HA       ARG 125  -9.905  -4.134  25.326
 1002    HB2  ARG 125           HB2      ARG 125 -11.539  -5.909  25.493
 1003    HB3  ARG 125           HB3      ARG 125 -12.143  -4.676  24.394
 1004    HG2  ARG 125           HG2      ARG 125 -11.341  -6.126  22.458
 1005    HG3  ARG 125           HG3      ARG 125 -10.998  -7.401  23.619
 1006    HD2  ARG 125           HD2      ARG 125 -13.730  -6.095  23.215
 1007    HD3  ARG 125           HD3      ARG 125 -13.203  -7.606  22.457
 1008    HE   ARG 125           HE       ARG 125 -12.950  -7.670  25.350
 1009   HH11  ARG 125          HH11      ARG 125 -15.405  -7.911  22.787
 1010   HH12  ARG 125          HH12      ARG 125 -16.285  -9.187  23.569
 1011   HH21  ARG 125          HH21      ARG 125 -14.244  -9.223  26.469
 1012   HH22  ARG 125          HH22      ARG 125 -15.695  -9.824  25.752
 1013    H    TRP 126           H        TRP 126  -9.335  -6.224  26.457
 1014    HA   TRP 126           HA       TRP 126  -7.195  -7.713  25.021
 1015    HB2  TRP 126           HB2      TRP 126  -7.496  -6.960  27.944
 1016    HB3  TRP 126           HB3      TRP 126  -6.385  -8.191  27.371
 1017    HD1  TRP 126           HD1      TRP 126  -6.816  -4.361  27.345
 1018    HE1  TRP 126           HE1      TRP 126  -4.566  -3.310  26.958
 1019    HE3  TRP 126           HE3      TRP 126  -4.189  -8.562  26.057
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.918  -4.137  26.092
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.810  -8.385  25.419
 1022    HH2  TRP 126           HH2      TRP 126  -0.654  -6.171  25.476
 1023    H    VAL 127           H        VAL 127  -7.550  -9.924  24.839
 1024    HA   VAL 127           HA       VAL 127  -9.918 -11.162  26.172
 1025    HB   VAL 127           HB       VAL 127 -10.198 -12.137  23.694
 1026   HG11  VAL 127          HG11      VAL 127 -11.992 -11.050  24.889
 1027   HG12  VAL 127          HG12      VAL 127 -11.245  -9.453  24.676
 1028   HG13  VAL 127          HG13      VAL 127 -11.911 -10.314  23.277
 1029   HG21  VAL 127          HG21      VAL 127  -9.167  -9.373  23.014
 1030   HG22  VAL 127          HG22      VAL 127  -8.330 -10.910  22.680
 1031   HG23  VAL 127          HG23      VAL 127  -9.891 -10.572  21.922
 1032    H    SER 128           H        SER 128  -9.880 -13.525  26.223
 1033    HA   SER 128           HA       SER 128  -7.333 -14.803  26.196
 1034    HB2  SER 128           HB2      SER 128 -10.116 -15.999  25.838
 1035    HB3  SER 128           HB3      SER 128  -8.659 -16.862  26.375
 1036    HG   SER 128           HG       SER 128 -10.049 -16.175  28.130
 1037    H    TYR 129           H        TYR 129  -6.318 -16.069  24.541
 1038    HA   TYR 129           HA       TYR 129  -6.483 -14.928  22.023
 1039    HB2  TYR 129           HB2      TYR 129  -5.071 -17.113  21.412
 1040    HB3  TYR 129           HB3      TYR 129  -4.441 -15.745  22.297
 1041    HD1  TYR 129           HD2      TYR 129  -6.157 -19.036  22.973
 1042    HD2  TYR 129           HD1      TYR 129  -3.232 -16.133  24.261
 1043    HE1  TYR 129           HE2      TYR 129  -5.552 -20.498  24.870
 1044    HE2  TYR 129           HE1      TYR 129  -2.603 -17.608  26.147
 1045    HH   TYR 129           HH       TYR 129  -4.206 -20.770  26.767
 1046    H    TRP 130           H        TRP 130  -8.429 -17.740  23.036
 1047    HA   TRP 130           HA       TRP 130  -9.081 -18.267  20.212
 1048    HB2  TRP 130           HB2      TRP 130 -10.265 -19.498  22.709
 1049    HB3  TRP 130           HB3      TRP 130 -10.464 -20.068  21.050
 1050    HD1  TRP 130           HD1      TRP 130  -8.821 -21.221  23.872
 1051    HE1  TRP 130           HE1      TRP 130  -6.594 -22.405  23.460
 1052    HE3  TRP 130           HE3      TRP 130  -7.936 -19.698  19.038
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.546 -22.426  21.455
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.827 -20.318  17.915
 1055    HH2  TRP 130           HH2      TRP 130  -4.090 -21.605  19.131
 1056    H    TYR 131           H        TYR 131 -10.368 -16.176  22.681
 1057    HA   TYR 131           HA       TYR 131 -13.091 -16.147  21.857
 1058    HB2  TYR 131           HB2      TYR 131 -12.336 -15.324  23.989
 1059    HB3  TYR 131           HB3      TYR 131 -11.422 -14.028  23.222
 1060    HD1  TYR 131           HD1      TYR 131 -12.678 -12.186  21.959
 1061    HD2  TYR 131           HD2      TYR 131 -14.675 -15.092  24.457
 1062    HE1  TYR 131           HE1      TYR 131 -14.651 -10.713  22.092
 1063    HE2  TYR 131           HE2      TYR 131 -16.650 -13.614  24.603
 1064    HH   TYR 131           HH       TYR 131 -17.609 -11.571  23.965
 1065    HA   PRO 132           HA       PRO 132 -12.073 -12.363  19.059
 1066    HB2  PRO 132           HB2      PRO 132  -9.628 -12.301  17.765
 1067    HB3  PRO 132           HB3      PRO 132  -9.984 -11.473  19.324
 1068    HG2  PRO 132           HG2      PRO 132  -8.649 -14.148  18.925
 1069    HG3  PRO 132           HG3      PRO 132  -8.114 -12.767  19.940
 1070    HD2  PRO 132           HD2      PRO 132  -9.467 -14.788  21.015
 1071    HD3  PRO 132           HD3      PRO 132  -9.867 -13.127  21.510
 1072    H    VAL 133           H        VAL 133 -10.694 -15.587  18.382
 1073    HA   VAL 133           HA       VAL 133 -11.249 -15.618  15.589
 1074    HB   VAL 133           HB       VAL 133 -11.154 -17.963  17.534
 1075   HG11  VAL 133          HG11      VAL 133 -11.952 -18.525  15.225
 1076   HG12  VAL 133          HG12      VAL 133 -10.434 -17.855  14.578
 1077   HG13  VAL 133          HG13      VAL 133 -10.411 -19.284  15.635
 1078   HG21  VAL 133          HG21      VAL 133  -8.871 -16.537  16.086
 1079   HG22  VAL 133          HG22      VAL 133  -9.092 -16.643  17.848
 1080   HG23  VAL 133          HG23      VAL 133  -8.720 -18.099  16.930
 1081    H    ARG 134           H        ARG 134 -13.370 -16.082  18.435
 1082    HA   ARG 134           HA       ARG 134 -15.538 -17.362  16.986
 1083    HB2  ARG 134           HB2      ARG 134 -15.880 -15.604  19.451
 1084    HB3  ARG 134           HB3      ARG 134 -16.850 -16.976  18.930
 1085    HG2  ARG 134           HG2      ARG 134 -14.046 -17.166  20.051
 1086    HG3  ARG 134           HG3      ARG 134 -15.520 -17.377  20.977
 1087    HD2  ARG 134           HD2      ARG 134 -14.811 -19.032  18.539
 1088    HD3  ARG 134           HD3      ARG 134 -14.350 -19.481  20.206
 1089    HE   ARG 134           HE       ARG 134 -17.123 -19.001  20.217
 1090   HH11  ARG 134          HH11      ARG 134 -14.904 -21.383  18.783
 1091   HH12  ARG 134          HH12      ARG 134 -16.084 -22.643  18.721
 1092   HH21  ARG 134          HH21      ARG 134 -18.691 -20.675  20.122
 1093   HH22  ARG 134          HH22      ARG 134 -18.276 -22.233  19.507
 1094    H    GLN 135           H        GLN 135 -14.406 -14.033  17.194
 1095    HA   GLN 135           HA       GLN 135 -17.053 -12.909  16.888
 1096    HB2  GLN 135           HB2      GLN 135 -14.340 -11.628  17.039
 1097    HB3  GLN 135           HB3      GLN 135 -15.846 -10.720  16.940
 1098    HG2  GLN 135           HG2      GLN 135 -15.187 -12.797  19.062
 1099    HG3  GLN 135           HG3      GLN 135 -15.011 -11.058  19.300
 1100   HE21  GLN 135          HE22      GLN 135 -16.710 -13.154  20.719
 1101   HE22  GLN 135          HE21      GLN 135 -18.341 -12.534  20.628
 1102    H    VAL 136           H        VAL 136 -14.792 -14.128  14.582
 1103    HA   VAL 136           HA       VAL 136 -15.766 -12.236  12.489
 1104    HB   VAL 136           HB       VAL 136 -13.391 -12.931  11.555
 1105   HG11  VAL 136          HG11      VAL 136 -14.121 -10.671  11.740
 1106   HG12  VAL 136          HG12      VAL 136 -14.054 -10.723  13.527
 1107   HG13  VAL 136          HG13      VAL 136 -12.556 -10.764  12.597
 1108   HG21  VAL 136          HG21      VAL 136 -11.645 -13.067  13.099
 1109   HG22  VAL 136          HG22      VAL 136 -12.685 -12.653  14.480
 1110   HG23  VAL 136          HG23      VAL 136 -12.806 -14.247  13.716
 1111    H    VAL 137           H        VAL 137 -15.448 -12.958  10.245
 1112    HA   VAL 137           HA       VAL 137 -16.888 -15.436   9.843
 1113    HB   VAL 137           HB       VAL 137 -17.109 -14.785   7.611
 1114   HG11  VAL 137          HG11      VAL 137 -16.906 -12.081   8.993
 1115   HG12  VAL 137          HG12      VAL 137 -17.918 -12.541   7.618
 1116   HG13  VAL 137          HG13      VAL 137 -18.247 -13.235   9.214
 1117   HG21  VAL 137          HG21      VAL 137 -14.569 -13.157   7.961
 1118   HG22  VAL 137          HG22      VAL 137 -14.917 -14.496   6.841
 1119   HG23  VAL 137          HG23      VAL 137 -15.684 -12.923   6.580
 1120    H    SER 138           H        SER 138 -16.030 -16.840   7.908
 1121    HA   SER 138           HA       SER 138 -14.156 -18.503   8.986
 1122    HB2  SER 138           HB2      SER 138 -14.941 -18.222   6.061
 1123    HB3  SER 138           HB3      SER 138 -14.367 -19.707   6.867
 1124    HG   SER 138           HG       SER 138 -16.682 -19.611   6.706
 1125    H    PHE 139           H        PHE 139 -13.494 -16.345   6.086
 1126    HA   PHE 139           HA       PHE 139 -10.845 -17.356   5.913
 1127    HB2  PHE 139           HB2      PHE 139 -10.456 -15.778   4.182
 1128    HB3  PHE 139           HB3      PHE 139 -12.075 -16.411   4.003
 1129    HD1  PHE 139           HD2      PHE 139 -10.039 -13.418   4.809
 1130    HD2  PHE 139           HD1      PHE 139 -14.049 -14.932   4.255
 1131    HE1  PHE 139           HE2      PHE 139 -10.908 -11.099   4.669
 1132    HE2  PHE 139           HE1      PHE 139 -14.897 -12.613   4.132
 1133    HZ   PHE 139           HZ       PHE 139 -13.338 -10.693   4.346
 1134    H    LYS 140           H        LYS 140 -12.099 -14.382   7.445
 1135    HA   LYS 140           HA       LYS 140  -9.526 -13.332   8.228
 1136    HB2  LYS 140           HB2      LYS 140 -12.296 -12.998   9.495
 1137    HB3  LYS 140           HB3      LYS 140 -10.819 -12.150   9.993
 1138    HG2  LYS 140           HG2      LYS 140 -10.669 -11.124   7.725
 1139    HG3  LYS 140           HG3      LYS 140 -12.144 -11.978   7.248
 1140    HD2  LYS 140           HD2      LYS 140 -12.603  -9.623   7.875
 1141    HD3  LYS 140           HD3      LYS 140 -13.465 -10.768   8.934
 1142    HE2  LYS 140           HE2      LYS 140 -11.823 -10.549  10.667
 1143    HE3  LYS 140           HE3      LYS 140 -10.771  -9.538   9.666
 1144    HZ1  LYS 140           HZ1      LYS 140 -12.195  -8.228  11.284
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.371  -7.755   9.715
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.530  -8.654  10.433
 1147    H    ARG 141           H        ARG 141 -12.002 -15.152  10.091
 1148    HA   ARG 141           HA       ARG 141 -10.404 -15.373  12.389
 1149    HB2  ARG 141           HB2      ARG 141 -12.001 -16.718  13.321
 1150    HB3  ARG 141           HB3      ARG 141 -12.919 -15.803  12.141
 1151    HG2  ARG 141           HG2      ARG 141 -12.888 -17.761  10.631
 1152    HG3  ARG 141           HG3      ARG 141 -12.009 -18.705  11.844
 1153    HD2  ARG 141           HD2      ARG 141 -13.821 -18.618  13.389
 1154    HD3  ARG 141           HD3      ARG 141 -14.599 -17.315  12.511
 1155    HE   ARG 141           HE       ARG 141 -14.345 -20.099  11.454
 1156   HH11  ARG 141          HH11      ARG 141 -16.369 -17.184  11.980
 1157   HH12  ARG 141          HH12      ARG 141 -17.785 -17.910  11.290
 1158   HH21  ARG 141          HH21      ARG 141 -16.207 -20.977  10.454
 1159   HH22  ARG 141          HH22      ARG 141 -17.661 -20.061  10.321
 1160    H    ASP 142           H        ASP 142 -10.436 -17.553   9.520
 1161    HA   ASP 142           HA       ASP 142  -8.847 -19.569  10.724
 1162    HB2  ASP 142           HB2      ASP 142  -9.973 -19.928   8.599
 1163    HB3  ASP 142           HB3      ASP 142  -8.940 -18.702   7.825
 1164    H    VAL 143           H        VAL 143  -7.870 -16.557   8.998
 1165    HA   VAL 143           HA       VAL 143  -5.049 -17.055   9.213
 1166    HB   VAL 143           HB       VAL 143  -6.691 -14.506   8.930
 1167   HG11  VAL 143          HG11      VAL 143  -3.661 -14.767   8.894
 1168   HG12  VAL 143          HG12      VAL 143  -4.582 -13.340   8.381
 1169   HG13  VAL 143          HG13      VAL 143  -4.617 -13.828  10.070
 1170   HG21  VAL 143          HG21      VAL 143  -6.658 -16.049   6.979
 1171   HG22  VAL 143          HG22      VAL 143  -5.803 -14.546   6.627
 1172   HG23  VAL 143          HG23      VAL 143  -4.887 -16.022   6.989
 1173    H    TYR 144           H        TYR 144  -7.299 -15.170  11.349
 1174    HA   TYR 144           HA       TYR 144  -5.312 -14.559  13.265
 1175    HB2  TYR 144           HB2      TYR 144  -8.311 -14.911  13.585
 1176    HB3  TYR 144           HB3      TYR 144  -7.286 -14.120  14.758
 1177    HD1  TYR 144           HD1      TYR 144  -5.710 -12.837  11.976
 1178    HD2  TYR 144           HD2      TYR 144  -9.576 -12.750  13.883
 1179    HE1  TYR 144           HE1      TYR 144  -6.208 -10.734  10.825
 1180    HE2  TYR 144           HE2      TYR 144 -10.077 -10.594  12.723
 1181    HH   TYR 144           HH       TYR 144  -7.798  -9.043  10.443
 1182    H    ARG 145           H        ARG 145  -7.428 -17.394  13.039
 1183    HA   ARG 145           HA       ARG 145  -6.713 -18.759  15.403
 1184    HB2  ARG 145           HB2      ARG 145  -8.548 -19.522  14.148
 1185    HB3  ARG 145           HB3      ARG 145  -7.688 -19.418  12.629
 1186    HG2  ARG 145           HG2      ARG 145  -6.391 -21.437  13.150
 1187    HG3  ARG 145           HG3      ARG 145  -7.375 -21.636  14.633
 1188    HD2  ARG 145           HD2      ARG 145  -9.445 -21.481  13.111
 1189    HD3  ARG 145           HD3      ARG 145  -8.362 -21.520  11.734
 1190    HE   ARG 145           HE       ARG 145  -8.669 -23.684  13.790
 1191   HH11  ARG 145          HH11      ARG 145  -7.998 -22.874  10.317
 1192   HH12  ARG 145          HH12      ARG 145  -7.854 -24.536   9.896
 1193   HH21  ARG 145          HH21      ARG 145  -8.459 -25.838  13.128
 1194   HH22  ARG 145          HH22      ARG 145  -8.118 -26.235  11.486
 1195    H    ARG 146           H        ARG 146  -5.157 -18.977  12.091
 1196    HA   ARG 146           HA       ARG 146  -3.012 -20.606  12.936
 1197    HB2  ARG 146           HB2      ARG 146  -3.532 -18.714  10.615
 1198    HB3  ARG 146           HB3      ARG 146  -1.854 -19.125  10.975
 1199    HG2  ARG 146           HG2      ARG 146  -2.453 -20.729   9.432
 1200    HG3  ARG 146           HG3      ARG 146  -2.525 -21.555  10.987
 1201    HD2  ARG 146           HD2      ARG 146  -5.065 -21.120  10.919
 1202    HD3  ARG 146           HD3      ARG 146  -4.810 -20.620   9.233
 1203    HE   ARG 146           HE       ARG 146  -4.068 -23.302  10.386
 1204   HH11  ARG 146          HH11      ARG 146  -5.784 -21.616   7.748
 1205   HH12  ARG 146          HH12      ARG 146  -5.531 -22.896   6.612
 1206   HH21  ARG 146          HH21      ARG 146  -3.948 -25.059   8.938
 1207   HH22  ARG 146          HH22      ARG 146  -4.620 -24.941   7.356
 1208    H    VAL 147           H        VAL 147  -3.155 -16.967  12.899
 1209    HA   VAL 147           HA       VAL 147  -0.571 -16.555  13.873
 1210    HB   VAL 147           HB       VAL 147  -3.057 -14.907  14.562
 1211   HG11  VAL 147          HG11      VAL 147  -1.441 -13.021  14.703
 1212   HG12  VAL 147          HG12      VAL 147  -1.102 -14.263  15.925
 1213   HG13  VAL 147          HG13      VAL 147  -0.104 -14.179  14.459
 1214   HG21  VAL 147          HG21      VAL 147  -1.111 -14.604  12.250
 1215   HG22  VAL 147          HG22      VAL 147  -2.799 -15.106  12.099
 1216   HG23  VAL 147          HG23      VAL 147  -2.451 -13.496  12.662
 1217    H    MET 148           H        MET 148  -3.521 -17.315  15.667
 1218    HA   MET 148           HA       MET 148  -2.421 -16.752  18.246
 1219    HB2  MET 148           HB2      MET 148  -4.921 -18.255  17.426
 1220    HB3  MET 148           HB3      MET 148  -4.452 -17.982  19.109
 1221    HG2  MET 148           HG2      MET 148  -5.001 -15.775  17.102
 1222    HG3  MET 148           HG3      MET 148  -6.147 -16.408  18.254
 1223    HE1  MET 148           HE1      MET 148  -3.253 -13.077  18.787
 1224    HE2  MET 148           HE2      MET 148  -2.358 -14.556  18.357
 1225    HE3  MET 148           HE3      MET 148  -3.670 -13.960  17.312
 1226    H    LYS 149           H        LYS 149  -3.074 -19.857  16.471
 1227    HA   LYS 149           HA       LYS 149  -1.790 -21.452  18.498
 1228    HB2  LYS 149           HB2      LYS 149  -3.369 -22.455  17.223
 1229    HB3  LYS 149           HB3      LYS 149  -2.653 -21.963  15.671
 1230    HG2  LYS 149           HG2      LYS 149  -1.136 -23.792  17.522
 1231    HG3  LYS 149           HG3      LYS 149  -2.458 -24.444  16.542
 1232    HD2  LYS 149           HD2      LYS 149  -1.422 -23.983  14.496
 1233    HD3  LYS 149           HD3      LYS 149  -0.467 -22.665  15.169
 1234    HE2  LYS 149           HE2      LYS 149   1.073 -24.364  14.731
 1235    HE3  LYS 149           HE3      LYS 149   0.853 -24.258  16.490
 1236    HZ1  LYS 149           HZ1      LYS 149   0.904 -26.569  15.701
 1237    HZ2  LYS 149           HZ2      LYS 149  -0.548 -26.254  16.365
 1238    HZ3  LYS 149           HZ3      LYS 149  -0.382 -26.324  14.733
 1239    H    GLU 150           H        GLU 150  -0.400 -19.756  15.625
 1240    HA   GLU 150           HA       GLU 150   2.063 -20.935  15.696
 1241    HB2  GLU 150           HB2      GLU 150   1.070 -19.317  13.995
 1242    HB3  GLU 150           HB3      GLU 150   1.377 -18.026  15.134
 1243    HG2  GLU 150           HG2      GLU 150   3.285 -17.913  13.914
 1244    HG3  GLU 150           HG3      GLU 150   3.846 -19.044  15.119
 1245    H    PHE 151           H        PHE 151   0.818 -18.180  17.593
 1246    HA   PHE 151           HA       PHE 151   3.378 -17.959  19.069
 1247    HB2  PHE 151           HB2      PHE 151   0.884 -16.245  19.188
 1248    HB3  PHE 151           HB3      PHE 151   2.453 -15.881  19.870
 1249    HD1  PHE 151           HD2      PHE 151   4.150 -16.793  17.258
 1250    HD2  PHE 151           HD1      PHE 151   0.822 -14.098  17.998
 1251    HE1  PHE 151           HE2      PHE 151   4.423 -15.821  15.092
 1252    HE2  PHE 151           HE1      PHE 151   1.362 -12.922  15.907
 1253    HZ   PHE 151           HZ       PHE 151   3.096 -13.855  14.379
 1254    H    ALA 152           H        ALA 152   0.356 -19.515  19.588
 1255    HA   ALA 152           HA       ALA 152  -0.361 -18.987  22.160
 1256    HB1  ALA 152           HB1      ALA 152  -0.437 -21.666  20.662
 1257    HB2  ALA 152           HB2      ALA 152  -1.343 -21.319  22.148
 1258    HB3  ALA 152           HB3      ALA 152  -1.710 -20.439  20.663
 1259    H    SER 153           H        SER 153   2.112 -21.249  21.084
 1260    HA   SER 153           HA       SER 153   2.524 -22.447  23.657
 1261    HB2  SER 153           HB2      SER 153   4.391 -22.450  21.254
 1262    HB3  SER 153           HB3      SER 153   4.328 -23.648  22.562
 1263    HG   SER 153           HG       SER 153   3.211 -24.392  20.695
 1264    H    VAL 154           H        VAL 154   3.836 -19.608  22.044
 1265    HA   VAL 154           HA       VAL 154   6.086 -19.289  23.867
 1266    HB   VAL 154           HB       VAL 154   4.678 -17.198  22.148
 1267   HG11  VAL 154          HG11      VAL 154   6.811 -15.981  22.292
 1268   HG12  VAL 154          HG12      VAL 154   6.129 -16.238  23.910
 1269   HG13  VAL 154          HG13      VAL 154   7.481 -17.249  23.342
 1270   HG21  VAL 154          HG21      VAL 154   6.957 -19.105  21.467
 1271   HG22  VAL 154          HG22      VAL 154   5.407 -18.912  20.614
 1272   HG23  VAL 154          HG23      VAL 154   6.625 -17.639  20.541
 1273    H    VAL 155           H        VAL 155   2.686 -18.167  23.602
 1274    HA   VAL 155           HA       VAL 155   2.832 -16.314  25.668
 1275    HB   VAL 155           HB       VAL 155   0.384 -17.926  24.855
 1276   HG11  VAL 155          HG11      VAL 155  -0.079 -16.935  26.999
 1277   HG12  VAL 155          HG12      VAL 155   0.775 -15.426  26.569
 1278   HG13  VAL 155          HG13      VAL 155  -0.793 -15.847  25.802
 1279   HG21  VAL 155          HG21      VAL 155  -0.178 -15.930  23.525
 1280   HG22  VAL 155          HG22      VAL 155   1.333 -15.138  24.042
 1281   HG23  VAL 155          HG23      VAL 155   1.372 -16.576  22.997
 1282    H    MET 156           H        MET 156   2.030 -19.883  26.085
 1283    HA   MET 156           HA       MET 156   1.444 -19.671  28.783
 1284    HB2  MET 156           HB2      MET 156   2.884 -21.843  27.174
 1285    HB3  MET 156           HB3      MET 156   2.377 -22.096  28.851
 1286    HG2  MET 156           HG2      MET 156   0.302 -22.626  28.196
 1287    HG3  MET 156           HG3      MET 156   0.101 -21.003  27.553
 1288    HE1  MET 156           HE1      MET 156  -0.976 -20.764  25.414
 1289    HE2  MET 156           HE2      MET 156  -1.319 -22.164  24.372
 1290    HE3  MET 156           HE3      MET 156  -1.809 -22.185  26.083
 1291    H    SER 157           H        SER 157   4.579 -20.341  27.302
 1292    HA   SER 157           HA       SER 157   6.242 -20.307  29.598
 1293    HB2  SER 157           HB2      SER 157   6.349 -20.102  26.615
 1294    HB3  SER 157           HB3      SER 157   7.836 -19.650  27.498
 1295    HG   SER 157           HG       SER 157   7.624 -21.945  26.903
 1296    H    LEU 158           H        LEU 158   4.981 -17.665  27.606
 1297    HA   LEU 158           HA       LEU 158   6.605 -15.667  28.750
 1298    HB2  LEU 158           HB2      LEU 158   5.360 -15.857  26.491
 1299    HB3  LEU 158           HB3      LEU 158   3.894 -15.398  27.364
 1300    HG   LEU 158           HG       LEU 158   5.241 -13.789  25.951
 1301   HD11  LEU 158          HD11      LEU 158   4.588 -12.653  28.653
 1302   HD12  LEU 158          HD12      LEU 158   4.424 -11.918  27.021
 1303   HD13  LEU 158          HD13      LEU 158   3.328 -13.215  27.524
 1304   HD21  LEU 158          HD21      LEU 158   7.025 -12.487  26.971
 1305   HD22  LEU 158          HD22      LEU 158   6.915 -13.447  28.450
 1306   HD23  LEU 158          HD23      LEU 158   7.462 -14.207  26.921
 1307    H    GLN 159           H        GLN 159   3.692 -17.194  29.783
 1308    HA   GLN 159           HA       GLN 159   2.893 -15.033  31.677
 1309    HB2  GLN 159           HB2      GLN 159   1.805 -17.879  31.414
 1310    HB3  GLN 159           HB3      GLN 159   1.160 -16.593  32.421
 1311    HG2  GLN 159           HG2      GLN 159   0.629 -15.308  30.260
 1312    HG3  GLN 159           HG3      GLN 159   1.107 -16.763  29.399
 1313   HE21  GLN 159          HE22      GLN 159  -0.992 -16.037  32.263
 1314   HE22  GLN 159          HE21      GLN 159  -2.272 -17.145  31.770
 1315    H    GLU 160           H        GLU 160   4.168 -18.274  31.554
 1316    HA   GLU 160           HA       GLU 160   4.431 -18.908  34.274
 1317    HB2  GLU 160           HB2      GLU 160   5.811 -19.690  31.702
 1318    HB3  GLU 160           HB3      GLU 160   6.266 -20.471  33.205
 1319    HG2  GLU 160           HG2      GLU 160   3.357 -20.430  32.352
 1320    HG3  GLU 160           HG3      GLU 160   4.475 -21.657  31.754
 1321    H    ASN 161           H        ASN 161   6.561 -17.532  31.905
 1322    HA   ASN 161           HA       ASN 161   8.708 -16.987  31.793
 1323    HB2  ASN 161           HB2      ASN 161   7.339 -15.263  33.626
 1324    HB3  ASN 161           HB3      ASN 161   9.075 -15.290  34.028
 1325   HD21  ASN 161          HD22      ASN 161   7.506 -15.797  30.829
 1326   HD22  ASN 161          HD21      ASN 161   8.207 -14.363  30.073
 1327    H    THR 162           H        THR 162   8.297 -19.352  32.528
 1328    HA   THR 162           HA       THR 162  11.055 -19.888  33.328
 1329    HB   THR 162           HB       THR 162  10.064 -20.111  35.462
 1330    HG1  THR 162           HG1      THR 162  11.508 -21.693  35.233
 1331   HG21  THR 162          HG21      THR 162   7.942 -21.933  34.290
 1332   HG22  THR 162          HG22      THR 162   8.280 -21.731  36.026
 1333   HG23  THR 162          HG23      THR 162   7.734 -20.350  35.076
 1334    HA   PRO 163           HA       PRO 163   9.399 -22.132  29.582
 1335    HB2  PRO 163           HB2      PRO 163  11.271 -21.259  27.804
 1336    HB3  PRO 163           HB3      PRO 163   9.718 -20.431  28.067
 1337    HG2  PRO 163           HG2      PRO 163  12.402 -19.787  29.335
 1338    HG3  PRO 163           HG3      PRO 163  11.260 -18.641  28.538
 1339    HD2  PRO 163           HD2      PRO 163  11.306 -18.945  31.223
 1340    HD3  PRO 163           HD3      PRO 163   9.743 -18.739  30.346
 1341    H    LYS 164           H        LYS 164  10.864 -23.707  28.369
 1342    HA   LYS 164           HA       LYS 164  12.991 -24.624  30.224
 1343    HB2  LYS 164           HB2      LYS 164  11.020 -26.385  28.734
 1344    HB3  LYS 164           HB3      LYS 164  12.104 -26.852  30.034
 1345    HG2  LYS 164           HG2      LYS 164   9.708 -24.954  30.312
 1346    HG3  LYS 164           HG3      LYS 164   9.693 -26.677  30.697
 1347    HD2  LYS 164           HD2      LYS 164  11.442 -26.290  32.455
 1348    HD3  LYS 164           HD3      LYS 164  11.374 -24.553  32.102
 1349    HE2  LYS 164           HE2      LYS 164   8.877 -24.647  32.575
 1350    HE3  LYS 164           HE3      LYS 164   9.106 -26.314  33.133
 1351    HZ1  LYS 164           HZ1      LYS 164  10.676 -25.399  34.811
 1352    HZ2  LYS 164           HZ2      LYS 164  10.295 -23.863  34.341
 1353    HZ3  LYS 164           HZ3      LYS 164   9.158 -24.830  34.998
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1  -1.274   0.845  -1.821
    2    H2   MET   1           H2       MET   1  -0.836   0.190  -0.387
    3    H3   MET   1           H3       MET   1  -0.202   1.626  -0.873
    4    HA   MET   1           HA       MET   1   0.943   0.599  -2.705
    5    HB2  MET   1           HB2      MET   1   1.927   0.689  -0.258
    6    HB3  MET   1           HB3      MET   1   1.707  -1.054  -0.254
    7    HG2  MET   1           HG2      MET   1   3.363   0.573  -2.221
    8    HG3  MET   1           HG3      MET   1   3.969  -0.353  -0.852
    9    HE1  MET   1           HE1      MET   1   4.413  -3.851  -1.983
   10    HE2  MET   1           HE2      MET   1   5.234  -2.484  -1.190
   11    HE3  MET   1           HE3      MET   1   3.623  -2.985  -0.632
   12    H    ILE   2           H        ILE   2   0.827  -0.995  -4.265
   13    HA   ILE   2           HA       ILE   2   0.124  -3.751  -3.504
   14    HB   ILE   2           HB       ILE   2  -1.033  -2.387  -5.974
   15   HG12  ILE   2          HG12      ILE   2  -2.119  -2.931  -3.239
   16   HG13  ILE   2          HG13      ILE   2  -2.459  -1.607  -4.356
   17   HG21  ILE   2          HG21      ILE   2  -2.101  -4.564  -6.389
   18   HG22  ILE   2          HG22      ILE   2  -0.355  -4.782  -6.303
   19   HG23  ILE   2          HG23      ILE   2  -1.374  -5.236  -4.915
   20   HD11  ILE   2          HD11      ILE   2  -3.911  -3.277  -5.655
   21   HD12  ILE   2          HD12      ILE   2  -3.546  -4.431  -4.319
   22   HD13  ILE   2          HD13      ILE   2  -4.423  -2.918  -3.994
   23    H    ASP   3           H        ASP   3   1.803  -5.043  -4.364
   24    HA   ASP   3           HA       ASP   3   4.138  -3.752  -5.089
   25    HB2  ASP   3           HB2      ASP   3   4.083  -5.930  -3.990
   26    HB3  ASP   3           HB3      ASP   3   3.434  -6.659  -5.474
   27    H    ASP   4           H        ASP   4   2.460  -6.087  -7.219
   28    HA   ASP   4           HA       ASP   4   2.691  -4.394  -9.523
   29    HB2  ASP   4           HB2      ASP   4   5.025  -5.165  -9.441
   30    HB3  ASP   4           HB3      ASP   4   4.483  -6.832  -9.293
   31    H    ASP   5           H        ASP   5   2.468  -7.807  -8.551
   32    HA   ASP   5           HA       ASP   5   0.872  -8.473 -10.842
   33    HB2  ASP   5           HB2      ASP   5   2.722  -9.865  -9.929
   34    HB3  ASP   5           HB3      ASP   5   1.698 -10.252  -8.540
   35    H    GLY   6           H        GLY   6  -0.193  -6.846  -8.407
   36    HA2  GLY   6           HA2      GLY   6  -2.424  -6.414  -7.822
   37    HA3  GLY   6           HA3      GLY   6  -2.910  -8.001  -8.413
   38    H    TYR   7           H        TYR   7  -0.284  -8.732  -6.566
   39    HA   TYR   7           HA       TYR   7  -1.877  -9.038  -4.081
   40    HB2  TYR   7           HB2      TYR   7   0.782 -10.318  -4.799
   41    HB3  TYR   7           HB3      TYR   7  -0.143 -10.556  -3.314
   42    HD1  TYR   7           HD2      TYR   7  -2.323 -11.738  -3.328
   43    HD2  TYR   7           HD1      TYR   7   0.160 -11.513  -6.840
   44    HE1  TYR   7           HE2      TYR   7  -3.632 -13.573  -4.363
   45    HE2  TYR   7           HE1      TYR   7  -1.109 -13.354  -7.877
   46    HH   TYR   7           HH       TYR   7  -2.890 -14.863  -7.649
   47    H    ARG   8           H        ARG   8  -0.808  -8.448  -2.047
   48    HA   ARG   8           HA       ARG   8   1.211  -6.289  -2.313
   49    HB2  ARG   8           HB2      ARG   8  -0.181  -4.721  -1.049
   50    HB3  ARG   8           HB3      ARG   8  -1.022  -5.259  -2.521
   51    HG2  ARG   8           HG2      ARG   8  -2.261  -6.942  -1.101
   52    HG3  ARG   8           HG3      ARG   8  -1.609  -6.110   0.333
   53    HD2  ARG   8           HD2      ARG   8  -3.038  -4.632  -1.888
   54    HD3  ARG   8           HD3      ARG   8  -3.947  -5.477  -0.628
   55    HE   ARG   8           HE       ARG   8  -2.119  -3.125  -0.309
   56   HH11  ARG   8          HH11      ARG   8  -4.478  -5.338   1.255
   57   HH12  ARG   8          HH12      ARG   8  -4.823  -4.241   2.548
   58   HH21  ARG   8          HH22      ARG   8  -2.566  -1.723   1.475
   59   HH22  ARG   8          HH21      ARG   8  -3.698  -2.181   2.692
   60    HA   PRO   9           HA       PRO   9   2.521  -8.617   1.232
   61    HB2  PRO   9           HB2      PRO   9   4.899  -7.468   1.783
   62    HB3  PRO   9           HB3      PRO   9   4.587  -8.278   0.226
   63    HG2  PRO   9           HG2      PRO   9   4.478  -5.296   0.796
   64    HG3  PRO   9           HG3      PRO   9   5.283  -6.145  -0.555
   65    HD2  PRO   9           HD2      PRO   9   2.753  -5.015  -0.670
   66    HD3  PRO   9           HD3      PRO   9   3.295  -6.380  -1.689
   67    H    ASN  10           H        ASN  10   2.089  -8.633   3.447
   68    HA   ASN  10           HA       ASN  10   1.635  -6.041   4.847
   69    HB2  ASN  10           HB2      ASN  10  -0.446  -6.776   3.710
   70    HB3  ASN  10           HB3      ASN  10  -0.299  -8.360   4.447
   71   HD21  ASN  10          HD22      ASN  10  -1.522  -5.110   4.897
   72   HD22  ASN  10          HD21      ASN  10  -2.132  -5.386   6.508
   73    H    VAL  11           H        VAL  11   1.488  -6.314   7.215
   74    HA   VAL  11           HA       VAL  11   2.315  -8.914   8.222
   75    HB   VAL  11           HB       VAL  11   4.073  -8.035   9.684
   76   HG11  VAL  11          HG11      VAL  11   5.808  -7.607   8.149
   77   HG12  VAL  11          HG12      VAL  11   4.745  -8.909   7.559
   78   HG13  VAL  11          HG13      VAL  11   4.614  -7.284   6.880
   79   HG21  VAL  11          HG21      VAL  11   4.987  -5.811   9.419
   80   HG22  VAL  11          HG22      VAL  11   3.670  -5.346   8.317
   81   HG23  VAL  11          HG23      VAL  11   3.337  -5.727  10.030
   82    H    GLY  12           H        GLY  12   1.793  -9.204  10.473
   83    HA2  GLY  12           HA2      GLY  12  -0.177  -7.228  11.531
   84    HA3  GLY  12           HA3      GLY  12  -0.535  -8.936  11.466
   85    H    ILE  13           H        ILE  13  -0.537  -7.449  13.862
   86    HA   ILE  13           HA       ILE  13   1.889  -8.394  15.312
   87    HB   ILE  13           HB       ILE  13   0.297  -5.809  15.450
   88   HG12  ILE  13          HG12      ILE  13   3.136  -5.376  15.498
   89   HG13  ILE  13          HG13      ILE  13   2.803  -6.510  14.192
   90   HG21  ILE  13          HG21      ILE  13   1.636  -5.152  17.376
   91   HG22  ILE  13          HG22      ILE  13   0.665  -6.557  17.753
   92   HG23  ILE  13          HG23      ILE  13   2.406  -6.766  17.426
   93   HD11  ILE  13          HD11      ILE  13   1.435  -3.809  14.583
   94   HD12  ILE  13          HD12      ILE  13   2.734  -4.155  13.427
   95   HD13  ILE  13          HD13      ILE  13   1.144  -4.935  13.232
   96    H    VAL  14           H        VAL  14   1.478  -9.423  17.209
   97    HA   VAL  14           HA       VAL  14  -1.291  -9.421  18.306
   98    HB   VAL  14           HB       VAL  14   0.627 -11.805  18.223
   99   HG11  VAL  14          HG11      VAL  14  -2.259 -11.579  19.164
  100   HG12  VAL  14          HG12      VAL  14  -1.277 -13.070  19.135
  101   HG13  VAL  14          HG13      VAL  14  -0.842 -11.755  20.215
  102   HG21  VAL  14          HG21      VAL  14  -0.179 -11.513  15.973
  103   HG22  VAL  14          HG22      VAL  14  -1.057 -12.860  16.708
  104   HG23  VAL  14          HG23      VAL  14  -1.853 -11.278  16.542
  105    H    ILE  15           H        ILE  15  -1.209  -8.943  20.552
  106    HA   ILE  15           HA       ILE  15   1.480  -9.070  21.776
  107    HB   ILE  15           HB       ILE  15  -0.591  -7.101  22.740
  108   HG12  ILE  15          HG12      ILE  15   0.085  -6.383  20.452
  109   HG13  ILE  15          HG13      ILE  15   0.586  -5.272  21.722
  110   HG21  ILE  15          HG21      ILE  15   1.154  -7.904  24.355
  111   HG22  ILE  15          HG22      ILE  15   2.409  -7.331  23.257
  112   HG23  ILE  15          HG23      ILE  15   1.275  -6.178  23.984
  113   HD11  ILE  15          HD11      ILE  15   2.878  -5.977  21.565
  114   HD12  ILE  15          HD12      ILE  15   2.451  -7.343  20.493
  115   HD13  ILE  15          HD13      ILE  15   2.290  -5.662  19.928
  116    H    CYS  16           H        CYS  16   1.572 -10.347  23.583
  117    HA   CYS  16           HA       CYS  16  -1.041 -11.336  24.645
  118    HB2  CYS  16           HB2      CYS  16   1.527 -12.967  24.581
  119    HB3  CYS  16           HB3      CYS  16  -0.074 -13.479  25.148
  120    HG   CYS  16           HG       CYS  16   0.710 -12.407  22.093
  121    H    ASN  17           H        ASN  17  -1.195 -11.481  26.883
  122    HA   ASN  17           HA       ASN  17   0.915 -10.023  28.405
  123    HB2  ASN  17           HB2      ASN  17  -0.749  -9.278  29.924
  124    HB3  ASN  17           HB3      ASN  17  -1.336  -8.952  28.303
  125   HD21  ASN  17          HD22      ASN  17  -3.364  -8.734  29.829
  126   HD22  ASN  17          HD21      ASN  17  -4.288 -10.207  30.034
  127    H    ARG  18           H        ARG  18   0.863 -10.938  30.887
  128    HA   ARG  18           HA       ARG  18   1.638 -13.745  30.522
  129    HB2  ARG  18           HB2      ARG  18   1.663 -12.030  33.055
  130    HB3  ARG  18           HB3      ARG  18   2.308 -13.663  32.900
  131    HG2  ARG  18           HG2      ARG  18   4.207 -12.659  32.514
  132    HG3  ARG  18           HG3      ARG  18   3.628 -12.630  30.854
  133    HD2  ARG  18           HD2      ARG  18   3.155 -10.335  30.910
  134    HD3  ARG  18           HD3      ARG  18   3.061 -10.282  32.689
  135    HE   ARG  18           HE       ARG  18   5.600 -10.947  32.472
  136   HH11  ARG  18          HH11      ARG  18   3.855  -8.215  30.979
  137   HH12  ARG  18          HH12      ARG  18   5.289  -7.315  30.654
  138   HH21  ARG  18          HH21      ARG  18   7.485  -9.796  31.985
  139   HH22  ARG  18          HH22      ARG  18   7.390  -8.173  31.381
  140    H    GLN  19           H        GLN  19  -1.328 -12.534  30.797
  141    HA   GLN  19           HA       GLN  19  -2.361 -14.460  32.757
  142    HB2  GLN  19           HB2      GLN  19  -4.066 -12.509  31.207
  143    HB3  GLN  19           HB3      GLN  19  -4.406 -13.260  32.756
  144    HG2  GLN  19           HG2      GLN  19  -2.380 -11.071  32.173
  145    HG3  GLN  19           HG3      GLN  19  -3.930 -10.869  32.960
  146   HE21  GLN  19          HE22      GLN  19  -1.653  -9.903  34.254
  147   HE22  GLN  19          HE21      GLN  19  -1.309 -10.892  35.653
  148    H    GLY  20           H        GLY  20  -1.574 -14.469  29.468
  149    HA2  GLY  20           HA2      GLY  20  -2.155 -15.979  27.814
  150    HA3  GLY  20           HA3      GLY  20  -3.312 -16.750  28.899
  151    H    GLN  21           H        GLN  21  -3.244 -13.186  28.179
  152    HA   GLN  21           HA       GLN  21  -5.669 -13.578  26.475
  153    HB2  GLN  21           HB2      GLN  21  -4.939 -11.135  28.104
  154    HB3  GLN  21           HB3      GLN  21  -6.374 -11.337  27.123
  155    HG2  GLN  21           HG2      GLN  21  -5.740 -13.033  29.586
  156    HG3  GLN  21           HG3      GLN  21  -6.707 -11.569  29.610
  157   HE21  GLN  21          HE22      GLN  21  -6.635 -14.945  28.284
  158   HE22  GLN  21          HE21      GLN  21  -8.370 -15.022  28.047
  159    H    VAL  22           H        VAL  22  -5.788 -12.185  24.670
  160    HA   VAL  22           HA       VAL  22  -3.242 -11.045  23.697
  161    HB   VAL  22           HB       VAL  22  -3.855 -11.636  21.456
  162   HG11  VAL  22          HG11      VAL  22  -4.260 -14.142  23.138
  163   HG12  VAL  22          HG12      VAL  22  -3.495 -14.003  21.524
  164   HG13  VAL  22          HG13      VAL  22  -2.706 -13.324  22.957
  165   HG21  VAL  22          HG21      VAL  22  -6.299 -11.477  21.456
  166   HG22  VAL  22          HG22      VAL  22  -5.813 -13.084  20.910
  167   HG23  VAL  22          HG23      VAL  22  -6.443 -12.861  22.556
  168    H    MET  23           H        MET  23  -3.501  -9.019  22.516
  169    HA   MET  23           HA       MET  23  -5.878  -7.494  23.331
  170    HB2  MET  23           HB2      MET  23  -4.936  -5.634  22.098
  171    HB3  MET  23           HB3      MET  23  -3.788  -6.317  23.250
  172    HG2  MET  23           HG2      MET  23  -2.497  -7.332  21.522
  173    HG3  MET  23           HG3      MET  23  -3.748  -7.091  20.309
  174    HE1  MET  23           HE1      MET  23  -3.142  -3.970  22.648
  175    HE2  MET  23           HE2      MET  23  -1.685  -4.959  22.918
  176    HE3  MET  23           HE3      MET  23  -1.563  -3.404  22.066
  177    H    TRP  24           H        TRP  24  -7.486  -6.663  21.989
  178    HA   TRP  24           HA       TRP  24  -7.681  -7.517  19.170
  179    HB2  TRP  24           HB2      TRP  24  -8.707  -9.216  20.680
  180    HB3  TRP  24           HB3      TRP  24  -9.718  -7.974  21.394
  181    HD1  TRP  24           HD1      TRP  24 -12.023  -8.681  20.805
  182    HE1  TRP  24           HE1      TRP  24 -13.313  -9.512  18.773
  183    HE3  TRP  24           HE3      TRP  24  -8.132  -9.086  17.542
  184    HZ2  TRP  24           HZ2      TRP  24 -12.701 -10.380  16.086
  185    HZ3  TRP  24           HZ3      TRP  24  -8.473 -10.119  15.316
  186    HH2  TRP  24           HH2      TRP  24 -10.784 -10.702  14.560
  187    H    ALA  25           H        ALA  25  -8.588  -5.630  18.009
  188    HA   ALA  25           HA       ALA  25  -9.569  -3.390  19.719
  189    HB1  ALA  25           HB1      ALA  25  -7.103  -3.142  19.491
  190    HB2  ALA  25           HB2      ALA  25  -7.270  -3.176  17.725
  191    HB3  ALA  25           HB3      ALA  25  -7.979  -1.847  18.670
  192    H    ARG  26           H        ARG  26 -10.838  -1.801  18.584
  193    HA   ARG  26           HA       ARG  26 -11.955  -2.862  16.024
  194    HB2  ARG  26           HB2      ARG  26 -14.016  -1.567  16.522
  195    HB3  ARG  26           HB3      ARG  26 -13.733  -2.984  17.529
  196    HG2  ARG  26           HG2      ARG  26 -13.306  -1.732  19.441
  197    HG3  ARG  26           HG3      ARG  26 -12.735  -0.352  18.528
  198    HD2  ARG  26           HD2      ARG  26 -14.767   0.208  19.647
  199    HD3  ARG  26           HD3      ARG  26 -14.965   0.298  17.889
  200    HE   ARG  26           HE       ARG  26 -15.867  -2.235  18.553
  201   HH11  ARG  26          HH11      ARG  26 -16.691   1.130  19.435
  202   HH12  ARG  26          HH12      ARG  26 -18.335   0.757  19.851
  203   HH21  ARG  26          HH21      ARG  26 -18.103  -2.695  19.006
  204   HH22  ARG  26          HH22      ARG  26 -19.150  -1.457  19.588
  205    H    ARG  27           H        ARG  27 -11.919  -1.528  14.156
  206    HA   ARG  27           HA       ARG  27 -10.111   0.768  14.467
  207    HB2  ARG  27           HB2      ARG  27  -9.690  -0.720  12.677
  208    HB3  ARG  27           HB3      ARG  27 -11.332  -0.600  12.062
  209    HG2  ARG  27           HG2      ARG  27 -10.958   1.736  11.383
  210    HG3  ARG  27           HG3      ARG  27  -9.372   1.748  12.157
  211    HD2  ARG  27           HD2      ARG  27  -8.396   0.388  10.511
  212    HD3  ARG  27           HD3      ARG  27  -9.941  -0.322  10.040
  213    HE   ARG  27           HE       ARG  27 -10.293   1.322   8.535
  214   HH11  ARG  27          HH21      ARG  27  -7.672   2.469  10.703
  215   HH12  ARG  27          HH22      ARG  27  -7.375   3.882   9.769
  216   HH21  ARG  27          HH11      ARG  27  -9.871   3.229   7.320
  217   HH22  ARG  27          HH12      ARG  27  -8.636   4.326   7.813
  218    H    PHE  28           H        PHE  28 -10.594   2.899  13.989
  219    HA   PHE  28           HA       PHE  28 -12.958   3.833  15.140
  220    HB2  PHE  28           HB2      PHE  28 -10.819   5.022  15.024
  221    HB3  PHE  28           HB3      PHE  28 -10.981   5.207  13.282
  222    HD1  PHE  28           HD1      PHE  28 -12.667   6.091  16.539
  223    HD2  PHE  28           HD2      PHE  28 -11.947   7.186  12.425
  224    HE1  PHE  28           HE1      PHE  28 -13.761   8.283  16.925
  225    HE2  PHE  28           HE2      PHE  28 -13.009   9.385  12.826
  226    HZ   PHE  28           HZ       PHE  28 -13.939   9.932  15.073
  227    H    GLY  29           H        GLY  29 -14.955   4.359  14.410
  228    HA2  GLY  29           HA2      GLY  29 -16.739   4.646  13.036
  229    HA3  GLY  29           HA3      GLY  29 -15.642   4.790  11.660
  230    H    GLN  30           H        GLN  30 -14.716   1.840  12.838
  231    HA   GLN  30           HA       GLN  30 -16.491   0.475  10.899
  232    HB2  GLN  30           HB2      GLN  30 -14.137  -0.783  12.325
  233    HB3  GLN  30           HB3      GLN  30 -14.908  -1.268  10.818
  234    HG2  GLN  30           HG2      GLN  30 -13.078   1.076  11.333
  235    HG3  GLN  30           HG3      GLN  30 -12.775  -0.313  10.313
  236   HE21  GLN  30          HE22      GLN  30 -13.560   2.959  10.186
  237   HE22  GLN  30          HE21      GLN  30 -14.317   2.988   8.605
  238    H    HIS  31           H        HIS  31 -15.542   0.365  14.299
  239    HA   HIS  31           HA       HIS  31 -16.348  -0.548  16.149
  240    HB2  HIS  31           HB2      HIS  31 -18.973  -1.124  14.777
  241    HB3  HIS  31           HB3      HIS  31 -18.673  -0.862  16.487
  242    HD1  HIS  31           HD1      HIS  31 -19.840   0.999  13.534
  243    HD2  HIS  31           HD2      HIS  31 -17.523   1.822  16.955
  244    HE1  HIS  31           HE1      HIS  31 -19.773   3.534  13.765
  245    H    SER  32           H        SER  32 -16.572  -2.615  13.296
  246    HA   SER  32           HA       SER  32 -16.556  -5.112  14.683
  247    HB2  SER  32           HB2      SER  32 -15.372  -4.416  11.958
  248    HB3  SER  32           HB3      SER  32 -15.876  -6.018  12.525
  249    HG   SER  32           HG       SER  32 -17.491  -5.035  11.205
  250    H    TRP  33           H        TRP  33 -14.719  -6.561  14.936
  251    HA   TRP  33           HA       TRP  33 -12.400  -5.054  15.995
  252    HB2  TRP  33           HB2      TRP  33 -13.517  -7.772  16.667
  253    HB3  TRP  33           HB3      TRP  33 -12.144  -6.964  17.444
  254    HD1  TRP  33           HD1      TRP  33 -15.979  -6.596  17.120
  255    HE1  TRP  33           HE1      TRP  33 -16.849  -5.209  19.062
  256    HE3  TRP  33           HE3      TRP  33 -11.516  -5.373  19.245
  257    HZ2  TRP  33           HZ2      TRP  33 -15.715  -3.574  21.215
  258    HZ3  TRP  33           HZ3      TRP  33 -11.414  -3.817  21.172
  259    HH2  TRP  33           HH2      TRP  33 -13.508  -2.915  22.161
  260    H    GLN  34           H        GLN  34 -10.269  -5.857  15.830
  261    HA   GLN  34           HA       GLN  34  -9.588  -7.957  13.932
  262    HB2  GLN  34           HB2      GLN  34  -8.261  -6.388  12.501
  263    HB3  GLN  34           HB3      GLN  34  -9.989  -6.089  12.382
  264    HG2  GLN  34           HG2      GLN  34  -9.861  -4.090  13.693
  265    HG3  GLN  34           HG3      GLN  34  -8.245  -4.463  14.283
  266   HE21  GLN  34          HE22      GLN  34  -6.399  -4.391  12.735
  267   HE22  GLN  34          HE21      GLN  34  -6.514  -3.243  11.422
  268    H    PHE  35           H        PHE  35  -7.152  -8.108  13.753
  269    HA   PHE  35           HA       PHE  35  -5.795  -7.410  16.294
  270    HB2  PHE  35           HB2      PHE  35  -4.891  -8.929  13.818
  271    HB3  PHE  35           HB3      PHE  35  -3.896  -8.653  15.251
  272    HD1  PHE  35           HD1      PHE  35  -5.749  -9.284  17.478
  273    HD2  PHE  35           HD2      PHE  35  -5.011 -11.341  13.721
  274    HE1  PHE  35           HE1      PHE  35  -6.524 -11.393  18.476
  275    HE2  PHE  35           HE2      PHE  35  -5.657 -13.450  14.807
  276    HZ   PHE  35           HZ       PHE  35  -6.526 -13.485  17.132
  277    HA   PRO  36           HA       PRO  36  -3.996  -3.825  14.283
  278    HB2  PRO  36           HB2      PRO  36  -1.472  -3.673  15.449
  279    HB3  PRO  36           HB3      PRO  36  -2.991  -3.148  16.238
  280    HG2  PRO  36           HG2      PRO  36  -1.542  -5.773  16.572
  281    HG3  PRO  36           HG3      PRO  36  -2.260  -4.723  17.824
  282    HD2  PRO  36           HD2      PRO  36  -3.514  -6.942  16.847
  283    HD3  PRO  36           HD3      PRO  36  -4.437  -5.471  17.306
  284    H    GLN  37           H        GLN  37  -2.938  -3.527  12.277
  285    HA   GLN  37           HA       GLN  37  -0.772  -5.263  11.436
  286    HB2  GLN  37           HB2      GLN  37  -1.966  -6.410   9.616
  287    HB3  GLN  37           HB3      GLN  37  -2.651  -6.825  11.176
  288    HG2  GLN  37           HG2      GLN  37  -4.410  -4.927  10.653
  289    HG3  GLN  37           HG3      GLN  37  -3.837  -5.102   8.992
  290   HE21  GLN  37          HE22      GLN  37  -5.521  -6.695  11.703
  291   HE22  GLN  37          HE21      GLN  37  -6.224  -7.982  10.728
  292    H    GLY  38           H        GLY  38  -0.190  -4.846   9.021
  293    HA2  GLY  38           HA2      GLY  38  -1.161  -2.449   7.755
  294    HA3  GLY  38           HA3      GLY  38   0.285  -2.125   8.713
  295    H    GLY  39           H        GLY  39   0.634  -1.623   6.078
  296    HA2  GLY  39           HA2      GLY  39   1.283  -3.998   4.542
  297    HA3  GLY  39           HA3      GLY  39   1.260  -2.327   3.991
  298    H    ILE  40           H        ILE  40   3.240  -4.334   3.636
  299    HA   ILE  40           HA       ILE  40   5.699  -3.325   4.981
  300    HB   ILE  40           HB       ILE  40   5.217  -5.431   2.841
  301   HG12  ILE  40          HG12      ILE  40   6.351  -5.889   5.610
  302   HG13  ILE  40          HG13      ILE  40   4.616  -5.906   5.317
  303   HG21  ILE  40          HG21      ILE  40   7.626  -6.052   3.080
  304   HG22  ILE  40          HG22      ILE  40   7.429  -4.436   2.436
  305   HG23  ILE  40          HG23      ILE  40   7.856  -4.669   4.150
  306   HD11  ILE  40          HD11      ILE  40   5.940  -8.148   5.313
  307   HD12  ILE  40          HD12      ILE  40   4.712  -7.862   4.058
  308   HD13  ILE  40          HD13      ILE  40   6.440  -7.718   3.687
  309    H    ASN  41           H        ASN  41   6.751  -1.570   4.134
  310    HA   ASN  41           HA       ASN  41   5.759  -0.307   1.682
  311    HB2  ASN  41           HB2      ASN  41   8.091   0.354   3.538
  312    HB3  ASN  41           HB3      ASN  41   7.697   1.288   2.115
  313   HD21  ASN  41          HD22      ASN  41   6.528   0.285   5.310
  314   HD22  ASN  41          HD21      ASN  41   5.240   1.490   5.426
  315    HA   PRO  42           HA       PRO  42   8.321  -2.497  -1.133
  316    HB2  PRO  42           HB2      PRO  42   9.391  -0.605  -2.858
  317    HB3  PRO  42           HB3      PRO  42   7.707  -1.208  -2.914
  318    HG2  PRO  42           HG2      PRO  42   8.741   1.310  -1.582
  319    HG3  PRO  42           HG3      PRO  42   7.316   1.119  -2.653
  320    HD2  PRO  42           HD2      PRO  42   7.017   1.175   0.024
  321    HD3  PRO  42           HD3      PRO  42   6.073   0.022  -0.963
  322    H    GLY  43           H        GLY  43  10.216  -3.435  -0.546
  323    HA2  GLY  43           HA2      GLY  43  12.501  -3.625  -0.259
  324    HA3  GLY  43           HA3      GLY  43  12.669  -1.876  -0.134
  325    H    GLU  44           H        GLU  44  10.197  -2.557   2.069
  326    HA   GLU  44           HA       GLU  44  11.965  -2.593   4.355
  327    HB2  GLU  44           HB2      GLU  44   9.123  -2.167   3.857
  328    HB3  GLU  44           HB3      GLU  44   9.327  -3.369   5.133
  329    HG2  GLU  44           HG2      GLU  44  10.413  -1.934   6.549
  330    HG3  GLU  44           HG3      GLU  44  10.890  -0.827   5.237
  331    H    SER  45           H        SER  45  11.940  -4.277   6.002
  332    HA   SER  45           HA       SER  45  11.523  -7.024   4.946
  333    HB2  SER  45           HB2      SER  45  12.840  -7.636   7.023
  334    HB3  SER  45           HB3      SER  45  13.734  -6.770   5.767
  335    HG   SER  45           HG       SER  45  14.211  -5.846   7.746
  336    H    ALA  46           H        ALA  46  10.287  -8.450   6.419
  337    HA   ALA  46           HA       ALA  46   7.813  -7.293   7.047
  338    HB1  ALA  46           HB1      ALA  46   8.165  -9.676   6.549
  339    HB2  ALA  46           HB2      ALA  46   9.051  -9.882   8.094
  340    HB3  ALA  46           HB3      ALA  46   7.314  -9.494   8.092
  341    H    GLU  47           H        GLU  47  10.594  -7.936   9.171
  342    HA   GLU  47           HA       GLU  47   9.263  -7.414  11.642
  343    HB2  GLU  47           HB2      GLU  47  11.343  -8.732  11.175
  344    HB3  GLU  47           HB3      GLU  47  12.211  -7.216  10.886
  345    HG2  GLU  47           HG2      GLU  47  11.613  -6.489  13.219
  346    HG3  GLU  47           HG3      GLU  47  10.848  -8.060  13.471
  347    H    GLN  48           H        GLN  48  11.005  -5.312   9.287
  348    HA   GLN  48           HA       GLN  48  10.915  -3.030  11.061
  349    HB2  GLN  48           HB2      GLN  48  11.477  -3.205   8.108
  350    HB3  GLN  48           HB3      GLN  48  11.605  -1.719   9.070
  351    HG2  GLN  48           HG2      GLN  48  13.077  -4.309   9.589
  352    HG3  GLN  48           HG3      GLN  48  13.795  -2.895   8.815
  353   HE21  GLN  48          HE22      GLN  48  14.722  -4.345  11.108
  354   HE22  GLN  48          HE21      GLN  48  14.723  -3.257  12.485
  355    H    ALA  49           H        ALA  49   8.828  -4.344   8.448
  356    HA   ALA  49           HA       ALA  49   7.017  -2.129   8.330
  357    HB1  ALA  49           HB1      ALA  49   6.511  -5.116   7.881
  358    HB2  ALA  49           HB2      ALA  49   5.511  -3.771   7.318
  359    HB3  ALA  49           HB3      ALA  49   7.167  -3.960   6.671
  360    H    MET  50           H        MET  50   7.261  -5.068  10.415
  361    HA   MET  50           HA       MET  50   4.854  -4.644  11.837
  362    HB2  MET  50           HB2      MET  50   5.887  -6.756  11.987
  363    HB3  MET  50           HB3      MET  50   7.425  -6.114  12.537
  364    HG2  MET  50           HG2      MET  50   4.893  -5.807  14.136
  365    HG3  MET  50           HG3      MET  50   5.883  -7.250  14.240
  366    HE1  MET  50           HE1      MET  50   8.252  -7.401  15.040
  367    HE2  MET  50           HE2      MET  50   8.996  -5.978  14.266
  368    HE3  MET  50           HE3      MET  50   9.083  -6.173  16.019
  369    H    TYR  51           H        TYR  51   8.231  -3.525  12.683
  370    HA   TYR  51           HA       TYR  51   7.282  -2.169  14.967
  371    HB2  TYR  51           HB2      TYR  51   9.762  -1.677  13.284
  372    HB3  TYR  51           HB3      TYR  51   9.429  -0.853  14.796
  373    HD1  TYR  51           HD2      TYR  51   8.658  -2.573  16.800
  374    HD2  TYR  51           HD1      TYR  51  11.306  -3.473  13.509
  375    HE1  TYR  51           HE2      TYR  51   9.915  -4.123  18.245
  376    HE2  TYR  51           HE1      TYR  51  12.549  -5.057  14.949
  377    HH   TYR  51           HH       TYR  51  11.774  -5.552  18.429
  378    H    ARG  52           H        ARG  52   7.495  -0.897  11.548
  379    HA   ARG  52           HA       ARG  52   6.887   1.808  12.352
  380    HB2  ARG  52           HB2      ARG  52   7.918   1.227  10.182
  381    HB3  ARG  52           HB3      ARG  52   6.518   0.236   9.769
  382    HG2  ARG  52           HG2      ARG  52   5.136   2.461  10.008
  383    HG3  ARG  52           HG3      ARG  52   6.705   3.272   9.938
  384    HD2  ARG  52           HD2      ARG  52   5.769   1.184   7.938
  385    HD3  ARG  52           HD3      ARG  52   5.403   2.909   7.722
  386    HE   ARG  52           HE       ARG  52   7.885   1.500   7.219
  387   HH11  ARG  52          HH11      ARG  52   6.683   4.787   7.965
  388   HH12  ARG  52          HH12      ARG  52   8.032   5.555   7.213
  389   HH21  ARG  52          HH21      ARG  52   9.515   2.426   6.278
  390   HH22  ARG  52          HH22      ARG  52   9.758   4.168   6.210
  391    H    GLU  53           H        GLU  53   4.866  -0.946  11.113
  392    HA   GLU  53           HA       GLU  53   2.545   0.685  11.126
  393    HB2  GLU  53           HB2      GLU  53   2.813  -2.304  10.825
  394    HB3  GLU  53           HB3      GLU  53   1.319  -1.394  10.614
  395    HG2  GLU  53           HG2      GLU  53   3.878  -0.804   9.087
  396    HG3  GLU  53           HG3      GLU  53   2.606  -1.848   8.469
  397    H    LEU  54           H        LEU  54   4.002  -1.476  13.544
  398    HA   LEU  54           HA       LEU  54   1.918  -1.672  15.415
  399    HB2  LEU  54           HB2      LEU  54   4.096  -2.781  15.692
  400    HB3  LEU  54           HB3      LEU  54   4.911  -1.213  15.752
  401    HG   LEU  54           HG       LEU  54   3.500  -0.757  17.880
  402   HD11  LEU  54          HD11      LEU  54   3.329  -3.793  17.832
  403   HD12  LEU  54          HD12      LEU  54   2.642  -2.688  19.042
  404   HD13  LEU  54          HD13      LEU  54   1.953  -2.741  17.420
  405   HD21  LEU  54          HD21      LEU  54   5.922  -1.187  17.920
  406   HD22  LEU  54          HD22      LEU  54   5.110  -1.943  19.295
  407   HD23  LEU  54          HD23      LEU  54   5.623  -2.940  17.907
  408    H    PHE  55           H        PHE  55   4.275   1.074  14.878
  409    HA   PHE  55           HA       PHE  55   3.152   2.639  16.977
  410    HB2  PHE  55           HB2      PHE  55   5.360   3.119  15.978
  411    HB3  PHE  55           HB3      PHE  55   4.567   3.634  14.480
  412    HD1  PHE  55           HD2      PHE  55   5.061   4.425  18.079
  413    HD2  PHE  55           HD1      PHE  55   3.338   5.775  14.360
  414    HE1  PHE  55           HE2      PHE  55   4.671   6.662  19.068
  415    HE2  PHE  55           HE1      PHE  55   2.960   8.017  15.354
  416    HZ   PHE  55           HZ       PHE  55   3.620   8.468  17.710
  417    H    GLU  56           H        GLU  56   2.334   2.448  13.443
  418    HA   GLU  56           HA       GLU  56   0.497   4.556  13.554
  419    HB2  GLU  56           HB2      GLU  56   0.657   2.171  11.698
  420    HB3  GLU  56           HB3      GLU  56  -0.543   3.451  11.506
  421    HG2  GLU  56           HG2      GLU  56   2.440   4.018  11.668
  422    HG3  GLU  56           HG3      GLU  56   1.608   3.704  10.145
  423    H    GLU  57           H        GLU  57   0.127   1.195  14.614
  424    HA   GLU  57           HA       GLU  57  -2.796   1.331  14.571
  425    HB2  GLU  57           HB2      GLU  57  -0.833  -0.842  15.358
  426    HB3  GLU  57           HB3      GLU  57  -2.584  -1.016  15.413
  427    HG2  GLU  57           HG2      GLU  57  -1.080  -0.386  12.846
  428    HG3  GLU  57           HG3      GLU  57  -1.419  -2.009  13.419
  429    H    VAL  58           H        VAL  58  -0.243   0.723  17.026
  430    HA   VAL  58           HA       VAL  58  -2.210   1.324  19.187
  431    HB   VAL  58           HB       VAL  58  -0.384  -0.144  20.489
  432   HG11  VAL  58          HG11      VAL  58  -1.737  -2.068  20.228
  433   HG12  VAL  58          HG12      VAL  58  -2.813  -0.680  20.190
  434   HG13  VAL  58          HG13      VAL  58  -2.396  -1.506  18.667
  435   HG21  VAL  58          HG21      VAL  58   1.163  -0.373  18.648
  436   HG22  VAL  58          HG22      VAL  58   0.534  -1.918  19.257
  437   HG23  VAL  58          HG23      VAL  58  -0.050  -1.265  17.702
  438    H    GLY  59           H        GLY  59   0.322   2.887  17.661
  439    HA2  GLY  59           HA2      GLY  59   1.523   4.743  18.287
  440    HA3  GLY  59           HA3      GLY  59   0.574   4.787  19.774
  441    H    LEU  60           H        LEU  60   2.112   1.793  19.389
  442    HA   LEU  60           HA       LEU  60   3.987   2.308  21.544
  443    HB2  LEU  60           HB2      LEU  60   2.209   0.540  21.435
  444    HB3  LEU  60           HB3      LEU  60   3.049  -0.164  20.046
  445    HG   LEU  60           HG       LEU  60   4.971  -0.754  21.482
  446   HD11  LEU  60          HD11      LEU  60   4.712  -0.617  23.923
  447   HD12  LEU  60          HD12      LEU  60   4.807   0.999  23.207
  448   HD13  LEU  60          HD13      LEU  60   3.233   0.353  23.717
  449   HD21  LEU  60          HD21      LEU  60   2.128  -1.530  22.390
  450   HD22  LEU  60          HD22      LEU  60   3.067  -2.303  21.106
  451   HD23  LEU  60          HD23      LEU  60   3.594  -2.465  22.784
  452    H    SER  61           H        SER  61   6.219   1.662  21.372
  453    HA   SER  61           HA       SER  61   7.306   1.559  18.592
  454    HB2  SER  61           HB2      SER  61   8.460   3.221  20.863
  455    HB3  SER  61           HB3      SER  61   8.941   3.215  19.153
  456    HG   SER  61           HG       SER  61   7.585   5.011  19.706
  457    H    ARG  62           H        ARG  62   9.599   0.874  18.568
  458    HA   ARG  62           HA       ARG  62   9.982  -1.699  19.295
  459    HB2  ARG  62           HB2      ARG  62  12.265   0.334  19.179
  460    HB3  ARG  62           HB3      ARG  62  12.362  -1.416  18.954
  461    HG2  ARG  62           HG2      ARG  62  10.657  -0.981  17.000
  462    HG3  ARG  62           HG3      ARG  62  11.241   0.684  17.095
  463    HD2  ARG  62           HD2      ARG  62  13.614  -0.219  16.909
  464    HD3  ARG  62           HD3      ARG  62  12.926  -1.827  16.700
  465    HE   ARG  62           HE       ARG  62  12.430  -1.391  14.531
  466   HH11  ARG  62          HH11      ARG  62  13.126   1.761  16.053
  467   HH12  ARG  62          HH12      ARG  62  13.241   2.605  14.553
  468   HH21  ARG  62          HH21      ARG  62  12.757  -0.278  12.534
  469   HH22  ARG  62          HH22      ARG  62  12.968   1.439  12.526
  470    H    LYS  63           H        LYS  63  10.829   1.094  21.330
  471    HA   LYS  63           HA       LYS  63  12.485  -0.336  23.146
  472    HB2  LYS  63           HB2      LYS  63  12.931   1.656  24.042
  473    HB3  LYS  63           HB3      LYS  63  12.334   2.180  22.490
  474    HG2  LYS  63           HG2      LYS  63  11.140   3.596  23.899
  475    HG3  LYS  63           HG3      LYS  63   9.989   2.268  23.698
  476    HD2  LYS  63           HD2      LYS  63  10.018   2.258  26.023
  477    HD3  LYS  63           HD3      LYS  63  11.508   1.305  25.776
  478    HE2  LYS  63           HE2      LYS  63  12.864   3.378  25.918
  479    HE3  LYS  63           HE3      LYS  63  11.392   4.336  26.155
  480    HZ1  LYS  63           HZ1      LYS  63  11.022   3.134  28.240
  481    HZ2  LYS  63           HZ2      LYS  63  12.382   2.248  28.023
  482    HZ3  LYS  63           HZ3      LYS  63  12.478   3.862  28.255
  483    H    ASP  64           H        ASP  64   8.930  -0.083  23.032
  484    HA   ASP  64           HA       ASP  64   8.957  -1.352  25.718
  485    HB2  ASP  64           HB2      ASP  64   7.937   0.998  25.438
  486    HB3  ASP  64           HB3      ASP  64   6.569   0.144  24.747
  487    H    VAL  65           H        VAL  65   9.193  -2.568  23.002
  488    HA   VAL  65           HA       VAL  65   7.307  -4.759  23.599
  489    HB   VAL  65           HB       VAL  65   7.171  -5.225  21.124
  490   HG11  VAL  65          HG11      VAL  65   5.848  -2.712  22.162
  491   HG12  VAL  65          HG12      VAL  65   5.266  -3.727  20.813
  492   HG13  VAL  65          HG13      VAL  65   5.297  -4.364  22.468
  493   HG21  VAL  65          HG21      VAL  65   9.005  -3.676  20.387
  494   HG22  VAL  65          HG22      VAL  65   7.485  -3.422  19.520
  495   HG23  VAL  65          HG23      VAL  65   7.965  -2.307  20.802
  496    H    ARG  66           H        ARG  66   8.061  -6.833  22.658
  497    HA   ARG  66           HA       ARG  66  10.882  -6.996  21.860
  498    HB2  ARG  66           HB2      ARG  66  11.481  -8.674  23.477
  499    HB3  ARG  66           HB3      ARG  66  10.883  -7.254  24.344
  500    HG2  ARG  66           HG2      ARG  66   8.550  -8.567  24.247
  501    HG3  ARG  66           HG3      ARG  66   9.587  -9.976  24.009
  502    HD2  ARG  66           HD2      ARG  66   9.610  -7.977  26.284
  503    HD3  ARG  66           HD3      ARG  66   8.936  -9.626  26.314
  504    HE   ARG  66           HE       ARG  66  11.772  -9.491  25.611
  505   HH11  ARG  66          HH21      ARG  66   9.629  -9.529  28.459
  506   HH12  ARG  66          HH22      ARG  66  10.823 -10.205  29.503
  507   HH21  ARG  66          HH11      ARG  66  13.334 -10.425  26.996
  508   HH22  ARG  66          HH12      ARG  66  12.976 -10.693  28.661
  509    H    ILE  67           H        ILE  67  11.067  -8.839  20.339
  510    HA   ILE  67           HA       ILE  67   8.445  -9.869  19.484
  511    HB   ILE  67           HB       ILE  67  11.194 -10.349  18.318
  512   HG12  ILE  67          HG12      ILE  67   9.080  -8.602  17.036
  513   HG13  ILE  67          HG13      ILE  67  10.293  -7.926  18.128
  514   HG21  ILE  67          HG21      ILE  67   9.615 -12.177  17.795
  515   HG22  ILE  67          HG22      ILE  67   8.413 -11.000  17.216
  516   HG23  ILE  67          HG23      ILE  67   9.941 -11.246  16.346
  517   HD11  ILE  67          HD11      ILE  67  10.842  -9.387  15.516
  518   HD12  ILE  67          HD12      ILE  67  11.055  -7.663  15.862
  519   HD13  ILE  67          HD13      ILE  67  12.091  -8.850  16.672
  520    H    LEU  68           H        LEU  68   7.686 -11.629  20.308
  521    HA   LEU  68           HA       LEU  68   9.437 -13.483  21.872
  522    HB2  LEU  68           HB2      LEU  68   6.421 -13.158  21.660
  523    HB3  LEU  68           HB3      LEU  68   7.242 -14.416  22.579
  524    HG   LEU  68           HG       LEU  68   7.374 -11.407  23.152
  525   HD11  LEU  68          HD11      LEU  68   5.893 -13.779  24.298
  526   HD12  LEU  68          HD12      LEU  68   6.305 -12.374  25.288
  527   HD13  LEU  68          HD13      LEU  68   5.305 -12.157  23.842
  528   HD21  LEU  68          HD21      LEU  68   8.592 -12.083  25.215
  529   HD22  LEU  68          HD22      LEU  68   8.702 -13.750  24.604
  530   HD23  LEU  68          HD23      LEU  68   9.534 -12.421  23.767
  531    H    ALA  69           H        ALA  69   7.314 -13.241  19.000
  532    HA   ALA  69           HA       ALA  69   8.287 -15.767  17.922
  533    HB1  ALA  69           HB1      ALA  69   6.271 -16.998  17.975
  534    HB2  ALA  69           HB2      ALA  69   6.501 -16.418  19.633
  535    HB3  ALA  69           HB3      ALA  69   5.335 -15.611  18.570
  536    H    SER  70           H        SER  70   7.185 -16.209  15.882
  537    HA   SER  70           HA       SER  70   5.688 -14.204  14.592
  538    HB2  SER  70           HB2      SER  70   7.376 -13.597  12.816
  539    HB3  SER  70           HB3      SER  70   7.621 -12.907  14.429
  540    HG   SER  70           HG       SER  70   9.602 -13.732  13.544
  541    H    THR  71           H        THR  71   5.118 -14.833  12.257
  542    HA   THR  71           HA       THR  71   4.626 -17.663  12.421
  543    HB   THR  71           HB       THR  71   3.529 -17.226  10.112
  544    HG1  THR  71           HG1      THR  71   4.280 -15.351   9.439
  545   HG21  THR  71          HG21      THR  71   2.005 -17.459  11.792
  546   HG22  THR  71          HG22      THR  71   2.620 -16.086  12.732
  547   HG23  THR  71          HG23      THR  71   1.690 -15.802  11.240
  548    H    ARG  72           H        ARG  72   5.259 -19.338  11.238
  549    HA   ARG  72           HA       ARG  72   7.918 -19.083   9.956
  550    HB2  ARG  72           HB2      ARG  72   6.132 -21.539  10.295
  551    HB3  ARG  72           HB3      ARG  72   7.817 -21.518   9.771
  552    HG2  ARG  72           HG2      ARG  72   8.419 -21.770  11.919
  553    HG3  ARG  72           HG3      ARG  72   7.885 -20.110  12.200
  554    HD2  ARG  72           HD2      ARG  72   5.574 -21.001  12.679
  555    HD3  ARG  72           HD3      ARG  72   6.206 -22.636  12.545
  556    HE   ARG  72           HE       ARG  72   6.659 -20.641  14.667
  557   HH11  ARG  72          HH11      ARG  72   7.638 -23.826  13.409
  558   HH12  ARG  72          HH12      ARG  72   8.337 -24.354  14.896
  559   HH21  ARG  72          HH21      ARG  72   7.587 -21.355  16.654
  560   HH22  ARG  72          HH22      ARG  72   8.305 -22.920  16.777
  561    H    ASN  73           H        ASN  73   4.624 -20.045   9.093
  562    HA   ASN  73           HA       ASN  73   5.158 -19.914   6.222
  563    HB2  ASN  73           HB2      ASN  73   2.677 -20.569   6.116
  564    HB3  ASN  73           HB3      ASN  73   3.841 -21.744   6.731
  565   HD21  ASN  73          HD22      ASN  73   2.307 -19.020   8.631
  566   HD22  ASN  73          HD21      ASN  73   1.711 -20.126   9.849
  567    H    TRP  74           H        TRP  74   4.167 -18.409   4.824
  568    HA   TRP  74           HA       TRP  74   3.173 -15.893   6.049
  569    HB2  TRP  74           HB2      TRP  74   3.658 -16.815   3.180
  570    HB3  TRP  74           HB3      TRP  74   2.817 -15.329   3.580
  571    HD1  TRP  74           HD1      TRP  74   6.315 -16.866   3.678
  572    HE1  TRP  74           HE1      TRP  74   8.052 -14.993   3.910
  573    HE3  TRP  74           HE3      TRP  74   3.157 -12.910   4.374
  574    HZ2  TRP  74           HZ2      TRP  74   8.073 -12.192   4.527
  575    HZ3  TRP  74           HZ3      TRP  74   4.064 -10.624   4.785
  576    HH2  TRP  74           HH2      TRP  74   6.522 -10.292   4.997
  577    H    LEU  75           H        LEU  75   0.991 -15.651   6.458
  578    HA   LEU  75           HA       LEU  75  -0.881 -17.715   5.417
  579    HB2  LEU  75           HB2      LEU  75  -1.523 -15.299   7.145
  580    HB3  LEU  75           HB3      LEU  75  -2.558 -16.667   6.770
  581    HG   LEU  75           HG       LEU  75  -0.255 -17.878   7.877
  582   HD11  LEU  75          HD11      LEU  75   0.044 -16.743  10.021
  583   HD12  LEU  75          HD12      LEU  75   0.597 -15.759   8.653
  584   HD13  LEU  75          HD13      LEU  75  -0.972 -15.399   9.430
  585   HD21  LEU  75          HD21      LEU  75  -2.854 -17.182   9.319
  586   HD22  LEU  75          HD22      LEU  75  -2.564 -18.622   8.316
  587   HD23  LEU  75          HD23      LEU  75  -1.643 -18.361   9.810
  588    H    ARG  76           H        ARG  76  -2.010 -17.361   3.516
  589    HA   ARG  76           HA       ARG  76  -2.123 -14.564   2.465
  590    HB2  ARG  76           HB2      ARG  76  -0.542 -16.294   1.356
  591    HB3  ARG  76           HB3      ARG  76  -2.002 -17.156   0.874
  592    HG2  ARG  76           HG2      ARG  76  -2.701 -15.042  -0.392
  593    HG3  ARG  76           HG3      ARG  76  -1.092 -14.383   0.015
  594    HD2  ARG  76           HD2      ARG  76  -0.119 -16.522  -0.955
  595    HD3  ARG  76           HD3      ARG  76  -1.741 -16.892  -1.580
  596    HE   ARG  76           HE       ARG  76  -1.164 -14.315  -2.489
  597   HH11  ARG  76          HH11      ARG  76   0.319 -17.528  -2.876
  598   HH12  ARG  76          HH12      ARG  76   1.085 -17.158  -4.375
  599   HH21  ARG  76          HH21      ARG  76  -0.180 -13.841  -4.551
  600   HH22  ARG  76          HH22      ARG  76   0.790 -15.030  -5.336
  601    H    TYR  77           H        TYR  77  -4.105 -14.011   1.437
  602    HA   TYR  77           HA       TYR  77  -6.164 -16.078   1.241
  603    HB2  TYR  77           HB2      TYR  77  -7.930 -14.871   2.267
  604    HB3  TYR  77           HB3      TYR  77  -6.661 -15.201   3.433
  605    HD1  TYR  77           HD2      TYR  77  -5.120 -13.353   4.169
  606    HD2  TYR  77           HD1      TYR  77  -8.616 -12.634   1.743
  607    HE1  TYR  77           HE2      TYR  77  -5.083 -10.989   4.818
  608    HE2  TYR  77           HE1      TYR  77  -8.585 -10.261   2.379
  609    HH   TYR  77           HH       TYR  77  -7.533  -8.590   3.690
  610    H    LYS  78           H        LYS  78  -7.642 -15.685  -0.399
  611    HA   LYS  78           HA       LYS  78  -7.037 -13.372  -2.188
  612    HB2  LYS  78           HB2      LYS  78  -8.328 -16.082  -2.642
  613    HB3  LYS  78           HB3      LYS  78  -8.807 -14.716  -3.632
  614    HG2  LYS  78           HG2      LYS  78  -7.129 -15.945  -4.785
  615    HG3  LYS  78           HG3      LYS  78  -6.531 -14.334  -4.384
  616    HD2  LYS  78           HD2      LYS  78  -5.049 -15.152  -2.732
  617    HD3  LYS  78           HD3      LYS  78  -5.855 -16.722  -2.609
  618    HE2  LYS  78           HE2      LYS  78  -4.394 -15.761  -5.110
  619    HE3  LYS  78           HE3      LYS  78  -3.602 -16.673  -3.824
  620    HZ1  LYS  78           HZ1      LYS  78  -5.864 -17.681  -5.472
  621    HZ2  LYS  78           HZ2      LYS  78  -4.309 -18.142  -5.580
  622    HZ3  LYS  78           HZ3      LYS  78  -5.162 -18.503  -4.239
  623    H    LEU  79           H        LEU  79  -8.641 -11.920  -2.620
  624    HA   LEU  79           HA       LEU  79 -10.800 -11.494  -0.747
  625    HB2  LEU  79           HB2      LEU  79 -10.417 -10.411  -3.585
  626    HB3  LEU  79           HB3      LEU  79 -11.520  -9.790  -2.368
  627    HG   LEU  79           HG       LEU  79  -8.495  -9.605  -2.425
  628   HD11  LEU  79          HD11      LEU  79  -9.735  -8.036  -3.824
  629   HD12  LEU  79          HD12      LEU  79 -10.720  -7.526  -2.436
  630   HD13  LEU  79          HD13      LEU  79  -8.974  -7.185  -2.467
  631   HD21  LEU  79          HD21      LEU  79  -8.734  -8.329  -0.267
  632   HD22  LEU  79          HD22      LEU  79 -10.389  -8.966  -0.139
  633   HD23  LEU  79          HD23      LEU  79  -8.992 -10.084  -0.162
  634    HA   PRO  80           HA       PRO  80 -13.862 -13.910  -3.117
  635    HB2  PRO  80           HB2      PRO  80 -16.169 -12.805  -2.066
  636    HB3  PRO  80           HB3      PRO  80 -15.170 -13.980  -1.144
  637    HG2  PRO  80           HG2      PRO  80 -15.101 -10.968  -1.012
  638    HG3  PRO  80           HG3      PRO  80 -15.240 -12.121   0.355
  639    HD2  PRO  80           HD2      PRO  80 -12.833 -11.081  -0.350
  640    HD3  PRO  80           HD3      PRO  80 -12.961 -12.802   0.110
  641    H    LYS  81           H        LYS  81 -15.063 -13.182  -5.145
  642    HA   LYS  81           HA       LYS  81 -13.758 -10.833  -6.029
  643    HB2  LYS  81           HB2      LYS  81 -15.831 -12.341  -7.592
  644    HB3  LYS  81           HB3      LYS  81 -14.612 -11.163  -8.181
  645    HG2  LYS  81           HG2      LYS  81 -12.806 -12.627  -7.528
  646    HG3  LYS  81           HG3      LYS  81 -13.964 -13.860  -6.981
  647    HD2  LYS  81           HD2      LYS  81 -14.908 -14.075  -9.221
  648    HD3  LYS  81           HD3      LYS  81 -13.940 -12.705  -9.819
  649    HE2  LYS  81           HE2      LYS  81 -11.878 -13.884  -9.316
  650    HE3  LYS  81           HE3      LYS  81 -12.786 -15.255  -8.647
  651    HZ1  LYS  81           HZ1      LYS  81 -12.080 -15.702 -10.928
  652    HZ2  LYS  81           HZ2      LYS  81 -13.707 -15.653 -10.868
  653    HZ3  LYS  81           HZ3      LYS  81 -12.867 -14.394 -11.495
  654    H    ARG  82           H        ARG  82 -16.801 -11.008  -4.452
  655    HA   ARG  82           HA       ARG  82 -17.917  -8.612  -5.454
  656    HB2  ARG  82           HB2      ARG  82 -19.097  -8.489  -3.287
  657    HB3  ARG  82           HB3      ARG  82 -19.217 -10.032  -4.118
  658    HG2  ARG  82           HG2      ARG  82 -17.047 -10.513  -2.442
  659    HG3  ARG  82           HG3      ARG  82 -17.946  -9.320  -1.513
  660    HD2  ARG  82           HD2      ARG  82 -18.655 -11.484  -0.858
  661    HD3  ARG  82           HD3      ARG  82 -19.985 -10.739  -1.771
  662    HE   ARG  82           HE       ARG  82 -19.164 -12.092  -3.748
  663   HH11  ARG  82          HH21      ARG  82 -19.018 -13.315  -0.403
  664   HH12  ARG  82          HH22      ARG  82 -19.065 -14.976  -0.870
  665   HH21  ARG  82          HH11      ARG  82 -19.179 -14.307  -4.358
  666   HH22  ARG  82          HH12      ARG  82 -19.173 -15.540  -3.155
  667    H    LEU  83           H        LEU  83 -15.181  -9.065  -3.280
  668    HA   LEU  83           HA       LEU  83 -15.183  -6.232  -2.527
  669    HB2  LEU  83           HB2      LEU  83 -13.327  -8.486  -1.717
  670    HB3  LEU  83           HB3      LEU  83 -13.329  -6.864  -1.036
  671    HG   LEU  83           HG       LEU  83 -15.580  -8.893  -0.817
  672   HD11  LEU  83          HD11      LEU  83 -13.769  -7.793   1.360
  673   HD12  LEU  83          HD12      LEU  83 -14.993  -9.088   1.501
  674   HD13  LEU  83          HD13      LEU  83 -13.533  -9.351   0.543
  675   HD21  LEU  83          HD21      LEU  83 -16.625  -6.749  -0.877
  676   HD22  LEU  83          HD22      LEU  83 -16.626  -7.323   0.787
  677   HD23  LEU  83          HD23      LEU  83 -15.451  -6.079   0.295
  678    H    VAL  84           H        VAL  84 -13.758  -8.168  -4.990
  679    HA   VAL  84           HA       VAL  84 -11.220  -6.906  -5.202
  680    HB   VAL  84           HB       VAL  84 -12.962  -8.305  -7.290
  681   HG11  VAL  84          HG11      VAL  84 -10.786  -8.671  -8.503
  682   HG12  VAL  84          HG12      VAL  84 -11.317  -6.986  -8.480
  683   HG13  VAL  84          HG13      VAL  84 -10.031  -7.520  -7.383
  684   HG21  VAL  84          HG21      VAL  84 -12.129  -9.700  -5.260
  685   HG22  VAL  84          HG22      VAL  84 -11.778 -10.294  -6.893
  686   HG23  VAL  84          HG23      VAL  84 -10.510  -9.482  -5.934
  687    H    ARG  85           H        ARG  85 -10.618  -4.979  -6.073
  688    HA   ARG  85           HA       ARG  85 -12.682  -3.293  -7.321
  689    HB2  ARG  85           HB2      ARG  85 -10.500  -2.844  -5.427
  690    HB3  ARG  85           HB3      ARG  85 -10.293  -1.789  -6.835
  691    HG2  ARG  85           HG2      ARG  85 -12.871  -2.099  -5.310
  692    HG3  ARG  85           HG3      ARG  85 -11.663  -0.814  -5.019
  693    HD2  ARG  85           HD2      ARG  85 -11.897  -0.227  -7.513
  694    HD3  ARG  85           HD3      ARG  85 -13.343  -1.224  -7.549
  695    HE   ARG  85           HE       ARG  85 -12.908   1.386  -6.264
  696   HH11  ARG  85          HH21      ARG  85 -15.167  -1.378  -6.406
  697   HH12  ARG  85          HH22      ARG  85 -16.519  -0.463  -5.850
  698   HH21  ARG  85          HH11      ARG  85 -14.705   2.576  -5.526
  699   HH22  ARG  85          HH12      ARG  85 -16.243   1.823  -5.311
  700    H    TRP  86           H        TRP  86 -12.775  -4.118  -9.296
  701    HA   TRP  86           HA       TRP  86 -10.536  -4.590 -10.994
  702    HB2  TRP  86           HB2      TRP  86 -13.482  -4.082 -11.535
  703    HB3  TRP  86           HB3      TRP  86 -12.336  -4.672 -12.751
  704    HD1  TRP  86           HD1      TRP  86 -14.692  -5.878 -10.206
  705    HE1  TRP  86           HE1      TRP  86 -14.422  -8.353  -9.723
  706    HE3  TRP  86           HE3      TRP  86 -10.212  -6.659 -12.562
  707    HZ2  TRP  86           HZ2      TRP  86 -12.415 -10.423 -10.151
  708    HZ3  TRP  86           HZ3      TRP  86  -9.141  -8.898 -12.500
  709    HH2  TRP  86           HH2      TRP  86 -10.231 -10.783 -11.300
  710    H    ASP  87           H        ASP  87 -12.253  -1.663 -10.121
  711    HA   ASP  87           HA       ASP  87 -11.860  -0.237 -12.570
  712    HB2  ASP  87           HB2      ASP  87 -13.696   0.216 -11.023
  713    HB3  ASP  87           HB3      ASP  87 -12.558   0.715  -9.771
  714    H    THR  88           H        THR  88  -9.763  -0.718  -9.804
  715    HA   THR  88           HA       THR  88  -8.067   1.538 -10.666
  716    HB   THR  88           HB       THR  88  -9.120   1.598  -8.325
  717    HG1  THR  88           HG1      THR  88  -7.557   3.048  -8.721
  718   HG21  THR  88          HG21      THR  88  -8.006   0.439  -6.546
  719   HG22  THR  88          HG22      THR  88  -8.493  -0.787  -7.731
  720   HG23  THR  88          HG23      THR  88  -6.801  -0.251  -7.672
  721    H    LYS  89           H        LYS  89  -5.707   1.115 -10.459
  722    HA   LYS  89           HA       LYS  89  -5.097  -1.647 -11.288
  723    HB2  LYS  89           HB2      LYS  89  -4.075   0.802 -12.735
  724    HB3  LYS  89           HB3      LYS  89  -3.836  -0.880 -13.190
  725    HG2  LYS  89           HG2      LYS  89  -6.473   0.640 -13.197
  726    HG3  LYS  89           HG3      LYS  89  -5.464   0.303 -14.605
  727    HD2  LYS  89           HD2      LYS  89  -5.880  -2.111 -14.393
  728    HD3  LYS  89           HD3      LYS  89  -6.859  -1.836 -12.942
  729    HE2  LYS  89           HE2      LYS  89  -8.322  -0.273 -14.338
  730    HE3  LYS  89           HE3      LYS  89  -7.433  -0.830 -15.760
  731    HZ1  LYS  89           HZ1      LYS  89  -8.205  -3.118 -15.186
  732    HZ2  LYS  89           HZ2      LYS  89  -9.147  -2.483 -13.978
  733    HZ3  LYS  89           HZ3      LYS  89  -9.433  -2.096 -15.537
  734    HA   PRO  90           HA       PRO  90  -3.601  -3.020 -11.437
  735    HB2  PRO  90           HB2      PRO  90  -2.190  -4.761  -9.933
  736    HB3  PRO  90           HB3      PRO  90  -1.465  -3.765 -11.243
  737    HG2  PRO  90           HG2      PRO  90  -1.457  -3.209  -8.258
  738    HG3  PRO  90           HG3      PRO  90  -0.058  -3.168  -9.377
  739    HD2  PRO  90           HD2      PRO  90  -1.462  -0.915  -8.662
  740    HD3  PRO  90           HD3      PRO  90  -0.759  -1.111 -10.296
  741    H    VAL  91           H        VAL  91  -5.113  -4.602 -10.738
  742    HA   VAL  91           HA       VAL  91  -6.797  -3.735  -8.570
  743    HB   VAL  91           HB       VAL  91  -7.923  -4.507 -10.454
  744   HG11  VAL  91          HG11      VAL  91  -7.606  -6.715 -11.566
  745   HG12  VAL  91          HG12      VAL  91  -6.218  -5.650 -11.735
  746   HG13  VAL  91          HG13      VAL  91  -6.166  -6.990 -10.561
  747   HG21  VAL  91          HG21      VAL  91  -8.795  -5.542  -8.300
  748   HG22  VAL  91          HG22      VAL  91  -9.254  -6.385  -9.789
  749   HG23  VAL  91          HG23      VAL  91  -7.966  -7.036  -8.763
  750    H    CYS  92           H        CYS  92  -7.013  -4.509  -6.522
  751    HA   CYS  92           HA       CYS  92  -4.974  -6.329  -5.519
  752    HB2  CYS  92           HB2      CYS  92  -5.975  -4.427  -4.149
  753    HB3  CYS  92           HB3      CYS  92  -7.488  -5.336  -4.095
  754    HG   CYS  92           HG       CYS  92  -4.464  -6.389  -3.150
  755    H    ILE  93           H        ILE  93  -5.181  -8.548  -5.485
  756    HA   ILE  93           HA       ILE  93  -7.958  -9.620  -5.261
  757    HB   ILE  93           HB       ILE  93  -7.605 -11.454  -6.567
  758   HG12  ILE  93          HG12      ILE  93  -5.382 -12.182  -6.072
  759   HG13  ILE  93          HG13      ILE  93  -5.601 -12.067  -7.810
  760   HG21  ILE  93          HG21      ILE  93  -6.501  -9.099  -8.143
  761   HG22  ILE  93          HG22      ILE  93  -7.270 -10.551  -8.805
  762   HG23  ILE  93          HG23      ILE  93  -8.205  -9.446  -7.794
  763   HD11  ILE  93          HD11      ILE  93  -4.389  -9.790  -7.683
  764   HD12  ILE  93          HD12      ILE  93  -3.959 -10.266  -6.018
  765   HD13  ILE  93          HD13      ILE  93  -3.430 -11.240  -7.391
  766    H    GLY  94           H        GLY  94  -4.838  -9.468  -3.741
  767    HA2  GLY  94           HA2      GLY  94  -5.888 -10.789  -1.480
  768    HA3  GLY  94           HA3      GLY  94  -4.819 -11.899  -2.342
  769    H    GLN  95           H        GLN  95  -3.995 -11.340   0.048
  770    HA   GLN  95           HA       GLN  95  -1.512  -9.842  -0.380
  771    HB2  GLN  95           HB2      GLN  95  -1.734  -9.073   2.116
  772    HB3  GLN  95           HB3      GLN  95  -2.436  -8.129   0.832
  773    HG2  GLN  95           HG2      GLN  95  -4.173 -10.130   2.267
  774    HG3  GLN  95           HG3      GLN  95  -3.778  -8.595   3.039
  775   HE21  GLN  95          HE22      GLN  95  -6.042 -10.037   0.926
  776   HE22  GLN  95          HE21      GLN  95  -6.621  -8.560   0.168
  777    H    LYS  96           H        LYS  96   0.154 -10.450   1.111
  778    HA   LYS  96           HA       LYS  96  -0.239 -13.136   2.381
  779    HB2  LYS  96           HB2      LYS  96   2.159 -13.520   2.127
  780    HB3  LYS  96           HB3      LYS  96   1.381 -13.294   0.566
  781    HG2  LYS  96           HG2      LYS  96   2.204 -10.946   0.496
  782    HG3  LYS  96           HG3      LYS  96   3.057 -11.185   2.023
  783    HD2  LYS  96           HD2      LYS  96   3.577 -12.793  -0.515
  784    HD3  LYS  96           HD3      LYS  96   4.458 -11.330  -0.066
  785    HE2  LYS  96           HE2      LYS  96   5.263 -12.417   2.029
  786    HE3  LYS  96           HE3      LYS  96   4.393 -13.894   1.607
  787    HZ1  LYS  96           HZ1      LYS  96   6.622 -12.719   0.019
  788    HZ2  LYS  96           HZ2      LYS  96   6.713 -14.047   0.967
  789    HZ3  LYS  96           HZ3      LYS  96   5.797 -14.078  -0.383
  790    H    GLN  97           H        GLN  97   0.158 -13.183   4.598
  791    HA   GLN  97           HA       GLN  97   0.964 -10.611   5.873
  792    HB2  GLN  97           HB2      GLN  97  -1.075 -12.598   6.917
  793    HB3  GLN  97           HB3      GLN  97  -0.587 -11.056   7.648
  794    HG2  GLN  97           HG2      GLN  97  -1.479  -9.954   5.493
  795    HG3  GLN  97           HG3      GLN  97  -2.218 -11.509   5.124
  796   HE21  GLN  97          HE22      GLN  97  -2.277  -8.684   7.286
  797   HE22  GLN  97          HE21      GLN  97  -3.845  -9.018   7.979
  798    H    LYS  98           H        LYS  98   2.662 -10.771   7.223
  799    HA   LYS  98           HA       LYS  98   3.342 -13.440   8.407
  800    HB2  LYS  98           HB2      LYS  98   5.069 -12.593   6.916
  801    HB3  LYS  98           HB3      LYS  98   5.113 -11.031   7.774
  802    HG2  LYS  98           HG2      LYS  98   6.161 -11.947   9.616
  803    HG3  LYS  98           HG3      LYS  98   5.691 -13.621   9.229
  804    HD2  LYS  98           HD2      LYS  98   7.585 -12.019   7.488
  805    HD3  LYS  98           HD3      LYS  98   8.177 -12.893   8.893
  806    HE2  LYS  98           HE2      LYS  98   6.501 -14.361   6.808
  807    HE3  LYS  98           HE3      LYS  98   8.174 -13.956   6.454
  808    HZ1  LYS  98           HZ1      LYS  98   8.895 -15.208   8.392
  809    HZ2  LYS  98           HZ2      LYS  98   7.360 -15.596   8.821
  810    HZ3  LYS  98           HZ3      LYS  98   8.001 -16.170   7.431
  811    H    TRP  99           H        TRP  99   3.353 -13.489  10.689
  812    HA   TRP  99           HA       TRP  99   2.332 -10.978  11.956
  813    HB2  TRP  99           HB2      TRP  99   1.581 -13.865  12.461
  814    HB3  TRP  99           HB3      TRP  99   1.087 -12.508  13.461
  815    HD1  TRP  99           HD1      TRP  99   0.680 -13.729   9.826
  816    HE1  TRP  99           HE1      TRP  99  -1.590 -12.906   8.947
  817    HE3  TRP  99           HE3      TRP  99  -0.677 -10.784  13.765
  818    HZ2  TRP  99           HZ2      TRP  99  -3.630 -11.030   9.766
  819    HZ3  TRP  99           HZ3      TRP  99  -2.655  -9.352  13.622
  820    HH2  TRP  99           HH2      TRP  99  -4.185  -9.482  11.641
  821    H    PHE 100           H        PHE 100   2.842 -10.660  14.174
  822    HA   PHE 100           HA       PHE 100   5.311 -12.037  15.137
  823    HB2  PHE 100           HB2      PHE 100   4.717  -9.046  14.950
  824    HB3  PHE 100           HB3      PHE 100   6.078  -9.757  15.812
  825    HD1  PHE 100           HD1      PHE 100   4.576  -9.258  12.415
  826    HD2  PHE 100           HD2      PHE 100   8.056 -10.455  14.682
  827    HE1  PHE 100           HE1      PHE 100   5.941  -9.286  10.339
  828    HE2  PHE 100           HE2      PHE 100   9.412 -10.458  12.606
  829    HZ   PHE 100           HZ       PHE 100   8.352  -9.906  10.433
  830    H    LEU 101           H        LEU 101   5.024 -12.692  17.221
  831    HA   LEU 101           HA       LEU 101   2.823 -11.571  18.882
  832    HB2  LEU 101           HB2      LEU 101   3.315 -14.086  18.754
  833    HB3  LEU 101           HB3      LEU 101   4.835 -13.738  19.576
  834    HG   LEU 101           HG       LEU 101   2.036 -13.781  20.588
  835   HD11  LEU 101          HD11      LEU 101   4.557 -14.631  22.068
  836   HD12  LEU 101          HD12      LEU 101   2.891 -15.236  22.237
  837   HD13  LEU 101          HD13      LEU 101   3.859 -15.673  20.826
  838   HD21  LEU 101          HD21      LEU 101   2.598 -11.579  21.388
  839   HD22  LEU 101          HD22      LEU 101   2.800 -12.708  22.747
  840   HD23  LEU 101          HD23      LEU 101   4.220 -12.128  21.890
  841    H    LEU 102           H        LEU 102   3.484  -9.774  20.085
  842    HA   LEU 102           HA       LEU 102   6.330  -9.740  20.979
  843    HB2  LEU 102           HB2      LEU 102   4.704  -7.217  20.873
  844    HB3  LEU 102           HB3      LEU 102   6.430  -7.389  20.854
  845    HG   LEU 102           HG       LEU 102   4.608  -8.015  18.497
  846   HD11  LEU 102          HD11      LEU 102   6.426  -5.616  18.873
  847   HD12  LEU 102          HD12      LEU 102   5.270  -5.929  17.565
  848   HD13  LEU 102          HD13      LEU 102   4.669  -5.590  19.189
  849   HD21  LEU 102          HD21      LEU 102   6.703  -9.277  18.355
  850   HD22  LEU 102          HD22      LEU 102   6.751  -7.932  17.205
  851   HD23  LEU 102          HD23      LEU 102   7.647  -7.815  18.735
  852    H    GLN 103           H        GLN 103   6.585  -9.104  23.307
  853    HA   GLN 103           HA       GLN 103   3.935  -9.075  24.723
  854    HB2  GLN 103           HB2      GLN 103   5.050 -10.716  25.634
  855    HB3  GLN 103           HB3      GLN 103   6.636  -9.954  25.615
  856    HG2  GLN 103           HG2      GLN 103   6.141  -8.786  27.636
  857    HG3  GLN 103           HG3      GLN 103   4.414  -8.680  27.274
  858   HE21  GLN 103          HE22      GLN 103   3.055 -10.681  27.421
  859   HE22  GLN 103          HE21      GLN 103   3.525 -11.863  28.642
  860    H    LEU 104           H        LEU 104   3.265  -7.165  25.609
  861    HA   LEU 104           HA       LEU 104   4.547  -4.655  25.119
  862    HB2  LEU 104           HB2      LEU 104   2.021  -5.598  26.113
  863    HB3  LEU 104           HB3      LEU 104   2.743  -4.826  27.481
  864    HG   LEU 104           HG       LEU 104   1.510  -3.149  26.667
  865   HD11  LEU 104          HD11      LEU 104   3.822  -2.306  26.743
  866   HD12  LEU 104          HD12      LEU 104   3.988  -2.604  24.997
  867   HD13  LEU 104          HD13      LEU 104   2.805  -1.429  25.605
  868   HD21  LEU 104          HD21      LEU 104   0.513  -4.179  24.807
  869   HD22  LEU 104          HD22      LEU 104   1.056  -2.574  24.344
  870   HD23  LEU 104          HD23      LEU 104   2.015  -3.984  23.818
  871    H    VAL 105           H        VAL 105   6.155  -3.599  26.420
  872    HA   VAL 105           HA       VAL 105   7.415  -5.392  28.360
  873    HB   VAL 105           HB       VAL 105   8.255  -2.766  27.152
  874   HG11  VAL 105          HG11      VAL 105   9.891  -4.636  28.915
  875   HG12  VAL 105          HG12      VAL 105  10.538  -3.265  27.991
  876   HG13  VAL 105          HG13      VAL 105   9.399  -2.968  29.308
  877   HG21  VAL 105          HG21      VAL 105   9.459  -5.525  26.646
  878   HG22  VAL 105          HG22      VAL 105   8.155  -4.876  25.656
  879   HG23  VAL 105          HG23      VAL 105   9.695  -4.023  25.714
  880    H    SER 106           H        SER 106   6.142  -2.016  28.473
  881    HA   SER 106           HA       SER 106   6.320  -1.950  31.394
  882    HB2  SER 106           HB2      SER 106   5.013  -0.096  29.354
  883    HB3  SER 106           HB3      SER 106   5.107   0.220  31.094
  884    HG   SER 106           HG       SER 106   7.198   0.072  29.191
  885    H    GLY 107           H        GLY 107   3.902  -2.838  29.002
  886    HA2  GLY 107           HA2      GLY 107   2.063  -4.341  29.837
  887    HA3  GLY 107           HA3      GLY 107   1.812  -3.162  31.127
  888    H    ASP 108           H        ASP 108  -0.305  -3.654  29.629
  889    HA   ASP 108           HA       ASP 108  -0.638  -2.596  27.118
  890    HB2  ASP 108           HB2      ASP 108  -2.331  -3.973  27.617
  891    HB3  ASP 108           HB3      ASP 108  -2.301  -3.611  29.327
  892    H    ALA 109           H        ALA 109  -0.495  -0.831  30.101
  893    HA   ALA 109           HA       ALA 109  -1.900   1.526  29.483
  894    HB1  ALA 109           HB1      ALA 109  -0.367   2.591  31.097
  895    HB2  ALA 109           HB2      ALA 109  -0.904   1.010  31.694
  896    HB3  ALA 109           HB3      ALA 109   0.727   1.195  30.990
  897    H    GLU 110           H        GLU 110   1.171   0.399  28.129
  898    HA   GLU 110           HA       GLU 110   1.797   3.048  27.170
  899    HB2  GLU 110           HB2      GLU 110   3.286   0.449  27.291
  900    HB3  GLU 110           HB3      GLU 110   3.800   1.605  26.062
  901    HG2  GLU 110           HG2      GLU 110   3.544   2.222  29.026
  902    HG3  GLU 110           HG3      GLU 110   5.045   1.811  28.192
  903    H    ILE 111           H        ILE 111  -0.492   1.505  26.181
  904    HA   ILE 111           HA       ILE 111  -0.087   1.656  23.233
  905    HB   ILE 111           HB       ILE 111  -2.569   0.936  24.841
  906   HG12  ILE 111          HG12      ILE 111  -0.968  -0.959  23.046
  907   HG13  ILE 111          HG13      ILE 111  -0.641  -0.799  24.798
  908   HG21  ILE 111          HG21      ILE 111  -3.500   0.224  22.613
  909   HG22  ILE 111          HG22      ILE 111  -3.188   1.949  22.686
  910   HG23  ILE 111          HG23      ILE 111  -2.043   0.881  21.840
  911   HD11  ILE 111          HD11      ILE 111  -2.105  -2.661  24.606
  912   HD12  ILE 111          HD12      ILE 111  -3.106  -1.331  25.195
  913   HD13  ILE 111          HD13      ILE 111  -3.200  -1.806  23.503
  914    H    ASN 112           H        ASN 112  -0.880   3.363  22.039
  915    HA   ASN 112           HA       ASN 112  -2.564   5.460  23.319
  916    HB2  ASN 112           HB2      ASN 112  -0.371   6.510  23.243
  917    HB3  ASN 112           HB3      ASN 112  -0.075   5.888  21.615
  918   HD21  ASN 112          HD22      ASN 112   0.295   8.156  20.860
  919   HD22  ASN 112          HD21      ASN 112  -1.127   9.121  20.496
  920    H    MET 113           H        MET 113  -4.468   5.448  22.133
  921    HA   MET 113           HA       MET 113  -4.431   4.120  19.487
  922    HB2  MET 113           HB2      MET 113  -6.888   5.107  20.960
  923    HB3  MET 113           HB3      MET 113  -6.763   3.908  19.670
  924    HG2  MET 113           HG2      MET 113  -5.167   2.713  21.485
  925    HG3  MET 113           HG3      MET 113  -6.168   3.660  22.585
  926    HE1  MET 113           HE1      MET 113  -7.019  -0.324  20.705
  927    HE2  MET 113           HE2      MET 113  -5.660   0.757  20.319
  928    HE3  MET 113           HE3      MET 113  -5.852   0.137  21.969
  929    H    GLN 114           H        GLN 114  -3.844   7.235  20.393
  930    HA   GLN 114           HA       GLN 114  -5.163   8.426  18.049
  931    HB2  GLN 114           HB2      GLN 114  -4.763   9.735  20.747
  932    HB3  GLN 114           HB3      GLN 114  -5.223  10.534  19.226
  933    HG2  GLN 114           HG2      GLN 114  -7.247   9.083  19.102
  934    HG3  GLN 114           HG3      GLN 114  -6.843   8.387  20.678
  935   HE21  GLN 114          HE22      GLN 114  -7.595  11.563  19.013
  936   HE22  GLN 114          HE21      GLN 114  -8.307  12.285  20.433
  937    H    THR 115           H        THR 115  -3.378   7.553  17.219
  938    HA   THR 115           HA       THR 115  -0.662   8.457  17.506
  939    HB   THR 115           HB       THR 115  -0.754   7.317  15.142
  940    HG1  THR 115           HG1      THR 115  -2.572   5.985  14.853
  941   HG21  THR 115          HG21      THR 115  -1.005   5.025  16.338
  942   HG22  THR 115          HG22      THR 115   0.142   6.141  17.102
  943   HG23  THR 115          HG23      THR 115  -1.482   5.918  17.798
  944    H    SER 116           H        SER 116  -3.122   8.778  15.027
  945    HA   SER 116           HA       SER 116  -2.410  11.515  14.221
  946    HB2  SER 116           HB2      SER 116  -4.810   9.766  13.518
  947    HB3  SER 116           HB3      SER 116  -4.334  11.259  12.695
  948    HG   SER 116           HG       SER 116  -2.435  10.223  11.996
  949    H    SER 117           H        SER 117  -4.351  13.219  14.292
  950    HA   SER 117           HA       SER 117  -5.249  13.592  16.955
  951    HB2  SER 117           HB2      SER 117  -6.533  14.676  14.418
  952    HB3  SER 117           HB3      SER 117  -6.584  15.384  16.043
  953    HG   SER 117           HG       SER 117  -5.012  16.413  14.696
  954    H    THR 118           H        THR 118  -6.755  12.103  14.082
  955    HA   THR 118           HA       THR 118  -9.174  11.253  15.310
  956    HB   THR 118           HB       THR 118  -8.527   9.581  13.219
  957    HG1  THR 118           HG1      THR 118  -7.985  11.002  11.538
  958   HG21  THR 118          HG21      THR 118 -10.338  11.988  13.315
  959   HG22  THR 118          HG22      THR 118 -10.389  10.667  12.107
  960   HG23  THR 118          HG23      THR 118 -10.699  10.309  13.814
  961    HA   PRO 119           HA       PRO 119  -7.298   7.702  17.333
  962    HB2  PRO 119           HB2      PRO 119 -10.079   6.584  17.186
  963    HB3  PRO 119           HB3      PRO 119  -8.987   6.723  18.598
  964    HG2  PRO 119           HG2      PRO 119 -11.129   8.395  18.260
  965    HG3  PRO 119           HG3      PRO 119  -9.580   8.971  18.950
  966    HD2  PRO 119           HD2      PRO 119 -10.602   9.312  16.115
  967    HD3  PRO 119           HD3      PRO 119  -9.721  10.476  17.155
  968    H    GLU 120           H        GLU 120  -6.475   5.829  16.423
  969    HA   GLU 120           HA       GLU 120  -7.266   5.018  13.714
  970    HB2  GLU 120           HB2      GLU 120  -4.895   4.911  14.213
  971    HB3  GLU 120           HB3      GLU 120  -5.186   4.039  15.720
  972    HG2  GLU 120           HG2      GLU 120  -4.379   2.570  13.948
  973    HG3  GLU 120           HG3      GLU 120  -5.956   2.097  14.563
  974    H    PHE 121           H        PHE 121  -7.415   3.817  17.103
  975    HA   PHE 121           HA       PHE 121  -9.528   1.900  16.278
  976    HB2  PHE 121           HB2      PHE 121  -7.708   1.832  18.691
  977    HB3  PHE 121           HB3      PHE 121  -9.018   0.707  18.388
  978    HD1  PHE 121           HD1      PHE 121  -8.866  -0.421  15.871
  979    HD2  PHE 121           HD2      PHE 121  -5.559   1.016  18.215
  980    HE1  PHE 121           HE1      PHE 121  -7.368  -1.993  14.701
  981    HE2  PHE 121           HE2      PHE 121  -4.098  -0.654  17.156
  982    HZ   PHE 121           HZ       PHE 121  -4.976  -2.124  15.341
  983    H    ASP 122           H        ASP 122 -11.471   1.951  17.310
  984    HA   ASP 122           HA       ASP 122 -12.139   4.338  18.958
  985    HB2  ASP 122           HB2      ASP 122 -13.642   3.890  17.153
  986    HB3  ASP 122           HB3      ASP 122 -13.765   2.187  17.567
  987    H    GLY 123           H        GLY 123 -11.161   1.040  19.393
  988    HA2  GLY 123           HA2      GLY 123 -11.918   0.994  22.214
  989    HA3  GLY 123           HA3      GLY 123 -12.844  -0.091  21.141
  990    H    TRP 124           H        TRP 124 -10.963  -0.690  23.329
  991    HA   TRP 124           HA       TRP 124  -9.377  -2.703  21.846
  992    HB2  TRP 124           HB2      TRP 124  -7.605  -2.576  23.445
  993    HB3  TRP 124           HB3      TRP 124  -7.857  -0.959  22.811
  994    HD1  TRP 124           HD1      TRP 124  -8.476   0.938  24.515
  995    HE1  TRP 124           HE1      TRP 124  -8.771   1.086  27.047
  996    HE3  TRP 124           HE3      TRP 124  -8.242  -4.040  25.649
  997    HZ2  TRP 124           HZ2      TRP 124  -9.036  -0.786  29.296
  998    HZ3  TRP 124           HZ3      TRP 124  -8.699  -4.837  27.960
  999    HH2  TRP 124           HH2      TRP 124  -9.080  -3.201  29.786
 1000    H    ARG 125           H        ARG 125  -9.329  -4.751  22.936
 1001    HA   ARG 125           HA       ARG 125 -10.474  -4.967  25.592
 1002    HB2  ARG 125           HB2      ARG 125 -12.039  -6.734  25.116
 1003    HB3  ARG 125           HB3      ARG 125 -12.505  -5.219  24.358
 1004    HG2  ARG 125           HG2      ARG 125 -11.430  -6.170  22.188
 1005    HG3  ARG 125           HG3      ARG 125 -11.458  -7.730  23.008
 1006    HD2  ARG 125           HD2      ARG 125 -13.897  -5.929  22.608
 1007    HD3  ARG 125           HD3      ARG 125 -13.463  -7.264  21.544
 1008    HE   ARG 125           HE       ARG 125 -13.707  -8.010  24.367
 1009   HH11  ARG 125          HH11      ARG 125 -15.594  -7.512  21.381
 1010   HH12  ARG 125          HH12      ARG 125 -16.809  -8.662  21.820
 1011   HH21  ARG 125          HH21      ARG 125 -15.421  -9.403  24.996
 1012   HH22  ARG 125          HH22      ARG 125 -16.731  -9.707  23.914
 1013    H    TRP 126           H        TRP 126  -9.592  -6.761  26.656
 1014    HA   TRP 126           HA       TRP 126  -7.387  -8.157  25.203
 1015    HB2  TRP 126           HB2      TRP 126  -7.623  -7.038  27.986
 1016    HB3  TRP 126           HB3      TRP 126  -6.690  -8.515  27.736
 1017    HD1  TRP 126           HD1      TRP 126  -6.464  -4.741  27.194
 1018    HE1  TRP 126           HE1      TRP 126  -4.224  -4.079  26.464
 1019    HE3  TRP 126           HE3      TRP 126  -4.599  -9.414  26.294
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.738  -5.381  25.643
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.245  -9.652  25.572
 1022    HH2  TRP 126           HH2      TRP 126  -0.793  -7.648  25.321
 1023    H    VAL 127           H        VAL 127  -7.789 -10.271  24.825
 1024    HA   VAL 127           HA       VAL 127 -10.076 -11.618  26.192
 1025    HB   VAL 127           HB       VAL 127 -10.579 -12.414  23.752
 1026   HG11  VAL 127          HG11      VAL 127 -12.114 -11.026  25.068
 1027   HG12  VAL 127          HG12      VAL 127 -11.214  -9.557  24.619
 1028   HG13  VAL 127          HG13      VAL 127 -12.102 -10.479  23.387
 1029   HG21  VAL 127          HG21      VAL 127  -8.600 -11.448  22.650
 1030   HG22  VAL 127          HG22      VAL 127 -10.126 -10.907  21.939
 1031   HG23  VAL 127          HG23      VAL 127  -9.211  -9.813  22.997
 1032    H    SER 128           H        SER 128 -10.165 -13.987  25.836
 1033    HA   SER 128           HA       SER 128  -7.604 -15.300  25.789
 1034    HB2  SER 128           HB2      SER 128 -10.418 -16.397  25.358
 1035    HB3  SER 128           HB3      SER 128  -8.978 -17.337  25.821
 1036    HG   SER 128           HG       SER 128 -10.348 -16.743  27.632
 1037    H    TYR 129           H        TYR 129  -6.705 -16.612  24.137
 1038    HA   TYR 129           HA       TYR 129  -6.567 -15.472  21.637
 1039    HB2  TYR 129           HB2      TYR 129  -5.961 -18.335  21.474
 1040    HB3  TYR 129           HB3      TYR 129  -4.908 -16.954  21.302
 1041    HD1  TYR 129           HD2      TYR 129  -6.549 -19.191  23.813
 1042    HD2  TYR 129           HD1      TYR 129  -3.238 -16.500  23.031
 1043    HE1  TYR 129           HE2      TYR 129  -5.577 -19.750  26.009
 1044    HE2  TYR 129           HE1      TYR 129  -2.299 -17.066  25.225
 1045    HH   TYR 129           HH       TYR 129  -3.823 -19.340  27.532
 1046    H    TRP 130           H        TRP 130  -8.857 -18.001  22.639
 1047    HA   TRP 130           HA       TRP 130  -9.629 -18.488  19.851
 1048    HB2  TRP 130           HB2      TRP 130 -10.635 -19.845  22.352
 1049    HB3  TRP 130           HB3      TRP 130 -10.775 -20.404  20.684
 1050    HD1  TRP 130           HD1      TRP 130  -8.871 -21.159  23.595
 1051    HE1  TRP 130           HE1      TRP 130  -6.555 -22.148  23.130
 1052    HE3  TRP 130           HE3      TRP 130  -8.485 -20.022  18.602
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.729 -22.324  20.929
 1054    HZ3  TRP 130           HZ3      TRP 130  -6.436 -20.630  17.348
 1055    HH2  TRP 130           HH2      TRP 130  -4.548 -21.761  18.500
 1056    H    TYR 131           H        TYR 131 -10.633 -16.154  22.063
 1057    HA   TYR 131           HA       TYR 131 -13.462 -16.229  21.326
 1058    HB2  TYR 131           HB2      TYR 131 -12.899 -15.359  23.464
 1059    HB3  TYR 131           HB3      TYR 131 -11.803 -14.163  22.772
 1060    HD1  TYR 131           HD2      TYR 131 -15.356 -15.116  23.246
 1061    HD2  TYR 131           HD1      TYR 131 -12.672 -12.134  21.643
 1062    HE1  TYR 131           HE2      TYR 131 -17.266 -13.581  22.917
 1063    HE2  TYR 131           HE1      TYR 131 -14.579 -10.603  21.298
 1064    HH   TYR 131           HH       TYR 131 -17.974 -11.488  22.132
 1065    HA   PRO 132           HA       PRO 132 -12.290 -12.374  18.748
 1066    HB2  PRO 132           HB2      PRO 132  -9.825 -12.273  17.460
 1067    HB3  PRO 132           HB3      PRO 132 -10.191 -11.559  19.066
 1068    HG2  PRO 132           HG2      PRO 132  -8.914 -14.235  18.511
 1069    HG3  PRO 132           HG3      PRO 132  -8.358 -12.936  19.620
 1070    HD2  PRO 132           HD2      PRO 132  -9.771 -14.975  20.560
 1071    HD3  PRO 132           HD3      PRO 132 -10.171 -13.331  21.128
 1072    H    VAL 133           H        VAL 133 -10.944 -15.534  17.735
 1073    HA   VAL 133           HA       VAL 133 -11.572 -15.297  14.981
 1074    HB   VAL 133           HB       VAL 133 -11.269 -17.749  14.983
 1075   HG11  VAL 133          HG11      VAL 133  -9.196 -15.958  16.339
 1076   HG12  VAL 133          HG12      VAL 133  -8.866 -17.578  15.744
 1077   HG13  VAL 133          HG13      VAL 133  -9.405 -16.323  14.607
 1078   HG21  VAL 133          HG21      VAL 133 -12.092 -18.262  17.305
 1079   HG22  VAL 133          HG22      VAL 133 -10.505 -18.940  16.924
 1080   HG23  VAL 133          HG23      VAL 133 -10.613 -17.493  17.944
 1081    H    ARG 134           H        ARG 134 -13.700 -15.901  17.745
 1082    HA   ARG 134           HA       ARG 134 -15.834 -17.173  16.219
 1083    HB2  ARG 134           HB2      ARG 134 -16.177 -15.424  18.692
 1084    HB3  ARG 134           HB3      ARG 134 -17.231 -16.710  18.100
 1085    HG2  ARG 134           HG2      ARG 134 -14.492 -17.144  19.310
 1086    HG3  ARG 134           HG3      ARG 134 -16.009 -17.259  20.187
 1087    HD2  ARG 134           HD2      ARG 134 -15.354 -18.912  17.738
 1088    HD3  ARG 134           HD3      ARG 134 -14.984 -19.427  19.410
 1089    HE   ARG 134           HE       ARG 134 -17.710 -18.725  19.328
 1090   HH11  ARG 134          HH11      ARG 134 -15.629 -21.250  17.929
 1091   HH12  ARG 134          HH12      ARG 134 -16.890 -22.426  17.830
 1092   HH21  ARG 134          HH21      ARG 134 -19.387 -20.268  19.166
 1093   HH22  ARG 134          HH22      ARG 134 -19.081 -21.851  18.550
 1094    H    GLN 135           H        GLN 135 -14.674 -13.854  16.690
 1095    HA   GLN 135           HA       GLN 135 -17.265 -12.711  16.064
 1096    HB2  GLN 135           HB2      GLN 135 -14.616 -11.457  16.758
 1097    HB3  GLN 135           HB3      GLN 135 -16.084 -10.532  16.431
 1098    HG2  GLN 135           HG2      GLN 135 -15.828 -12.711  18.530
 1099    HG3  GLN 135           HG3      GLN 135 -15.711 -10.986  18.880
 1100   HE21  GLN 135          HE22      GLN 135 -17.732 -13.364  19.543
 1101   HE22  GLN 135          HE21      GLN 135 -19.284 -12.622  19.251
 1102    H    VAL 136           H        VAL 136 -14.315 -13.411  14.248
 1103    HA   VAL 136           HA       VAL 136 -15.040 -11.440  12.178
 1104    HB   VAL 136           HB       VAL 136 -12.891 -12.599  11.141
 1105   HG11  VAL 136          HG11      VAL 136 -12.761 -10.436  13.270
 1106   HG12  VAL 136          HG12      VAL 136 -11.629 -10.696  11.907
 1107   HG13  VAL 136          HG13      VAL 136 -13.283 -10.172  11.602
 1108   HG21  VAL 136          HG21      VAL 136 -12.128 -12.609  14.069
 1109   HG22  VAL 136          HG22      VAL 136 -12.637 -14.092  13.246
 1110   HG23  VAL 136          HG23      VAL 136 -11.227 -13.205  12.658
 1111    H    VAL 137           H        VAL 137 -14.989 -11.933   9.894
 1112    HA   VAL 137           HA       VAL 137 -16.788 -14.056   9.165
 1113    HB   VAL 137           HB       VAL 137 -16.766 -13.154   7.014
 1114   HG11  VAL 137          HG11      VAL 137 -17.616 -11.529   8.718
 1115   HG12  VAL 137          HG12      VAL 137 -16.046 -10.692   8.653
 1116   HG13  VAL 137          HG13      VAL 137 -17.062 -10.795   7.206
 1117   HG21  VAL 137          HG21      VAL 137 -14.932 -11.552   6.202
 1118   HG22  VAL 137          HG22      VAL 137 -13.946 -12.139   7.566
 1119   HG23  VAL 137          HG23      VAL 137 -14.534 -13.270   6.310
 1120    H    SER 138           H        SER 138 -16.102 -15.449   7.137
 1121    HA   SER 138           HA       SER 138 -14.615 -17.511   8.136
 1122    HB2  SER 138           HB2      SER 138 -15.178 -16.854   5.222
 1123    HB3  SER 138           HB3      SER 138 -14.929 -18.476   5.912
 1124    HG   SER 138           HG       SER 138 -17.175 -17.956   5.683
 1125    H    PHE 139           H        PHE 139 -13.429 -15.279   5.486
 1126    HA   PHE 139           HA       PHE 139 -10.954 -16.687   5.337
 1127    HB2  PHE 139           HB2      PHE 139 -10.241 -15.041   3.770
 1128    HB3  PHE 139           HB3      PHE 139 -11.901 -15.471   3.451
 1129    HD1  PHE 139           HD1      PHE 139  -9.609 -12.790   4.551
 1130    HD2  PHE 139           HD2      PHE 139 -13.727 -13.788   3.704
 1131    HE1  PHE 139           HE1      PHE 139 -10.179 -10.384   4.449
 1132    HE2  PHE 139           HE2      PHE 139 -14.277 -11.378   3.589
 1133    HZ   PHE 139           HZ       PHE 139 -12.512  -9.669   3.960
 1134    H    LYS 140           H        LYS 140 -11.847 -13.682   7.060
 1135    HA   LYS 140           HA       LYS 140  -9.175 -13.167   8.049
 1136    HB2  LYS 140           HB2      LYS 140 -11.917 -12.331   9.097
 1137    HB3  LYS 140           HB3      LYS 140 -10.379 -11.795   9.808
 1138    HG2  LYS 140           HG2      LYS 140  -9.710 -10.874   7.586
 1139    HG3  LYS 140           HG3      LYS 140 -11.318 -11.260   6.960
 1140    HD2  LYS 140           HD2      LYS 140 -10.803  -9.445   9.358
 1141    HD3  LYS 140           HD3      LYS 140 -10.987  -8.884   7.675
 1142    HE2  LYS 140           HE2      LYS 140 -13.263  -9.972   7.645
 1143    HE3  LYS 140           HE3      LYS 140 -13.068 -10.286   9.385
 1144    HZ1  LYS 140           HZ1      LYS 140 -13.058  -7.587   8.079
 1145    HZ2  LYS 140           HZ2      LYS 140 -14.297  -8.189   8.948
 1146    HZ3  LYS 140           HZ3      LYS 140 -12.884  -7.828   9.692
 1147    H    ARG 141           H        ARG 141 -12.014 -14.869   9.522
 1148    HA   ARG 141           HA       ARG 141 -10.574 -15.392  11.931
 1149    HB2  ARG 141           HB2      ARG 141 -12.293 -16.740  12.664
 1150    HB3  ARG 141           HB3      ARG 141 -13.062 -15.493  11.671
 1151    HG2  ARG 141           HG2      ARG 141 -13.326 -17.124   9.849
 1152    HG3  ARG 141           HG3      ARG 141 -12.624 -18.400  10.861
 1153    HD2  ARG 141           HD2      ARG 141 -14.421 -18.243  12.447
 1154    HD3  ARG 141           HD3      ARG 141 -14.965 -16.712  11.785
 1155    HE   ARG 141           HE       ARG 141 -15.181 -19.342  10.376
 1156   HH11  ARG 141          HH11      ARG 141 -16.598 -16.134  11.129
 1157   HH12  ARG 141          HH12      ARG 141 -18.101 -16.487  10.341
 1158   HH21  ARG 141          HH21      ARG 141 -17.150 -19.730   9.263
 1159   HH22  ARG 141          HH22      ARG 141 -18.374 -18.524   9.180
 1160    H    ASP 142           H        ASP 142 -10.644 -17.283   8.885
 1161    HA   ASP 142           HA       ASP 142  -9.317 -19.523  10.040
 1162    HB2  ASP 142           HB2      ASP 142 -10.400 -19.583   7.826
 1163    HB3  ASP 142           HB3      ASP 142  -9.106 -18.566   7.173
 1164    H    VAL 143           H        VAL 143  -7.954 -16.579   8.427
 1165    HA   VAL 143           HA       VAL 143  -5.228 -17.324   8.922
 1166    HB   VAL 143           HB       VAL 143  -6.603 -14.620   8.518
 1167   HG11  VAL 143          HG11      VAL 143  -3.622 -15.177   8.816
 1168   HG12  VAL 143          HG12      VAL 143  -4.303 -13.692   8.111
 1169   HG13  VAL 143          HG13      VAL 143  -4.599 -14.076   9.805
 1170   HG21  VAL 143          HG21      VAL 143  -6.609 -16.093   6.568
 1171   HG22  VAL 143          HG22      VAL 143  -5.484 -14.763   6.291
 1172   HG23  VAL 143          HG23      VAL 143  -4.869 -16.376   6.730
 1173    H    TYR 144           H        TYR 144  -7.512 -15.311  10.861
 1174    HA   TYR 144           HA       TYR 144  -5.619 -14.711  12.861
 1175    HB2  TYR 144           HB2      TYR 144  -8.651 -14.803  12.892
 1176    HB3  TYR 144           HB3      TYR 144  -7.717 -14.228  14.250
 1177    HD1  TYR 144           HD1      TYR 144  -5.933 -13.101  11.342
 1178    HD2  TYR 144           HD2      TYR 144  -9.459 -12.326  13.693
 1179    HE1  TYR 144           HE1      TYR 144  -6.037 -10.837  10.419
 1180    HE2  TYR 144           HE2      TYR 144  -9.562 -10.018  12.769
 1181    HH   TYR 144           HH       TYR 144  -8.684  -8.537  11.170
 1182    H    ARG 145           H        ARG 145  -7.844 -17.603  12.679
 1183    HA   ARG 145           HA       ARG 145  -6.947 -18.451  15.284
 1184    HB2  ARG 145           HB2      ARG 145  -8.248 -20.351  15.053
 1185    HB3  ARG 145           HB3      ARG 145  -9.089 -19.156  14.080
 1186    HG2  ARG 145           HG2      ARG 145  -7.590 -20.276  12.132
 1187    HG3  ARG 145           HG3      ARG 145  -7.630 -21.656  13.240
 1188    HD2  ARG 145           HD2      ARG 145 -10.133 -21.441  13.245
 1189    HD3  ARG 145           HD3      ARG 145  -9.953 -20.057  12.157
 1190    HE   ARG 145           HE       ARG 145  -9.083 -21.481  10.400
 1191   HH11  ARG 145          HH11      ARG 145 -10.523 -23.406  13.053
 1192   HH12  ARG 145          HH12      ARG 145 -10.788 -24.772  12.038
 1193   HH21  ARG 145          HH21      ARG 145  -9.423 -23.145   9.150
 1194   HH22  ARG 145          HH22      ARG 145 -10.139 -24.647   9.712
 1195    H    ARG 146           H        ARG 146  -5.743 -19.192  11.942
 1196    HA   ARG 146           HA       ARG 146  -3.750 -21.032  12.840
 1197    HB2  ARG 146           HB2      ARG 146  -4.053 -19.246  10.374
 1198    HB3  ARG 146           HB3      ARG 146  -2.517 -20.053  10.740
 1199    HG2  ARG 146           HG2      ARG 146  -3.522 -21.512   9.293
 1200    HG3  ARG 146           HG3      ARG 146  -3.675 -22.248  10.889
 1201    HD2  ARG 146           HD2      ARG 146  -6.077 -21.540  10.945
 1202    HD3  ARG 146           HD3      ARG 146  -5.836 -20.754   9.379
 1203    HE   ARG 146           HE       ARG 146  -6.078 -22.661   8.293
 1204   HH11  ARG 146          HH11      ARG 146  -5.534 -23.628  11.698
 1205   HH12  ARG 146          HH12      ARG 146  -5.877 -25.289  11.393
 1206   HH21  ARG 146          HH21      ARG 146  -6.467 -24.873   7.919
 1207   HH22  ARG 146          HH22      ARG 146  -6.431 -26.007   9.218
 1208    H    VAL 147           H        VAL 147  -3.579 -17.450  12.494
 1209    HA   VAL 147           HA       VAL 147  -0.950 -17.088  13.366
 1210    HB   VAL 147           HB       VAL 147  -3.456 -15.383  13.578
 1211   HG11  VAL 147          HG11      VAL 147  -2.020 -13.412  13.954
 1212   HG12  VAL 147          HG12      VAL 147  -1.956 -14.520  15.327
 1213   HG13  VAL 147          HG13      VAL 147  -0.613 -14.478  14.163
 1214   HG21  VAL 147          HG21      VAL 147  -2.516 -14.209  11.699
 1215   HG22  VAL 147          HG22      VAL 147  -0.987 -15.116  11.826
 1216   HG23  VAL 147          HG23      VAL 147  -2.470 -15.922  11.302
 1217    H    MET 148           H        MET 148  -3.936 -17.508  15.261
 1218    HA   MET 148           HA       MET 148  -2.742 -16.947  17.810
 1219    HB2  MET 148           HB2      MET 148  -5.289 -18.468  17.167
 1220    HB3  MET 148           HB3      MET 148  -4.747 -18.073  18.800
 1221    HG2  MET 148           HG2      MET 148  -5.322 -15.948  16.722
 1222    HG3  MET 148           HG3      MET 148  -6.515 -16.586  17.827
 1223    HE1  MET 148           HE1      MET 148  -2.730 -14.783  18.070
 1224    HE2  MET 148           HE2      MET 148  -3.980 -14.141  16.980
 1225    HE3  MET 148           HE3      MET 148  -3.580 -13.267  18.467
 1226    H    LYS 149           H        LYS 149  -3.488 -20.086  16.118
 1227    HA   LYS 149           HA       LYS 149  -2.188 -21.644  18.134
 1228    HB2  LYS 149           HB2      LYS 149  -3.315 -23.124  17.106
 1229    HB3  LYS 149           HB3      LYS 149  -3.459 -22.206  15.607
 1230    HG2  LYS 149           HG2      LYS 149  -1.034 -23.888  16.308
 1231    HG3  LYS 149           HG3      LYS 149  -2.444 -24.504  15.446
 1232    HD2  LYS 149           HD2      LYS 149  -2.162 -23.012  13.604
 1233    HD3  LYS 149           HD3      LYS 149  -0.961 -22.057  14.468
 1234    HE2  LYS 149           HE2      LYS 149   0.518 -24.075  14.590
 1235    HE3  LYS 149           HE3      LYS 149  -0.656 -24.953  13.603
 1236    HZ1  LYS 149           HZ1      LYS 149   0.927 -22.559  12.714
 1237    HZ2  LYS 149           HZ2      LYS 149   1.146 -24.105  12.240
 1238    HZ3  LYS 149           HZ3      LYS 149  -0.219 -23.333  11.800
 1239    H    GLU 150           H        GLU 150  -0.764 -19.872  15.418
 1240    HA   GLU 150           HA       GLU 150   1.684 -21.058  15.426
 1241    HB2  GLU 150           HB2      GLU 150   0.564 -19.129  13.957
 1242    HB3  GLU 150           HB3      GLU 150   1.312 -18.063  15.115
 1243    HG2  GLU 150           HG2      GLU 150   3.025 -18.197  13.666
 1244    HG3  GLU 150           HG3      GLU 150   3.484 -19.548  14.664
 1245    H    PHE 151           H        PHE 151   0.390 -18.579  17.594
 1246    HA   PHE 151           HA       PHE 151   2.982 -18.372  19.047
 1247    HB2  PHE 151           HB2      PHE 151   0.568 -16.541  19.029
 1248    HB3  PHE 151           HB3      PHE 151   2.122 -16.221  19.758
 1249    HD1  PHE 151           HD2      PHE 151   4.006 -17.137  17.361
 1250    HD2  PHE 151           HD1      PHE 151   0.429 -14.669  17.572
 1251    HE1  PHE 151           HE2      PHE 151   4.459 -16.248  15.202
 1252    HE2  PHE 151           HE1      PHE 151   1.092 -13.585  15.476
 1253    HZ   PHE 151           HZ       PHE 151   3.094 -14.414  14.231
 1254    H    ALA 152           H        ALA 152  -0.200 -19.675  19.479
 1255    HA   ALA 152           HA       ALA 152  -0.878 -19.066  22.062
 1256    HB1  ALA 152           HB1      ALA 152  -2.113 -21.284  22.012
 1257    HB2  ALA 152           HB2      ALA 152  -2.381 -20.303  20.564
 1258    HB3  ALA 152           HB3      ALA 152  -1.267 -21.681  20.502
 1259    H    SER 153           H        SER 153   1.294 -21.633  20.978
 1260    HA   SER 153           HA       SER 153   1.598 -22.902  23.515
 1261    HB2  SER 153           HB2      SER 153   3.517 -22.936  21.151
 1262    HB3  SER 153           HB3      SER 153   3.347 -24.174  22.410
 1263    HG   SER 153           HG       SER 153   2.214 -24.787  20.519
 1264    H    VAL 154           H        VAL 154   3.224 -20.164  21.979
 1265    HA   VAL 154           HA       VAL 154   5.467 -20.056  23.806
 1266    HB   VAL 154           HB       VAL 154   4.224 -17.793  22.195
 1267   HG11  VAL 154          HG11      VAL 154   6.459 -16.771  22.326
 1268   HG12  VAL 154          HG12      VAL 154   5.803 -17.038  23.959
 1269   HG13  VAL 154          HG13      VAL 154   7.041 -18.136  23.298
 1270   HG21  VAL 154          HG21      VAL 154   6.003 -18.339  20.489
 1271   HG22  VAL 154          HG22      VAL 154   6.323 -19.840  21.369
 1272   HG23  VAL 154          HG23      VAL 154   4.738 -19.550  20.604
 1273    H    VAL 155           H        VAL 155   2.175 -18.598  23.658
 1274    HA   VAL 155           HA       VAL 155   2.613 -16.831  25.787
 1275    HB   VAL 155           HB       VAL 155  -0.048 -18.148  25.147
 1276   HG11  VAL 155          HG11      VAL 155  -0.169 -16.936  27.200
 1277   HG12  VAL 155          HG12      VAL 155   0.900 -15.638  26.626
 1278   HG13  VAL 155          HG13      VAL 155  -0.760 -15.752  26.011
 1279   HG21  VAL 155          HG21      VAL 155   1.183 -15.690  23.863
 1280   HG22  VAL 155          HG22      VAL 155   0.765 -17.213  23.055
 1281   HG23  VAL 155          HG23      VAL 155  -0.527 -16.208  23.688
 1282    H    MET 156           H        MET 156   1.482 -20.270  25.878
 1283    HA   MET 156           HA       MET 156   0.692 -20.344  28.488
 1284    HB2  MET 156           HB2      MET 156   2.346 -22.481  27.016
 1285    HB3  MET 156           HB3      MET 156   1.283 -22.796  28.397
 1286    HG2  MET 156           HG2      MET 156   0.448 -21.895  25.626
 1287    HG3  MET 156           HG3      MET 156   0.189 -23.481  26.323
 1288    HE1  MET 156           HE1      MET 156  -2.089 -22.444  24.909
 1289    HE2  MET 156           HE2      MET 156  -3.264 -21.386  25.724
 1290    HE3  MET 156           HE3      MET 156  -1.753 -20.703  25.090
 1291    H    SER 157           H        SER 157   3.927 -20.903  27.190
 1292    HA   SER 157           HA       SER 157   5.182 -21.293  29.743
 1293    HB2  SER 157           HB2      SER 157   5.997 -21.126  26.838
 1294    HB3  SER 157           HB3      SER 157   7.208 -21.392  28.136
 1295    HG   SER 157           HG       SER 157   6.420 -23.368  27.232
 1296    H    LEU 158           H        LEU 158   4.653 -18.533  27.600
 1297    HA   LEU 158           HA       LEU 158   6.599 -16.756  28.610
 1298    HB2  LEU 158           HB2      LEU 158   5.192 -16.427  26.555
 1299    HB3  LEU 158           HB3      LEU 158   3.763 -16.249  27.584
 1300    HG   LEU 158           HG       LEU 158   4.772 -14.219  28.627
 1301   HD11  LEU 158          HD11      LEU 158   7.132 -14.661  28.118
 1302   HD12  LEU 158          HD12      LEU 158   6.806 -14.597  26.378
 1303   HD13  LEU 158          HD13      LEU 158   6.633 -13.132  27.396
 1304   HD21  LEU 158          HD21      LEU 158   4.074 -14.477  25.684
 1305   HD22  LEU 158          HD22      LEU 158   3.033 -14.042  27.066
 1306   HD23  LEU 158          HD23      LEU 158   4.260 -12.895  26.460
 1307    H    GLN 159           H        GLN 159   3.290 -17.509  29.716
 1308    HA   GLN 159           HA       GLN 159   3.118 -15.657  31.847
 1309    HB2  GLN 159           HB2      GLN 159   2.051 -18.505  32.082
 1310    HB3  GLN 159           HB3      GLN 159   1.427 -17.037  32.828
 1311    HG2  GLN 159           HG2      GLN 159   0.774 -16.275  30.436
 1312    HG3  GLN 159           HG3      GLN 159   1.194 -17.922  29.948
 1313   HE21  GLN 159          HE22      GLN 159  -0.774 -16.457  32.611
 1314   HE22  GLN 159          HE21      GLN 159  -2.072 -17.643  32.469
 1315    H    GLU 160           H        GLU 160   4.726 -18.810  31.759
 1316    HA   GLU 160           HA       GLU 160   5.310 -18.818  34.574
 1317    HB2  GLU 160           HB2      GLU 160   6.301 -20.635  32.343
 1318    HB3  GLU 160           HB3      GLU 160   6.459 -20.939  34.078
 1319    HG2  GLU 160           HG2      GLU 160   3.941 -20.853  34.253
 1320    HG3  GLU 160           HG3      GLU 160   3.876 -20.808  32.489
 1321    H    ASN 161           H        ASN 161   6.774 -17.341  31.908
 1322    HA   ASN 161           HA       ASN 161   9.569 -17.731  32.896
 1323    HB2  ASN 161           HB2      ASN 161   8.376 -17.125  30.204
 1324    HB3  ASN 161           HB3      ASN 161   9.954 -16.451  30.573
 1325   HD21  ASN 161          HD22      ASN 161   8.166 -19.577  30.544
 1326   HD22  ASN 161          HD21      ASN 161   9.602 -20.568  30.318
 1327    H    THR 162           H        THR 162   7.146 -15.178  32.484
 1328    HA   THR 162           HA       THR 162   8.935 -13.412  34.036
 1329    HB   THR 162           HB       THR 162   9.529 -12.909  31.787
 1330    HG1  THR 162           HG1      THR 162   9.422 -11.068  32.979
 1331   HG21  THR 162          HG21      THR 162   7.722 -13.747  30.462
 1332   HG22  THR 162          HG22      THR 162   6.586 -12.557  31.129
 1333   HG23  THR 162          HG23      THR 162   7.943 -12.038  30.101
 1334    HA   PRO 163           HA       PRO 163   4.432 -13.178  35.368
 1335    HB2  PRO 163           HB2      PRO 163   4.426 -14.602  37.669
 1336    HB3  PRO 163           HB3      PRO 163   4.319 -15.438  36.104
 1337    HG2  PRO 163           HG2      PRO 163   6.838 -14.852  37.717
 1338    HG3  PRO 163           HG3      PRO 163   6.266 -16.464  37.145
 1339    HD2  PRO 163           HD2      PRO 163   8.055 -15.028  35.697
 1340    HD3  PRO 163           HD3      PRO 163   6.723 -15.922  34.881
 1341    H    LYS 164           H        LYS 164   3.972 -12.578  37.938
 1342    HA   LYS 164           HA       LYS 164   5.783 -10.392  38.639
 1343    HB2  LYS 164           HB2      LYS 164   3.455 -11.586  40.208
 1344    HB3  LYS 164           HB3      LYS 164   4.247 -10.056  40.546
 1345    HG2  LYS 164           HG2      LYS 164   2.534 -10.674  38.084
 1346    HG3  LYS 164           HG3      LYS 164   2.018  -9.820  39.529
 1347    HD2  LYS 164           HD2      LYS 164   2.420  -8.058  38.122
 1348    HD3  LYS 164           HD3      LYS 164   3.942  -8.136  39.020
 1349    HE2  LYS 164           HE2      LYS 164   4.935  -9.448  37.091
 1350    HE3  LYS 164           HE3      LYS 164   3.399  -9.292  36.233
 1351    HZ1  LYS 164           HZ1      LYS 164   5.135  -7.020  37.057
 1352    HZ2  LYS 164           HZ2      LYS 164   5.001  -7.597  35.541
 1353    HZ3  LYS 164           HZ3      LYS 164   3.715  -6.872  36.251
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1  -1.374   1.095  -0.768
    2    H2   MET   1           H2       MET   1  -0.533   0.329   0.406
    3    H3   MET   1           H3       MET   1  -0.189   1.888   0.019
    4    HA   MET   1           HA       MET   1   0.534   1.278  -2.172
    5    HB2  MET   1           HB2      MET   1   2.687   0.517  -1.642
    6    HB3  MET   1           HB3      MET   1   2.166   1.301  -0.171
    7    HG2  MET   1           HG2      MET   1   3.255  -0.607   0.560
    8    HG3  MET   1           HG3      MET   1   1.561  -1.029   0.719
    9    HE1  MET   1           HE1      MET   1   4.607  -2.905  -2.234
   10    HE2  MET   1           HE2      MET   1   4.219  -1.177  -2.341
   11    HE3  MET   1           HE3      MET   1   5.021  -1.824  -0.884
   12    H    ILE   2           H        ILE   2   1.211  -0.424  -3.672
   13    HA   ILE   2           HA       ILE   2   0.331  -3.177  -3.213
   14    HB   ILE   2           HB       ILE   2  -0.428  -1.554  -5.676
   15   HG12  ILE   2          HG12      ILE   2  -1.899  -2.490  -3.284
   16   HG13  ILE   2          HG13      ILE   2  -2.256  -1.163  -4.388
   17   HG21  ILE   2          HG21      ILE   2  -1.274  -3.621  -6.656
   18   HG22  ILE   2          HG22      ILE   2   0.429  -3.814  -6.317
   19   HG23  ILE   2          HG23      ILE   2  -0.766  -4.541  -5.213
   20   HD11  ILE   2          HD11      ILE   2  -3.259  -2.964  -5.926
   21   HD12  ILE   2          HD12      ILE   2  -2.980  -4.091  -4.545
   22   HD13  ILE   2          HD13      ILE   2  -4.062  -2.683  -4.381
   23    H    ASP   3           H        ASP   3   1.930  -4.562  -4.255
   24    HA   ASP   3           HA       ASP   3   4.486  -3.391  -4.606
   25    HB2  ASP   3           HB2      ASP   3   4.215  -5.668  -3.773
   26    HB3  ASP   3           HB3      ASP   3   3.526  -6.158  -5.333
   27    H    ASP   4           H        ASP   4   2.677  -5.338  -6.990
   28    HA   ASP   4           HA       ASP   4   2.914  -3.376  -9.055
   29    HB2  ASP   4           HB2      ASP   4   5.224  -4.236  -9.149
   30    HB3  ASP   4           HB3      ASP   4   4.615  -5.888  -9.209
   31    H    ASP   5           H        ASP   5   2.569  -6.874  -8.514
   32    HA   ASP   5           HA       ASP   5   0.839  -7.149 -10.814
   33    HB2  ASP   5           HB2      ASP   5   2.758  -8.664 -10.304
   34    HB3  ASP   5           HB3      ASP   5   1.846  -9.292  -8.931
   35    H    GLY   6           H        GLY   6  -0.078  -5.882  -8.207
   36    HA2  GLY   6           HA2      GLY   6  -2.258  -5.585  -7.401
   37    HA3  GLY   6           HA3      GLY   6  -2.764  -7.123  -8.106
   38    H    TYR   7           H        TYR   7   0.079  -7.812  -6.509
   39    HA   TYR   7           HA       TYR   7  -1.290  -8.507  -3.976
   40    HB2  TYR   7           HB2      TYR   7   1.420  -9.413  -5.005
   41    HB3  TYR   7           HB3      TYR   7   0.657  -9.915  -3.501
   42    HD1  TYR   7           HD1      TYR   7  -1.600 -11.118  -3.586
   43    HD2  TYR   7           HD2      TYR   7   0.958 -10.632  -7.028
   44    HE1  TYR   7           HE1      TYR   7  -2.809 -12.948  -4.736
   45    HE2  TYR   7           HE2      TYR   7  -0.219 -12.474  -8.173
   46    HH   TYR   7           HH       TYR   7  -1.944 -14.063  -8.056
   47    H    ARG   8           H        ARG   8  -0.184  -7.950  -1.962
   48    HA   ARG   8           HA       ARG   8   1.574  -5.563  -2.095
   49    HB2  ARG   8           HB2      ARG   8  -0.023  -4.190  -0.862
   50    HB3  ARG   8           HB3      ARG   8  -0.727  -4.773  -2.384
   51    HG2  ARG   8           HG2      ARG   8  -1.807  -6.649  -1.005
   52    HG3  ARG   8           HG3      ARG   8  -1.426  -5.673   0.425
   53    HD2  ARG   8           HD2      ARG   8  -2.834  -4.553  -2.020
   54    HD3  ARG   8           HD3      ARG   8  -3.724  -5.413  -0.747
   55    HE   ARG   8           HE       ARG   8  -2.211  -2.826  -0.505
   56   HH11  ARG   8          HH21      ARG   8  -4.596  -5.079   0.928
   57   HH12  ARG   8          HH22      ARG   8  -5.155  -3.950   2.101
   58   HH21  ARG   8          HH12      ARG   8  -2.997  -1.332   1.078
   59   HH22  ARG   8          HH11      ARG   8  -4.222  -1.796   2.201
   60    HA   PRO   9           HA       PRO   9   2.830  -8.092   1.381
   61    HB2  PRO   9           HB2      PRO   9   4.931  -6.002   1.808
   62    HB3  PRO   9           HB3      PRO   9   5.122  -7.779   1.656
   63    HG2  PRO   9           HG2      PRO   9   5.808  -6.135  -0.359
   64    HG3  PRO   9           HG3      PRO   9   4.876  -7.631  -0.724
   65    HD2  PRO   9           HD2      PRO   9   3.805  -4.812  -0.320
   66    HD3  PRO   9           HD3      PRO   9   3.508  -5.936  -1.678
   67    H    ASN  10           H        ASN  10   2.322  -8.182   3.576
   68    HA   ASN  10           HA       ASN  10   1.518  -5.669   4.965
   69    HB2  ASN  10           HB2      ASN  10  -0.400  -6.599   3.688
   70    HB3  ASN  10           HB3      ASN  10  -0.132  -8.175   4.426
   71   HD21  ASN  10          HD22      ASN  10  -1.712  -5.071   4.829
   72   HD22  ASN  10          HD21      ASN  10  -2.385  -5.436   6.397
   73    H    VAL  11           H        VAL  11   1.298  -5.999   7.312
   74    HA   VAL  11           HA       VAL  11   2.327  -8.525   8.334
   75    HB   VAL  11           HB       VAL  11   3.991  -7.544   9.821
   76   HG11  VAL  11          HG11      VAL  11   4.783  -8.343   7.738
   77   HG12  VAL  11          HG12      VAL  11   4.510  -6.756   7.024
   78   HG13  VAL  11          HG13      VAL  11   5.717  -6.947   8.318
   79   HG21  VAL  11          HG21      VAL  11   4.753  -5.267   9.639
   80   HG22  VAL  11          HG22      VAL  11   3.442  -4.866   8.498
   81   HG23  VAL  11          HG23      VAL  11   3.079  -5.298  10.187
   82    H    GLY  12           H        GLY  12   1.940  -8.720  10.713
   83    HA2  GLY  12           HA2      GLY  12   0.116  -6.706  11.821
   84    HA3  GLY  12           HA3      GLY  12  -0.551  -8.329  11.656
   85    H    ILE  13           H        ILE  13  -0.370  -7.138  14.111
   86    HA   ILE  13           HA       ILE  13   1.988  -8.354  15.423
   87    HB   ILE  13           HB       ILE  13   0.554  -5.825  16.350
   88   HG12  ILE  13          HG12      ILE  13   2.956  -4.850  15.587
   89   HG13  ILE  13          HG13      ILE  13   2.778  -6.075  14.339
   90   HG21  ILE  13          HG21      ILE  13   3.176  -7.186  16.997
   91   HG22  ILE  13          HG22      ILE  13   2.654  -5.620  17.668
   92   HG23  ILE  13          HG23      ILE  13   1.730  -7.058  18.041
   93   HD11  ILE  13          HD11      ILE  13   0.634  -5.037  13.614
   94   HD12  ILE  13          HD12      ILE  13   0.772  -3.856  14.931
   95   HD13  ILE  13          HD13      ILE  13   1.957  -3.859  13.610
   96    H    VAL  14           H        VAL  14   1.543  -9.498  17.263
   97    HA   VAL  14           HA       VAL  14  -1.271  -9.618  18.250
   98    HB   VAL  14           HB       VAL  14   0.865 -11.811  18.318
   99   HG11  VAL  14          HG11      VAL  14  -2.075 -11.824  19.131
  100   HG12  VAL  14          HG12      VAL  14  -1.000 -13.250  19.101
  101   HG13  VAL  14          HG13      VAL  14  -0.674 -11.933  20.223
  102   HG21  VAL  14          HG21      VAL  14   0.122 -11.570  16.013
  103   HG22  VAL  14          HG22      VAL  14  -0.555 -13.035  16.724
  104   HG23  VAL  14          HG23      VAL  14  -1.582 -11.589  16.529
  105    H    ILE  15           H        ILE  15  -1.375  -9.145  20.488
  106    HA   ILE  15           HA       ILE  15   1.223  -9.014  21.906
  107    HB   ILE  15           HB       ILE  15  -1.106  -7.245  22.702
  108   HG12  ILE  15          HG12      ILE  15  -0.356  -6.482  20.438
  109   HG13  ILE  15          HG13      ILE  15  -0.084  -5.320  21.722
  110   HG21  ILE  15          HG21      ILE  15   0.747  -6.078  23.905
  111   HG22  ILE  15          HG22      ILE  15   0.446  -7.733  24.479
  112   HG23  ILE  15          HG23      ILE  15   1.847  -7.387  23.436
  113   HD11  ILE  15          HD11      ILE  15   2.287  -5.822  21.807
  114   HD12  ILE  15          HD12      ILE  15   2.080  -7.180  20.661
  115   HD13  ILE  15          HD13      ILE  15   1.831  -5.507  20.116
  116    H    CYS  16           H        CYS  16   1.240 -10.303  23.767
  117    HA   CYS  16           HA       CYS  16  -1.426 -11.286  24.678
  118    HB2  CYS  16           HB2      CYS  16   0.014 -13.048  23.390
  119    HB3  CYS  16           HB3      CYS  16   1.017 -13.069  24.870
  120    HG   CYS  16           HG       CYS  16  -0.767 -13.778  26.524
  121    H    ASN  17           H        ASN  17  -1.702 -11.503  26.848
  122    HA   ASN  17           HA       ASN  17   0.376 -10.340  28.640
  123    HB2  ASN  17           HB2      ASN  17  -1.355  -9.860  30.181
  124    HB3  ASN  17           HB3      ASN  17  -1.938  -9.321  28.616
  125   HD21  ASN  17          HD22      ASN  17  -3.913  -9.479  30.352
  126   HD22  ASN  17          HD21      ASN  17  -4.842 -10.954  30.209
  127    H    ARG  18           H        ARG  18   0.182 -11.691  30.934
  128    HA   ARG  18           HA       ARG  18   1.023 -14.390  30.097
  129    HB2  ARG  18           HB2      ARG  18   1.138 -12.953  32.786
  130    HB3  ARG  18           HB3      ARG  18   1.668 -14.617  32.536
  131    HG2  ARG  18           HG2      ARG  18   3.673 -13.774  32.072
  132    HG3  ARG  18           HG3      ARG  18   3.001 -13.448  30.485
  133    HD2  ARG  18           HD2      ARG  18   4.128 -11.458  31.239
  134    HD3  ARG  18           HD3      ARG  18   2.384 -11.140  31.277
  135    HE   ARG  18           HE       ARG  18   3.644 -12.144  33.761
  136   HH11  ARG  18          HH21      ARG  18   2.824  -9.124  32.039
  137   HH12  ARG  18          HH22      ARG  18   2.816  -8.176  33.479
  138   HH21  ARG  18          HH11      ARG  18   3.632 -10.894  35.620
  139   HH22  ARG  18          HH12      ARG  18   3.297  -9.198  35.561
  140    H    GLN  19           H        GLN  19  -1.872 -13.471  30.103
  141    HA   GLN  19           HA       GLN  19  -3.019 -15.640  31.757
  142    HB2  GLN  19           HB2      GLN  19  -4.609 -13.327  30.668
  143    HB3  GLN  19           HB3      GLN  19  -5.070 -14.471  31.912
  144    HG2  GLN  19           HG2      GLN  19  -2.988 -12.262  32.130
  145    HG3  GLN  19           HG3      GLN  19  -4.595 -12.261  32.838
  146   HE21  GLN  19          HE22      GLN  19  -2.133 -11.873  34.333
  147   HE22  GLN  19          HE21      GLN  19  -1.993 -13.199  35.458
  148    H    GLY  20           H        GLY  20  -2.004 -14.992  28.628
  149    HA2  GLY  20           HA2      GLY  20  -2.475 -16.071  26.651
  150    HA3  GLY  20           HA3      GLY  20  -3.731 -17.020  27.452
  151    H    GLN  21           H        GLN  21  -3.938 -13.511  27.855
  152    HA   GLN  21           HA       GLN  21  -6.260 -13.489  26.018
  153    HB2  GLN  21           HB2      GLN  21  -5.321 -11.298  27.885
  154    HB3  GLN  21           HB3      GLN  21  -6.756 -11.281  26.875
  155    HG2  GLN  21           HG2      GLN  21  -7.780 -13.086  28.171
  156    HG3  GLN  21           HG3      GLN  21  -6.299 -13.270  29.131
  157   HE21  GLN  21          HE22      GLN  21  -9.076 -11.023  28.517
  158   HE22  GLN  21          HE21      GLN  21  -8.828 -10.127  29.989
  159    H    VAL  22           H        VAL  22  -6.028 -12.578  24.060
  160    HA   VAL  22           HA       VAL  22  -3.470 -11.295  23.382
  161    HB   VAL  22           HB       VAL  22  -3.898 -11.917  21.093
  162   HG11  VAL  22          HG11      VAL  22  -4.197 -14.324  22.974
  163   HG12  VAL  22          HG12      VAL  22  -3.542 -14.334  21.319
  164   HG13  VAL  22          HG13      VAL  22  -2.689 -13.480  22.610
  165   HG21  VAL  22          HG21      VAL  22  -5.742 -13.418  20.452
  166   HG22  VAL  22          HG22      VAL  22  -6.444 -13.297  22.069
  167   HG23  VAL  22          HG23      VAL  22  -6.368 -11.868  21.022
  168    H    MET  23           H        MET  23  -3.519  -9.364  22.133
  169    HA   MET  23           HA       MET  23  -5.606  -7.465  22.662
  170    HB2  MET  23           HB2      MET  23  -3.308  -6.783  22.146
  171    HB3  MET  23           HB3      MET  23  -3.384  -7.547  20.560
  172    HG2  MET  23           HG2      MET  23  -3.616  -5.088  20.454
  173    HG3  MET  23           HG3      MET  23  -4.980  -5.936  19.750
  174    HE1  MET  23           HE1      MET  23  -3.642  -3.914  22.812
  175    HE2  MET  23           HE2      MET  23  -5.082  -3.805  23.860
  176    HE3  MET  23           HE3      MET  23  -4.286  -5.364  23.620
  177    H    TRP  24           H        TRP  24  -7.470  -6.977  21.518
  178    HA   TRP  24           HA       TRP  24  -7.782  -7.949  18.747
  179    HB2  TRP  24           HB2      TRP  24  -8.781  -9.572  20.373
  180    HB3  TRP  24           HB3      TRP  24  -9.835  -8.302  20.959
  181    HD1  TRP  24           HD1      TRP  24 -12.144  -8.841  20.165
  182    HE1  TRP  24           HE1      TRP  24 -13.281  -9.774  18.096
  183    HE3  TRP  24           HE3      TRP  24  -7.982  -9.744  17.342
  184    HZ2  TRP  24           HZ2      TRP  24 -12.465 -10.915  15.553
  185    HZ3  TRP  24           HZ3      TRP  24  -8.180 -10.888  15.167
  186    HH2  TRP  24           HH2      TRP  24 -10.438 -11.450  14.248
  187    H    ALA  25           H        ALA  25  -8.620  -6.228  17.501
  188    HA   ALA  25           HA       ALA  25  -9.578  -3.809  18.974
  189    HB1  ALA  25           HB1      ALA  25  -7.202  -4.083  17.087
  190    HB2  ALA  25           HB2      ALA  25  -8.018  -2.545  17.374
  191    HB3  ALA  25           HB3      ALA  25  -7.246  -3.382  18.737
  192    H    ARG  26           H        ARG  26 -10.632  -2.261  17.673
  193    HA   ARG  26           HA       ARG  26 -11.744  -3.214  15.066
  194    HB2  ARG  26           HB2      ARG  26 -13.386  -3.468  16.816
  195    HB3  ARG  26           HB3      ARG  26 -13.055  -1.861  17.458
  196    HG2  ARG  26           HG2      ARG  26 -14.009  -0.821  15.477
  197    HG3  ARG  26           HG3      ARG  26 -14.310  -2.402  14.731
  198    HD2  ARG  26           HD2      ARG  26 -15.987  -2.967  16.281
  199    HD3  ARG  26           HD3      ARG  26 -15.391  -1.830  17.500
  200    HE   ARG  26           HE       ARG  26 -16.204  -0.353  15.217
  201   HH11  ARG  26          HH21      ARG  26 -17.812  -2.345  17.706
  202   HH12  ARG  26          HH22      ARG  26 -19.137  -1.253  17.898
  203   HH21  ARG  26          HH11      ARG  26 -17.722   1.200  15.745
  204   HH22  ARG  26          HH12      ARG  26 -19.163   0.789  16.641
  205    H    ARG  27           H        ARG  27 -11.304  -1.737  13.454
  206    HA   ARG  27           HA       ARG  27  -9.577   0.503  14.258
  207    HB2  ARG  27           HB2      ARG  27  -8.872  -1.209  12.646
  208    HB3  ARG  27           HB3      ARG  27 -10.136  -0.706  11.516
  209    HG2  ARG  27           HG2      ARG  27  -9.063   1.409  11.138
  210    HG3  ARG  27           HG3      ARG  27  -8.029   1.228  12.569
  211    HD2  ARG  27           HD2      ARG  27  -6.731  -0.527  11.477
  212    HD3  ARG  27           HD3      ARG  27  -7.842  -0.538  10.101
  213    HE   ARG  27           HE       ARG  27  -6.839   1.298   9.227
  214   HH11  ARG  27          HH21      ARG  27  -5.527   0.936  12.533
  215   HH12  ARG  27          HH22      ARG  27  -4.680   2.432  12.514
  216   HH21  ARG  27          HH11      ARG  27  -5.658   3.246   9.160
  217   HH22  ARG  27          HH12      ARG  27  -4.898   3.884  10.566
  218    H    PHE  28           H        PHE  28  -9.744   2.625  12.988
  219    HA   PHE  28           HA       PHE  28 -12.004   3.995  13.718
  220    HB2  PHE  28           HB2      PHE  28  -9.919   5.103  13.091
  221    HB3  PHE  28           HB3      PHE  28 -10.091   4.587  11.427
  222    HD1  PHE  28           HD2      PHE  28 -12.096   6.427  14.056
  223    HD2  PHE  28           HD1      PHE  28 -10.877   6.217   9.923
  224    HE1  PHE  28           HE2      PHE  28 -13.325   8.530  13.587
  225    HE2  PHE  28           HE1      PHE  28 -12.103   8.323   9.461
  226    HZ   PHE  28           HZ       PHE  28 -13.331   9.482  11.284
  227    H    GLY  29           H        GLY  29 -14.036   4.035  13.090
  228    HA2  GLY  29           HA2      GLY  29 -15.898   4.202  11.793
  229    HA3  GLY  29           HA3      GLY  29 -14.852   4.349  10.371
  230    H    GLN  30           H        GLN  30 -14.199   1.436  12.147
  231    HA   GLN  30           HA       GLN  30 -15.656  -0.113  10.067
  232    HB2  GLN  30           HB2      GLN  30 -13.434  -1.117  11.872
  233    HB3  GLN  30           HB3      GLN  30 -14.120  -1.892  10.448
  234    HG2  GLN  30           HG2      GLN  30 -12.350   0.560  10.562
  235    HG3  GLN  30           HG3      GLN  30 -11.973  -1.005   9.856
  236   HE21  GLN  30          HE22      GLN  30 -12.756   2.127   9.040
  237   HE22  GLN  30          HE21      GLN  30 -13.452   1.833   7.449
  238    H    HIS  31           H        HIS  31 -16.820  -1.949  10.676
  239    HA   HIS  31           HA       HIS  31 -17.737  -2.054  13.521
  240    HB2  HIS  31           HB2      HIS  31 -19.242  -2.904  11.025
  241    HB3  HIS  31           HB3      HIS  31 -19.852  -2.884  12.676
  242    HD1  HIS  31           HD1      HIS  31 -20.303  -0.894   9.742
  243    HD2  HIS  31           HD2      HIS  31 -19.368  -0.073  13.770
  244    HE1  HIS  31           HE1      HIS  31 -20.922   1.539  10.141
  245    H    SER  32           H        SER  32 -15.337  -3.367  12.148
  246    HA   SER  32           HA       SER  32 -16.023  -6.218  12.647
  247    HB2  SER  32           HB2      SER  32 -14.212  -5.144  10.454
  248    HB3  SER  32           HB3      SER  32 -14.650  -6.835  10.745
  249    HG   SER  32           HG       SER  32 -15.914  -5.870   9.057
  250    H    TRP  33           H        TRP  33 -14.387  -7.405  13.661
  251    HA   TRP  33           HA       TRP  33 -12.323  -5.754  15.010
  252    HB2  TRP  33           HB2      TRP  33 -13.511  -8.454  15.705
  253    HB3  TRP  33           HB3      TRP  33 -12.205  -7.613  16.559
  254    HD1  TRP  33           HD1      TRP  33 -15.974  -7.118  15.828
  255    HE1  TRP  33           HE1      TRP  33 -16.966  -5.629  17.642
  256    HE3  TRP  33           HE3      TRP  33 -11.693  -6.106  18.407
  257    HZ2  TRP  33           HZ2      TRP  33 -15.976  -4.045  19.896
  258    HZ3  TRP  33           HZ3      TRP  33 -11.721  -4.564  20.341
  259    HH2  TRP  33           HH2      TRP  33 -13.851  -3.528  21.094
  260    H    GLN  34           H        GLN  34 -10.170  -6.498  15.172
  261    HA   GLN  34           HA       GLN  34  -9.254  -8.652  13.431
  262    HB2  GLN  34           HB2      GLN  34  -7.972  -7.261  11.975
  263    HB3  GLN  34           HB3      GLN  34  -9.620  -6.680  11.913
  264    HG2  GLN  34           HG2      GLN  34  -8.999  -4.763  13.386
  265    HG3  GLN  34           HG3      GLN  34  -7.347  -5.366  13.494
  266   HE21  GLN  34          HE22      GLN  34  -6.305  -3.478  12.438
  267   HE22  GLN  34          HE21      GLN  34  -6.616  -3.176  10.760
  268    H    PHE  35           H        PHE  35  -6.907  -8.980  13.614
  269    HA   PHE  35           HA       PHE  35  -5.798  -8.207  16.233
  270    HB2  PHE  35           HB2      PHE  35  -4.643  -9.704  13.851
  271    HB3  PHE  35           HB3      PHE  35  -3.774  -9.436  15.363
  272    HD1  PHE  35           HD2      PHE  35  -5.428 -10.148  17.512
  273    HD2  PHE  35           HD1      PHE  35  -5.224 -11.978  13.586
  274    HE1  PHE  35           HE2      PHE  35  -6.353 -12.239  18.439
  275    HE2  PHE  35           HE1      PHE  35  -6.111 -14.070  14.554
  276    HZ   PHE  35           HZ       PHE  35  -6.727 -14.208  16.944
  277    HA   PRO  36           HA       PRO  36  -4.126  -4.369  14.705
  278    HB2  PRO  36           HB2      PRO  36  -1.525  -5.340  15.896
  279    HB3  PRO  36           HB3      PRO  36  -2.214  -3.691  15.968
  280    HG2  PRO  36           HG2      PRO  36  -2.516  -5.356  18.068
  281    HG3  PRO  36           HG3      PRO  36  -3.930  -4.414  17.492
  282    HD2  PRO  36           HD2      PRO  36  -3.291  -7.330  17.009
  283    HD3  PRO  36           HD3      PRO  36  -4.863  -6.539  17.314
  284    H    GLN  37           H        GLN  37  -3.488  -3.856  12.570
  285    HA   GLN  37           HA       GLN  37  -1.470  -5.567  11.187
  286    HB2  GLN  37           HB2      GLN  37  -4.397  -5.222  10.546
  287    HB3  GLN  37           HB3      GLN  37  -3.256  -5.457   9.224
  288    HG2  GLN  37           HG2      GLN  37  -2.547  -7.581   9.998
  289    HG3  GLN  37           HG3      GLN  37  -3.305  -7.360  11.576
  290   HE21  GLN  37          HE22      GLN  37  -5.612  -7.377  11.756
  291   HE22  GLN  37          HE21      GLN  37  -6.586  -8.273  10.582
  292    H    GLY  38           H        GLY  38  -0.670  -4.725   9.152
  293    HA2  GLY  38           HA2      GLY  38  -1.645  -2.305   8.020
  294    HA3  GLY  38           HA3      GLY  38  -0.225  -1.951   8.992
  295    H    GLY  39           H        GLY  39   0.348  -1.290   6.571
  296    HA2  GLY  39           HA2      GLY  39   1.032  -3.558   4.811
  297    HA3  GLY  39           HA3      GLY  39   0.833  -1.875   4.344
  298    H    ILE  40           H        ILE  40   3.096  -3.771   4.063
  299    HA   ILE  40           HA       ILE  40   5.327  -2.455   5.485
  300    HB   ILE  40           HB       ILE  40   5.435  -4.371   3.136
  301   HG12  ILE  40          HG12      ILE  40   5.482  -5.104   6.099
  302   HG13  ILE  40          HG13      ILE  40   4.148  -5.443   5.001
  303   HG21  ILE  40          HG21      ILE  40   7.518  -3.920   5.312
  304   HG22  ILE  40          HG22      ILE  40   7.688  -4.912   3.853
  305   HG23  ILE  40          HG23      ILE  40   7.560  -3.157   3.702
  306   HD11  ILE  40          HD11      ILE  40   5.135  -7.461   4.947
  307   HD12  ILE  40          HD12      ILE  40   5.975  -6.708   3.591
  308   HD13  ILE  40          HD13      ILE  40   6.788  -6.820   5.165
  309    H    ASN  41           H        ASN  41   6.172  -0.560   4.720
  310    HA   ASN  41           HA       ASN  41   5.159   0.618   2.252
  311    HB2  ASN  41           HB2      ASN  41   7.320   1.466   4.236
  312    HB3  ASN  41           HB3      ASN  41   6.970   2.367   2.778
  313   HD21  ASN  41          HD22      ASN  41   5.562   1.196   5.841
  314   HD22  ASN  41          HD21      ASN  41   4.193   2.314   5.843
  315    HA   PRO  42           HA       PRO  42   8.247  -1.053  -0.515
  316    HB2  PRO  42           HB2      PRO  42   8.997   1.121  -2.062
  317    HB3  PRO  42           HB3      PRO  42   7.497   0.172  -2.295
  318    HG2  PRO  42           HG2      PRO  42   7.839   2.778  -0.783
  319    HG3  PRO  42           HG3      PRO  42   6.574   2.345  -1.977
  320    HD2  PRO  42           HD2      PRO  42   6.102   2.192   0.677
  321    HD3  PRO  42           HD3      PRO  42   5.465   0.936  -0.422
  322    H    GLY  43           H        GLY  43  10.276  -1.556   0.136
  323    HA2  GLY  43           HA2      GLY  43  12.508  -1.244   0.665
  324    HA3  GLY  43           HA3      GLY  43  12.232   0.479   0.933
  325    H    GLU  44           H        GLU  44   9.790  -0.852   2.796
  326    HA   GLU  44           HA       GLU  44  11.334  -0.793   5.243
  327    HB2  GLU  44           HB2      GLU  44   8.539  -0.657   4.511
  328    HB3  GLU  44           HB3      GLU  44   8.755  -2.002   5.644
  329    HG2  GLU  44           HG2      GLU  44   9.793  -0.574   7.249
  330    HG3  GLU  44           HG3      GLU  44   9.779   0.794   6.109
  331    H    SER  45           H        SER  45  11.380  -2.610   6.754
  332    HA   SER  45           HA       SER  45  11.384  -5.289   5.469
  333    HB2  SER  45           HB2      SER  45  12.763  -5.908   7.501
  334    HB3  SER  45           HB3      SER  45  13.544  -4.841   6.327
  335    HG   SER  45           HG       SER  45  13.899  -4.046   8.398
  336    H    ALA  46           H        ALA  46  10.372  -6.980   6.852
  337    HA   ALA  46           HA       ALA  46   7.743  -6.212   7.419
  338    HB1  ALA  46           HB1      ALA  46   8.449  -8.491   6.782
  339    HB2  ALA  46           HB2      ALA  46   9.291  -8.675   8.353
  340    HB3  ALA  46           HB3      ALA  46   7.515  -8.541   8.289
  341    H    GLU  47           H        GLU  47  10.459  -6.660   9.679
  342    HA   GLU  47           HA       GLU  47   8.920  -6.401  12.076
  343    HB2  GLU  47           HB2      GLU  47  11.077  -7.543  11.778
  344    HB3  GLU  47           HB3      GLU  47  11.869  -5.990  11.469
  345    HG2  GLU  47           HG2      GLU  47  11.167  -5.256  13.775
  346    HG3  GLU  47           HG3      GLU  47  10.522  -6.879  14.043
  347    H    GLN  48           H        GLN  48  10.534  -4.025   9.896
  348    HA   GLN  48           HA       GLN  48  10.168  -1.853  11.777
  349    HB2  GLN  48           HB2      GLN  48  10.813  -1.820   8.835
  350    HB3  GLN  48           HB3      GLN  48  10.743  -0.376   9.871
  351    HG2  GLN  48           HG2      GLN  48  12.488  -2.802  10.326
  352    HG3  GLN  48           HG3      GLN  48  13.061  -1.283   9.630
  353   HE21  GLN  48          HE22      GLN  48  14.068  -2.717  11.917
  354   HE22  GLN  48          HE21      GLN  48  13.906  -1.678  13.322
  355    H    ALA  49           H        ALA  49   8.304  -3.244   9.052
  356    HA   ALA  49           HA       ALA  49   6.267  -1.231   8.992
  357    HB1  ALA  49           HB1      ALA  49   5.007  -2.946   7.777
  358    HB2  ALA  49           HB2      ALA  49   6.698  -2.864   7.201
  359    HB3  ALA  49           HB3      ALA  49   6.164  -4.200   8.272
  360    H    MET  50           H        MET  50   6.737  -4.272  10.849
  361    HA   MET  50           HA       MET  50   4.279  -4.275  12.247
  362    HB2  MET  50           HB2      MET  50   5.694  -6.217  12.233
  363    HB3  MET  50           HB3      MET  50   7.053  -5.321  12.867
  364    HG2  MET  50           HG2      MET  50   5.246  -5.019  14.923
  365    HG3  MET  50           HG3      MET  50   4.833  -6.600  14.266
  366    HE1  MET  50           HE1      MET  50   8.796  -5.430  16.309
  367    HE2  MET  50           HE2      MET  50   8.227  -4.537  14.892
  368    HE3  MET  50           HE3      MET  50   7.270  -4.521  16.397
  369    H    TYR  51           H        TYR  51   7.464  -2.725  13.194
  370    HA   TYR  51           HA       TYR  51   6.356  -1.609  15.562
  371    HB2  TYR  51           HB2      TYR  51   8.729  -0.738  13.884
  372    HB3  TYR  51           HB3      TYR  51   8.281   0.016  15.408
  373    HD1  TYR  51           HD2      TYR  51   7.798  -1.793  17.406
  374    HD2  TYR  51           HD1      TYR  51  10.510  -2.300  14.077
  375    HE1  TYR  51           HE2      TYR  51   9.248  -3.230  18.800
  376    HE2  TYR  51           HE1      TYR  51  11.950  -3.742  15.472
  377    HH   TYR  51           HH       TYR  51  11.255  -4.438  18.931
  378    H    ARG  52           H        ARG  52   6.551  -0.112  12.203
  379    HA   ARG  52           HA       ARG  52   5.580   2.427  13.110
  380    HB2  ARG  52           HB2      ARG  52   6.768   2.098  10.990
  381    HB3  ARG  52           HB3      ARG  52   5.528   0.971  10.437
  382    HG2  ARG  52           HG2      ARG  52   3.853   2.951  10.612
  383    HG3  ARG  52           HG3      ARG  52   5.273   3.989  10.803
  384    HD2  ARG  52           HD2      ARG  52   4.884   1.968   8.565
  385    HD3  ARG  52           HD3      ARG  52   4.352   3.656   8.407
  386    HE   ARG  52           HE       ARG  52   7.047   2.523   8.326
  387   HH11  ARG  52          HH11      ARG  52   5.247   5.603   8.625
  388   HH12  ARG  52          HH12      ARG  52   6.592   6.577   8.153
  389   HH21  ARG  52          HH21      ARG  52   8.798   3.815   7.730
  390   HH22  ARG  52          HH22      ARG  52   8.662   5.537   7.610
  391    H    GLU  53           H        GLU  53   3.924  -0.432  11.623
  392    HA   GLU  53           HA       GLU  53   1.448   0.960  11.587
  393    HB2  GLU  53           HB2      GLU  53   2.015  -1.976  11.166
  394    HB3  GLU  53           HB3      GLU  53   0.475  -1.169  10.871
  395    HG2  GLU  53           HG2      GLU  53   3.069  -0.243   9.573
  396    HG3  GLU  53           HG3      GLU  53   2.057  -1.482   8.849
  397    H    LEU  54           H        LEU  54   3.009  -1.106  14.013
  398    HA   LEU  54           HA       LEU  54   0.770  -1.601  15.669
  399    HB2  LEU  54           HB2      LEU  54   3.057  -2.545  16.036
  400    HB3  LEU  54           HB3      LEU  54   3.658  -0.937  16.419
  401    HG   LEU  54           HG       LEU  54   2.071  -0.878  18.386
  402   HD11  LEU  54          HD11      LEU  54   0.391  -2.530  17.627
  403   HD12  LEU  54          HD12      LEU  54   1.614  -3.775  17.540
  404   HD13  LEU  54          HD13      LEU  54   1.143  -3.124  19.120
  405   HD21  LEU  54          HD21      LEU  54   4.420  -1.447  18.664
  406   HD22  LEU  54          HD22      LEU  54   3.425  -2.426  19.749
  407   HD23  LEU  54          HD23      LEU  54   4.088  -3.149  18.263
  408    H    PHE  55           H        PHE  55   2.992   1.300  15.548
  409    HA   PHE  55           HA       PHE  55   1.635   2.728  17.585
  410    HB2  PHE  55           HB2      PHE  55   3.824   3.388  16.545
  411    HB3  PHE  55           HB3      PHE  55   2.951   3.899  15.101
  412    HD1  PHE  55           HD1      PHE  55   1.395   5.868  15.181
  413    HD2  PHE  55           HD2      PHE  55   3.789   4.712  18.585
  414    HE1  PHE  55           HE1      PHE  55   0.941   8.054  16.247
  415    HE2  PHE  55           HE2      PHE  55   3.326   6.906  19.645
  416    HZ   PHE  55           HZ       PHE  55   1.898   8.584  18.485
  417    H    GLU  56           H        GLU  56   0.923   2.425  14.070
  418    HA   GLU  56           HA       GLU  56  -1.193   4.301  14.152
  419    HB2  GLU  56           HB2      GLU  56  -0.422   2.213  12.106
  420    HB3  GLU  56           HB3      GLU  56  -1.711   3.386  11.853
  421    HG2  GLU  56           HG2      GLU  56   1.090   4.275  12.604
  422    HG3  GLU  56           HG3      GLU  56   0.642   3.956  10.939
  423    H    GLU  57           H        GLU  57  -1.188   1.320  15.617
  424    HA   GLU  57           HA       GLU  57  -4.148   0.949  15.317
  425    HB2  GLU  57           HB2      GLU  57  -1.950  -1.031  16.004
  426    HB3  GLU  57           HB3      GLU  57  -3.658  -1.381  16.190
  427    HG2  GLU  57           HG2      GLU  57  -2.439  -0.636  13.503
  428    HG3  GLU  57           HG3      GLU  57  -2.470  -2.274  14.137
  429    H    VAL  58           H        VAL  58  -1.432   1.046  17.674
  430    HA   VAL  58           HA       VAL  58  -3.403   1.394  19.912
  431    HB   VAL  58           HB       VAL  58  -1.542   0.016  21.206
  432   HG11  VAL  58          HG11      VAL  58  -2.652  -2.085  20.839
  433   HG12  VAL  58          HG12      VAL  58  -3.830  -0.793  20.994
  434   HG13  VAL  58          HG13      VAL  58  -3.468  -1.442  19.378
  435   HG21  VAL  58          HG21      VAL  58  -1.109  -1.180  18.493
  436   HG22  VAL  58          HG22      VAL  58   0.009  -0.045  19.289
  437   HG23  VAL  58          HG23      VAL  58  -0.359  -1.606  20.055
  438    H    GLY  59           H        GLY  59  -1.055   3.070  18.293
  439    HA2  GLY  59           HA2      GLY  59   0.220   4.872  18.848
  440    HA3  GLY  59           HA3      GLY  59  -0.697   4.965  20.360
  441    H    LEU  60           H        LEU  60   0.758   1.928  20.130
  442    HA   LEU  60           HA       LEU  60   2.683   2.443  22.194
  443    HB2  LEU  60           HB2      LEU  60   1.109   0.521  21.982
  444    HB3  LEU  60           HB3      LEU  60   1.965   0.020  20.513
  445    HG   LEU  60           HG       LEU  60   3.959  -0.572  21.800
  446   HD11  LEU  60          HD11      LEU  60   2.344   0.371  24.201
  447   HD12  LEU  60          HD12      LEU  60   3.842  -0.585  24.267
  448   HD13  LEU  60          HD13      LEU  60   3.876   1.063  23.628
  449   HD21  LEU  60          HD21      LEU  60   1.993  -2.145  21.479
  450   HD22  LEU  60          HD22      LEU  60   2.815  -2.448  23.024
  451   HD23  LEU  60          HD23      LEU  60   1.284  -1.549  22.979
  452    H    SER  61           H        SER  61   4.931   2.101  22.008
  453    HA   SER  61           HA       SER  61   6.088   2.151  19.262
  454    HB2  SER  61           HB2      SER  61   7.706   3.830  20.209
  455    HB3  SER  61           HB3      SER  61   6.038   4.401  20.111
  456    HG   SER  61           HG       SER  61   6.919   4.920  22.144
  457    H    ARG  62           H        ARG  62   8.487   1.706  19.401
  458    HA   ARG  62           HA       ARG  62   8.986  -0.923  20.052
  459    HB2  ARG  62           HB2      ARG  62  11.122   1.245  19.993
  460    HB3  ARG  62           HB3      ARG  62  11.305  -0.481  19.675
  461    HG2  ARG  62           HG2      ARG  62   9.534   0.004  17.747
  462    HG3  ARG  62           HG3      ARG  62  10.087   1.663  17.935
  463    HD2  ARG  62           HD2      ARG  62  12.488   0.806  17.699
  464    HD3  ARG  62           HD3      ARG  62  11.811  -0.785  17.374
  465    HE   ARG  62           HE       ARG  62  11.354  -0.186  15.237
  466   HH11  ARG  62          HH11      ARG  62  11.914   2.861  17.013
  467   HH12  ARG  62          HH12      ARG  62  12.024   3.820  15.585
  468   HH21  ARG  62          HH21      ARG  62  11.664   1.089  13.347
  469   HH22  ARG  62          HH22      ARG  62  11.807   2.808  13.472
  470    H    LYS  63           H        LYS  63   9.330   1.914  22.140
  471    HA   LYS  63           HA       LYS  63  11.235   0.815  23.916
  472    HB2  LYS  63           HB2      LYS  63   9.178   2.957  24.624
  473    HB3  LYS  63           HB3      LYS  63  10.809   2.748  25.283
  474    HG2  LYS  63           HG2      LYS  63  10.072   3.739  22.516
  475    HG3  LYS  63           HG3      LYS  63  10.741   4.690  23.836
  476    HD2  LYS  63           HD2      LYS  63  12.141   2.293  22.641
  477    HD3  LYS  63           HD3      LYS  63  12.361   3.944  22.017
  478    HE2  LYS  63           HE2      LYS  63  13.128   4.672  24.289
  479    HE3  LYS  63           HE3      LYS  63  13.010   3.006  24.861
  480    HZ1  LYS  63           HZ1      LYS  63  15.271   3.559  24.230
  481    HZ2  LYS  63           HZ2      LYS  63  14.716   2.401  23.221
  482    HZ3  LYS  63           HZ3      LYS  63  14.827   3.958  22.712
  483    H    ASP  64           H        ASP  64   7.781   0.347  23.761
  484    HA   ASP  64           HA       ASP  64   7.969  -1.023  26.412
  485    HB2  ASP  64           HB2      ASP  64   6.629   1.142  26.339
  486    HB3  ASP  64           HB3      ASP  64   5.407   0.218  25.483
  487    H    VAL  65           H        VAL  65   8.438  -2.071  23.640
  488    HA   VAL  65           HA       VAL  65   6.760  -4.475  24.085
  489    HB   VAL  65           HB       VAL  65   6.592  -4.829  21.640
  490   HG11  VAL  65          HG11      VAL  65   4.654  -3.430  21.367
  491   HG12  VAL  65          HG12      VAL  65   4.739  -3.951  23.065
  492   HG13  VAL  65          HG13      VAL  65   5.229  -2.308  22.631
  493   HG21  VAL  65          HG21      VAL  65   8.392  -3.247  20.908
  494   HG22  VAL  65          HG22      VAL  65   6.851  -2.956  20.072
  495   HG23  VAL  65          HG23      VAL  65   7.362  -1.894  21.396
  496    H    ARG  66           H        ARG  66   7.649  -6.421  23.063
  497    HA   ARG  66           HA       ARG  66  10.525  -6.392  22.411
  498    HB2  ARG  66           HB2      ARG  66  11.091  -8.139  23.979
  499    HB3  ARG  66           HB3      ARG  66  10.403  -6.777  24.861
  500    HG2  ARG  66           HG2      ARG  66   8.126  -8.256  24.529
  501    HG3  ARG  66           HG3      ARG  66   9.293  -9.560  24.449
  502    HD2  ARG  66           HD2      ARG  66   8.909  -7.482  26.623
  503    HD3  ARG  66           HD3      ARG  66   8.428  -9.196  26.695
  504    HE   ARG  66           HE       ARG  66  11.208  -9.108  26.200
  505   HH11  ARG  66          HH21      ARG  66   9.048  -8.176  28.904
  506   HH12  ARG  66          HH22      ARG  66  10.310  -8.343  30.094
  507   HH21  ARG  66          HH11      ARG  66  12.782  -9.447  27.859
  508   HH22  ARG  66          HH12      ARG  66  12.353  -9.180  29.528
  509    H    ILE  67           H        ILE  67  10.925  -8.129  20.839
  510    HA   ILE  67           HA       ILE  67   8.453  -9.332  19.774
  511    HB   ILE  67           HB       ILE  67  11.296  -9.479  18.704
  512   HG12  ILE  67          HG12      ILE  67   9.052  -7.776  17.535
  513   HG13  ILE  67          HG13      ILE  67  10.213  -7.115  18.685
  514   HG21  ILE  67          HG21      ILE  67   8.606 -10.182  17.408
  515   HG22  ILE  67          HG22      ILE  67  10.192 -10.305  16.628
  516   HG23  ILE  67          HG23      ILE  67   9.819 -11.357  17.979
  517   HD11  ILE  67          HD11      ILE  67  10.873  -8.309  15.976
  518   HD12  ILE  67          HD12      ILE  67  10.927  -6.604  16.444
  519   HD13  ILE  67          HD13      ILE  67  12.066  -7.749  17.185
  520    H    LEU  68           H        LEU  68   7.811 -11.186  20.509
  521    HA   LEU  68           HA       LEU  68   9.712 -12.946  22.002
  522    HB2  LEU  68           HB2      LEU  68   6.691 -13.013  21.656
  523    HB3  LEU  68           HB3      LEU  68   7.636 -14.157  22.592
  524    HG   LEU  68           HG       LEU  68   7.299 -11.187  23.285
  525   HD11  LEU  68          HD11      LEU  68   6.006 -13.778  24.161
  526   HD12  LEU  68          HD12      LEU  68   6.150 -12.405  25.257
  527   HD13  LEU  68          HD13      LEU  68   5.273 -12.203  23.720
  528   HD21  LEU  68          HD21      LEU  68   8.732 -13.440  24.771
  529   HD22  LEU  68          HD22      LEU  68   9.506 -12.016  24.036
  530   HD23  LEU  68          HD23      LEU  68   8.411 -11.808  25.404
  531    H    ALA  69           H        ALA  69   7.687 -12.745  19.060
  532    HA   ALA  69           HA       ALA  69   8.887 -15.123  17.902
  533    HB1  ALA  69           HB1      ALA  69   5.917 -15.303  18.499
  534    HB2  ALA  69           HB2      ALA  69   7.006 -16.563  17.894
  535    HB3  ALA  69           HB3      ALA  69   7.122 -16.017  19.575
  536    H    SER  70           H        SER  70   7.925 -15.584  15.840
  537    HA   SER  70           HA       SER  70   6.245 -13.690  14.547
  538    HB2  SER  70           HB2      SER  70   7.956 -12.908  12.842
  539    HB3  SER  70           HB3      SER  70   8.098 -12.242  14.474
  540    HG   SER  70           HG       SER  70  10.149 -12.904  13.640
  541    H    THR  71           H        THR  71   5.722 -14.332  12.228
  542    HA   THR  71           HA       THR  71   5.496 -17.182  12.300
  543    HB   THR  71           HB       THR  71   4.517 -16.754   9.918
  544    HG1  THR  71           HG1      THR  71   5.024 -14.746   9.445
  545   HG21  THR  71          HG21      THR  71   2.376 -15.831  10.927
  546   HG22  THR  71          HG22      THR  71   2.976 -17.377  11.539
  547   HG23  THR  71          HG23      THR  71   3.222 -15.910  12.493
  548    H    ARG  72           H        ARG  72   6.293 -18.772  11.145
  549    HA   ARG  72           HA       ARG  72   8.996 -18.402  10.031
  550    HB2  ARG  72           HB2      ARG  72   7.217 -20.858  10.383
  551    HB3  ARG  72           HB3      ARG  72   8.941 -20.898  10.007
  552    HG2  ARG  72           HG2      ARG  72   9.593 -20.336  12.174
  553    HG3  ARG  72           HG3      ARG  72   8.124 -19.433  12.524
  554    HD2  ARG  72           HD2      ARG  72   6.847 -21.632  12.459
  555    HD3  ARG  72           HD3      ARG  72   8.404 -22.457  12.476
  556    HE   ARG  72           HE       ARG  72   7.076 -20.881  14.595
  557   HH11  ARG  72          HH11      ARG  72  10.106 -22.511  13.654
  558   HH12  ARG  72          HH12      ARG  72  10.702 -22.640  15.267
  559   HH21  ARG  72          HH21      ARG  72   7.874 -21.075  16.757
  560   HH22  ARG  72          HH22      ARG  72   9.411 -21.796  17.058
  561    H    ASN  73           H        ASN  73   5.716 -18.899   8.908
  562    HA   ASN  73           HA       ASN  73   6.559 -18.977   6.101
  563    HB2  ASN  73           HB2      ASN  73   4.902 -20.542   5.576
  564    HB3  ASN  73           HB3      ASN  73   5.678 -21.190   7.026
  565   HD21  ASN  73          HD22      ASN  73   4.411 -20.722   9.227
  566   HD22  ASN  73          HD21      ASN  73   2.686 -20.679   9.094
  567    H    TRP  74           H        TRP  74   5.098 -17.794   4.664
  568    HA   TRP  74           HA       TRP  74   3.846 -15.533   6.097
  569    HB2  TRP  74           HB2      TRP  74   4.363 -16.080   3.146
  570    HB3  TRP  74           HB3      TRP  74   3.438 -14.710   3.722
  571    HD1  TRP  74           HD1      TRP  74   7.049 -16.072   3.879
  572    HE1  TRP  74           HE1      TRP  74   8.665 -14.112   4.204
  573    HE3  TRP  74           HE3      TRP  74   3.658 -12.293   4.389
  574    HZ2  TRP  74           HZ2      TRP  74   8.506 -11.309   4.806
  575    HZ3  TRP  74           HZ3      TRP  74   4.407  -9.968   4.862
  576    HH2  TRP  74           HH2      TRP  74   6.819  -9.489   5.206
  577    H    LEU  75           H        LEU  75   1.752 -15.101   6.266
  578    HA   LEU  75           HA       LEU  75  -0.089 -17.334   5.608
  579    HB2  LEU  75           HB2      LEU  75  -0.590 -14.957   7.431
  580    HB3  LEU  75           HB3      LEU  75  -1.566 -16.413   7.241
  581    HG   LEU  75           HG       LEU  75   1.121 -16.109   8.604
  582   HD11  LEU  75          HD11      LEU  75  -1.564 -17.215   9.565
  583   HD12  LEU  75          HD12      LEU  75  -0.100 -16.959  10.544
  584   HD13  LEU  75          HD13      LEU  75  -0.948 -15.573   9.837
  585   HD21  LEU  75          HD21      LEU  75  -0.236 -18.736   7.872
  586   HD22  LEU  75          HD22      LEU  75   1.388 -18.154   7.380
  587   HD23  LEU  75          HD23      LEU  75   1.071 -18.552   9.068
  588    H    ARG  76           H        ARG  76   0.282 -16.478   3.251
  589    HA   ARG  76           HA       ARG  76  -1.157 -14.066   2.508
  590    HB2  ARG  76           HB2      ARG  76   0.774 -15.037   1.244
  591    HB3  ARG  76           HB3      ARG  76  -0.154 -16.507   0.961
  592    HG2  ARG  76           HG2      ARG  76  -1.752 -15.242  -0.478
  593    HG3  ARG  76           HG3      ARG  76  -0.846 -13.754  -0.138
  594    HD2  ARG  76           HD2      ARG  76  -0.100 -14.536  -2.252
  595    HD3  ARG  76           HD3      ARG  76   1.198 -14.877  -1.066
  596    HE   ARG  76           HE       ARG  76  -0.530 -17.147  -1.321
  597   HH11  ARG  76          HH11      ARG  76   1.980 -15.445  -3.185
  598   HH12  ARG  76          HH12      ARG  76   2.518 -16.861  -4.011
  599   HH21  ARG  76          HH21      ARG  76   0.198 -19.038  -2.416
  600   HH22  ARG  76          HH22      ARG  76   1.470 -18.937  -3.577
  601    H    TYR  77           H        TYR  77  -3.119 -13.937   1.417
  602    HA   TYR  77           HA       TYR  77  -4.682 -16.329   0.912
  603    HB2  TYR  77           HB2      TYR  77  -6.665 -15.768   2.023
  604    HB3  TYR  77           HB3      TYR  77  -5.383 -15.863   3.208
  605    HD1  TYR  77           HD2      TYR  77  -4.515 -13.770   4.293
  606    HD2  TYR  77           HD1      TYR  77  -7.876 -13.726   1.583
  607    HE1  TYR  77           HE2      TYR  77  -5.242 -11.622   5.227
  608    HE2  TYR  77           HE1      TYR  77  -8.546 -11.524   2.440
  609    HH   TYR  77           HH       TYR  77  -6.851  -9.875   5.165
  610    H    LYS  78           H        LYS  78  -6.268 -15.960  -0.709
  611    HA   LYS  78           HA       LYS  78  -6.021 -13.352  -2.156
  612    HB2  LYS  78           HB2      LYS  78  -6.920 -16.133  -2.995
  613    HB3  LYS  78           HB3      LYS  78  -7.604 -14.713  -3.777
  614    HG2  LYS  78           HG2      LYS  78  -5.789 -15.477  -5.095
  615    HG3  LYS  78           HG3      LYS  78  -5.390 -13.899  -4.405
  616    HD2  LYS  78           HD2      LYS  78  -3.755 -14.775  -2.977
  617    HD3  LYS  78           HD3      LYS  78  -4.439 -16.404  -2.976
  618    HE2  LYS  78           HE2      LYS  78  -3.110 -15.126  -5.404
  619    HE3  LYS  78           HE3      LYS  78  -2.239 -16.111  -4.224
  620    HZ1  LYS  78           HZ1      LYS  78  -4.488 -17.071  -5.921
  621    HZ2  LYS  78           HZ2      LYS  78  -2.913 -17.433  -6.122
  622    HZ3  LYS  78           HZ3      LYS  78  -3.700 -17.980  -4.801
  623    H    LEU  79           H        LEU  79  -7.767 -12.064  -2.267
  624    HA   LEU  79           HA       LEU  79 -10.019 -12.667  -0.406
  625    HB2  LEU  79           HB2      LEU  79 -10.436 -10.403  -0.193
  626    HB3  LEU  79           HB3      LEU  79  -8.782 -10.796   0.196
  627    HG   LEU  79           HG       LEU  79  -7.961  -9.684  -1.789
  628   HD11  LEU  79          HD11      LEU  79  -9.765  -8.297  -3.098
  629   HD12  LEU  79          HD12      LEU  79  -9.507  -9.998  -3.484
  630   HD13  LEU  79          HD13      LEU  79 -10.902  -9.540  -2.492
  631   HD21  LEU  79          HD21      LEU  79 -10.046  -8.027  -0.301
  632   HD22  LEU  79          HD22      LEU  79  -8.396  -8.381   0.267
  633   HD23  LEU  79          HD23      LEU  79  -8.637  -7.390  -1.182
  634    HA   PRO  80           HA       PRO  80 -12.671 -13.508  -3.771
  635    HB2  PRO  80           HB2      PRO  80 -15.148 -13.025  -2.696
  636    HB3  PRO  80           HB3      PRO  80 -14.078 -14.354  -2.133
  637    HG2  PRO  80           HG2      PRO  80 -14.459 -11.614  -0.926
  638    HG3  PRO  80           HG3      PRO  80 -14.469 -13.198  -0.093
  639    HD2  PRO  80           HD2      PRO  80 -12.244 -11.578  -0.245
  640    HD3  PRO  80           HD3      PRO  80 -12.129 -13.367  -0.198
  641    H    LYS  81           H        LYS  81 -14.114 -12.545  -5.408
  642    HA   LYS  81           HA       LYS  81 -13.175  -9.971  -6.043
  643    HB2  LYS  81           HB2      LYS  81 -14.614  -9.991  -7.954
  644    HB3  LYS  81           HB3      LYS  81 -13.603 -11.438  -7.770
  645    HG2  LYS  81           HG2      LYS  81 -15.478 -12.765  -7.151
  646    HG3  LYS  81           HG3      LYS  81 -16.469 -11.337  -6.803
  647    HD2  LYS  81           HD2      LYS  81 -17.150 -12.478  -8.888
  648    HD3  LYS  81           HD3      LYS  81 -16.698 -10.774  -9.104
  649    HE2  LYS  81           HE2      LYS  81 -14.544 -11.387 -10.062
  650    HE3  LYS  81           HE3      LYS  81 -14.811 -13.102  -9.687
  651    HZ1  LYS  81           HZ1      LYS  81 -16.651 -13.091 -11.279
  652    HZ2  LYS  81           HZ2      LYS  81 -16.405 -11.508 -11.623
  653    HZ3  LYS  81           HZ3      LYS  81 -15.276 -12.615 -12.014
  654    H    ARG  82           H        ARG  82 -16.044 -10.771  -4.306
  655    HA   ARG  82           HA       ARG  82 -17.373  -8.289  -4.564
  656    HB2  ARG  82           HB2      ARG  82 -18.484  -8.748  -2.457
  657    HB3  ARG  82           HB3      ARG  82 -18.438 -10.172  -3.505
  658    HG2  ARG  82           HG2      ARG  82 -16.405 -10.935  -2.101
  659    HG3  ARG  82           HG3      ARG  82 -16.837  -9.654  -0.958
  660    HD2  ARG  82           HD2      ARG  82 -18.653 -11.899  -1.907
  661    HD3  ARG  82           HD3      ARG  82 -17.764 -11.903  -0.372
  662    HE   ARG  82           HE       ARG  82 -19.231  -9.547  -0.321
  663   HH11  ARG  82          HH11      ARG  82 -20.027 -13.015  -0.518
  664   HH12  ARG  82          HH12      ARG  82 -21.570 -12.842   0.237
  665   HH21  ARG  82          HH21      ARG  82 -21.297  -9.324   0.665
  666   HH22  ARG  82          HH22      ARG  82 -22.302 -10.702   0.924
  667    H    LEU  83           H        LEU  83 -14.490  -9.081  -2.728
  668    HA   LEU  83           HA       LEU  83 -14.393  -6.405  -1.518
  669    HB2  LEU  83           HB2      LEU  83 -12.403  -8.660  -1.245
  670    HB3  LEU  83           HB3      LEU  83 -12.510  -7.208  -0.258
  671    HG   LEU  83           HG       LEU  83 -14.473  -9.531  -0.326
  672   HD11  LEU  83          HD11      LEU  83 -12.303  -9.922   0.891
  673   HD12  LEU  83          HD12      LEU  83 -12.700  -8.552   1.946
  674   HD13  LEU  83          HD13      LEU  83 -13.732 -10.003   1.921
  675   HD21  LEU  83          HD21      LEU  83 -15.791  -7.526   0.059
  676   HD22  LEU  83          HD22      LEU  83 -15.644  -8.438   1.560
  677   HD23  LEU  83          HD23      LEU  83 -14.655  -6.982   1.319
  678    H    VAL  84           H        VAL  84 -13.128  -8.179  -4.265
  679    HA   VAL  84           HA       VAL  84 -10.741  -6.626  -4.605
  680    HB   VAL  84           HB       VAL  84 -12.383  -8.087  -6.725
  681   HG11  VAL  84          HG11      VAL  84 -10.971  -6.522  -7.860
  682   HG12  VAL  84          HG12      VAL  84  -9.605  -6.901  -6.788
  683   HG13  VAL  84          HG13      VAL  84 -10.157  -8.087  -7.969
  684   HG21  VAL  84          HG21      VAL  84 -10.868  -9.926  -6.611
  685   HG22  VAL  84          HG22      VAL  84  -9.764  -9.052  -5.528
  686   HG23  VAL  84          HG23      VAL  84 -11.332  -9.620  -4.932
  687    H    ARG  85           H        ARG  85 -10.525  -4.539  -5.423
  688    HA   ARG  85           HA       ARG  85 -12.901  -3.299  -6.670
  689    HB2  ARG  85           HB2      ARG  85 -10.777  -2.336  -4.885
  690    HB3  ARG  85           HB3      ARG  85 -10.924  -1.314  -6.327
  691    HG2  ARG  85           HG2      ARG  85 -13.275  -2.176  -4.644
  692    HG3  ARG  85           HG3      ARG  85 -12.400  -0.642  -4.419
  693    HD2  ARG  85           HD2      ARG  85 -12.867  -0.166  -6.899
  694    HD3  ARG  85           HD3      ARG  85 -14.012  -1.496  -6.889
  695    HE   ARG  85           HE       ARG  85 -14.232   1.159  -5.658
  696   HH11  ARG  85          HH21      ARG  85 -15.682  -2.112  -5.633
  697   HH12  ARG  85          HH22      ARG  85 -17.187  -1.570  -4.988
  698   HH21  ARG  85          HH11      ARG  85 -16.229   1.841  -4.784
  699   HH22  ARG  85          HH12      ARG  85 -17.500   0.710  -4.488
  700    H    TRP  86           H        TRP  86 -12.847  -4.341  -8.531
  701    HA   TRP  86           HA       TRP  86 -10.647  -4.375 -10.347
  702    HB2  TRP  86           HB2      TRP  86 -13.656  -4.679 -10.630
  703    HB3  TRP  86           HB3      TRP  86 -12.552  -4.885 -11.992
  704    HD1  TRP  86           HD1      TRP  86 -14.233  -6.849  -9.437
  705    HE1  TRP  86           HE1      TRP  86 -13.206  -9.146  -9.121
  706    HE3  TRP  86           HE3      TRP  86  -9.877  -6.169 -12.070
  707    HZ2  TRP  86           HZ2      TRP  86 -10.709 -10.468  -9.687
  708    HZ3  TRP  86           HZ3      TRP  86  -8.194  -7.995 -12.175
  709    HH2  TRP  86           HH2      TRP  86  -8.585 -10.137 -10.975
  710    H    ASP  87           H        ASP  87 -12.967  -1.900  -9.473
  711    HA   ASP  87           HA       ASP  87 -13.020  -0.526 -11.992
  712    HB2  ASP  87           HB2      ASP  87 -14.854  -0.558 -10.325
  713    HB3  ASP  87           HB3      ASP  87 -13.847   0.379  -9.212
  714    H    THR  88           H        THR  88 -10.526  -0.620  -9.694
  715    HA   THR  88           HA       THR  88  -9.482   1.992 -10.585
  716    HB   THR  88           HB       THR  88 -10.586   2.051  -8.276
  717    HG1  THR  88           HG1      THR  88  -9.098   3.547  -7.646
  718   HG21  THR  88          HG21      THR  88  -9.406   1.253  -6.364
  719   HG22  THR  88          HG22      THR  88  -9.475  -0.118  -7.482
  720   HG23  THR  88          HG23      THR  88  -7.977   0.811  -7.330
  721    H    LYS  89           H        LYS  89  -7.099   2.157 -10.176
  722    HA   LYS  89           HA       LYS  89  -5.769  -0.422 -10.696
  723    HB2  LYS  89           HB2      LYS  89  -5.256   2.217 -12.118
  724    HB3  LYS  89           HB3      LYS  89  -4.412   0.704 -12.422
  725    HG2  LYS  89           HG2      LYS  89  -7.384   1.193 -12.900
  726    HG3  LYS  89           HG3      LYS  89  -6.126   1.290 -14.132
  727    HD2  LYS  89           HD2      LYS  89  -5.585  -1.104 -13.820
  728    HD3  LYS  89           HD3      LYS  89  -6.851  -1.243 -12.579
  729    HE2  LYS  89           HE2      LYS  89  -8.568  -0.578 -14.212
  730    HE3  LYS  89           HE3      LYS  89  -7.328  -0.336 -15.453
  731    HZ1  LYS  89           HZ1      LYS  89  -8.412  -2.468 -15.720
  732    HZ2  LYS  89           HZ2      LYS  89  -6.848  -2.725 -15.342
  733    HZ3  LYS  89           HZ3      LYS  89  -8.018  -2.942 -14.208
  734    HA   PRO  90           HA       PRO  90  -4.015  -1.429 -10.497
  735    HB2  PRO  90           HB2      PRO  90  -2.409  -2.702  -8.778
  736    HB3  PRO  90           HB3      PRO  90  -1.805  -1.562 -10.022
  737    HG2  PRO  90           HG2      PRO  90  -2.327  -0.984  -7.082
  738    HG3  PRO  90           HG3      PRO  90  -0.853  -0.599  -8.027
  739    HD2  PRO  90           HD2      PRO  90  -2.877   1.212  -7.591
  740    HD3  PRO  90           HD3      PRO  90  -1.928   1.200  -9.111
  741    H    VAL  91           H        VAL  91  -5.278  -3.224  -9.986
  742    HA   VAL  91           HA       VAL  91  -7.111  -3.022  -7.759
  743    HB   VAL  91           HB       VAL  91  -7.984  -3.759  -9.837
  744   HG11  VAL  91          HG11      VAL  91  -6.008  -4.510 -11.061
  745   HG12  VAL  91          HG12      VAL  91  -5.824  -5.902  -9.971
  746   HG13  VAL  91          HG13      VAL  91  -7.219  -5.787 -11.056
  747   HG21  VAL  91          HG21      VAL  91  -7.662  -6.327  -8.242
  748   HG22  VAL  91          HG22      VAL  91  -8.764  -5.002  -7.810
  749   HG23  VAL  91          HG23      VAL  91  -8.975  -5.878  -9.340
  750    H    CYS  92           H        CYS  92  -7.178  -4.264  -5.892
  751    HA   CYS  92           HA       CYS  92  -4.760  -5.823  -5.211
  752    HB2  CYS  92           HB2      CYS  92  -5.771  -5.717  -2.904
  753    HB3  CYS  92           HB3      CYS  92  -5.353  -4.148  -3.603
  754    HG   CYS  92           HG       CYS  92  -8.325  -5.575  -3.656
  755    H    ILE  93           H        ILE  93  -4.842  -8.063  -5.324
  756    HA   ILE  93           HA       ILE  93  -7.541  -9.305  -4.961
  757    HB   ILE  93           HB       ILE  93  -7.141 -11.017  -6.425
  758   HG12  ILE  93          HG12      ILE  93  -4.873 -11.679  -6.056
  759   HG13  ILE  93          HG13      ILE  93  -5.170 -11.436  -7.769
  760   HG21  ILE  93          HG21      ILE  93  -7.863  -8.929  -7.463
  761   HG22  ILE  93          HG22      ILE  93  -6.188  -8.503  -7.859
  762   HG23  ILE  93          HG23      ILE  93  -6.938  -9.939  -8.581
  763   HD11  ILE  93          HD11      ILE  93  -3.551  -9.683  -5.906
  764   HD12  ILE  93          HD12      ILE  93  -3.005 -10.576  -7.330
  765   HD13  ILE  93          HD13      ILE  93  -4.026  -9.152  -7.545
  766    H    GLY  94           H        GLY  94  -4.363  -9.099  -3.577
  767    HA2  GLY  94           HA2      GLY  94  -5.199 -10.682  -1.380
  768    HA3  GLY  94           HA3      GLY  94  -4.092 -11.621  -2.401
  769    H    GLN  95           H        GLN  95  -3.181 -11.194  -0.042
  770    HA   GLN  95           HA       GLN  95  -0.935  -9.346  -0.333
  771    HB2  GLN  95           HB2      GLN  95  -1.251  -8.312   1.869
  772    HB3  GLN  95           HB3      GLN  95  -2.556  -7.904   0.779
  773    HG2  GLN  95           HG2      GLN  95  -2.761  -9.983   2.991
  774    HG3  GLN  95           HG3      GLN  95  -3.255  -8.302   3.129
  775   HE21  GLN  95          HE22      GLN  95  -4.205 -11.463   2.001
  776   HE22  GLN  95          HE21      GLN  95  -5.737 -10.992   1.323
  777    H    LYS  96           H        LYS  96   0.872 -10.031   0.870
  778    HA   LYS  96           HA       LYS  96   0.629 -12.741   2.116
  779    HB2  LYS  96           HB2      LYS  96   3.066 -12.851   2.035
  780    HB3  LYS  96           HB3      LYS  96   2.374 -12.600   0.437
  781    HG2  LYS  96           HG2      LYS  96   2.947 -10.193   0.552
  782    HG3  LYS  96           HG3      LYS  96   3.692 -10.424   2.136
  783    HD2  LYS  96           HD2      LYS  96   4.589 -11.815  -0.427
  784    HD3  LYS  96           HD3      LYS  96   5.265 -10.303   0.174
  785    HE2  LYS  96           HE2      LYS  96   6.013 -11.438   2.270
  786    HE3  LYS  96           HE3      LYS  96   5.345 -12.965   1.678
  787    HZ1  LYS  96           HZ1      LYS  96   7.551 -11.451   0.364
  788    HZ2  LYS  96           HZ2      LYS  96   7.722 -12.817   1.241
  789    HZ3  LYS  96           HZ3      LYS  96   6.928 -12.865  -0.183
  790    H    GLN  97           H        GLN  97   0.823 -12.920   4.390
  791    HA   GLN  97           HA       GLN  97   1.252 -10.337   5.831
  792    HB2  GLN  97           HB2      GLN  97  -0.533 -12.615   6.722
  793    HB3  GLN  97           HB3      GLN  97  -0.241 -11.066   7.539
  794    HG2  GLN  97           HG2      GLN  97  -1.192  -9.967   5.397
  795    HG3  GLN  97           HG3      GLN  97  -1.780 -11.582   4.977
  796   HE21  GLN  97          HE22      GLN  97  -2.155  -8.812   7.160
  797   HE22  GLN  97          HE21      GLN  97  -3.638  -9.363   7.908
  798    H    LYS  98           H        LYS  98   2.889 -10.321   7.288
  799    HA   LYS  98           HA       LYS  98   3.845 -12.943   8.380
  800    HB2  LYS  98           HB2      LYS  98   5.558 -11.920   7.010
  801    HB3  LYS  98           HB3      LYS  98   5.404 -10.368   7.883
  802    HG2  LYS  98           HG2      LYS  98   6.393 -11.238   9.805
  803    HG3  LYS  98           HG3      LYS  98   6.203 -12.926   9.288
  804    HD2  LYS  98           HD2      LYS  98   7.927 -10.975   7.744
  805    HD3  LYS  98           HD3      LYS  98   8.567 -11.761   9.180
  806    HE2  LYS  98           HE2      LYS  98   7.312 -13.435   6.957
  807    HE3  LYS  98           HE3      LYS  98   8.933 -12.779   6.754
  808    HZ1  LYS  98           HZ1      LYS  98   9.063 -14.989   7.686
  809    HZ2  LYS  98           HZ2      LYS  98   9.649 -13.930   8.765
  810    HZ3  LYS  98           HZ3      LYS  98   8.168 -14.605   8.997
  811    H    TRP  99           H        TRP  99   3.828 -13.075  10.623
  812    HA   TRP  99           HA       TRP  99   2.518 -10.773  11.988
  813    HB2  TRP  99           HB2      TRP  99   2.020 -13.748  12.224
  814    HB3  TRP  99           HB3      TRP  99   1.372 -12.537  13.333
  815    HD1  TRP  99           HD1      TRP  99   0.938 -13.863   9.797
  816    HE1  TRP  99           HE1      TRP  99  -1.307 -13.032   8.862
  817    HE3  TRP  99           HE3      TRP  99  -0.287 -10.596  13.509
  818    HZ2  TRP  99           HZ2      TRP  99  -3.449 -11.337   9.739
  819    HZ3  TRP  99           HZ3      TRP  99  -2.433  -9.380  13.453
  820    HH2  TRP  99           HH2      TRP  99  -4.081  -9.843  11.634
  821    H    PHE 100           H        PHE 100   3.007 -10.470  14.190
  822    HA   PHE 100           HA       PHE 100   5.529 -11.730  15.178
  823    HB2  PHE 100           HB2      PHE 100   4.765  -8.777  15.038
  824    HB3  PHE 100           HB3      PHE 100   6.172  -9.421  15.872
  825    HD1  PHE 100           HD1      PHE 100   4.629  -8.873  12.494
  826    HD2  PHE 100           HD2      PHE 100   8.203  -9.902  14.709
  827    HE1  PHE 100           HE1      PHE 100   5.994  -8.644  10.440
  828    HE2  PHE 100           HE2      PHE 100   9.541  -9.690  12.646
  829    HZ   PHE 100           HZ       PHE 100   8.446  -9.080  10.513
  830    H    LEU 101           H        LEU 101   5.256 -12.399  17.306
  831    HA   LEU 101           HA       LEU 101   2.946 -11.321  18.870
  832    HB2  LEU 101           HB2      LEU 101   2.970 -13.684  19.085
  833    HB3  LEU 101           HB3      LEU 101   4.726 -13.729  19.244
  834    HG   LEU 101           HG       LEU 101   4.556 -12.662  21.471
  835   HD11  LEU 101          HD11      LEU 101   1.551 -13.001  21.229
  836   HD12  LEU 101          HD12      LEU 101   2.474 -12.451  22.659
  837   HD13  LEU 101          HD13      LEU 101   2.401 -11.436  21.226
  838   HD21  LEU 101          HD21      LEU 101   3.819 -14.595  22.691
  839   HD22  LEU 101          HD22      LEU 101   2.835 -15.166  21.329
  840   HD23  LEU 101          HD23      LEU 101   4.608 -15.170  21.216
  841    H    LEU 102           H        LEU 102   3.405  -9.671  20.187
  842    HA   LEU 102           HA       LEU 102   6.193  -9.430  21.193
  843    HB2  LEU 102           HB2      LEU 102   4.267  -7.102  21.122
  844    HB3  LEU 102           HB3      LEU 102   6.006  -7.060  21.270
  845    HG   LEU 102           HG       LEU 102   4.451  -7.731  18.748
  846   HD11  LEU 102          HD11      LEU 102   4.333  -5.315  19.479
  847   HD12  LEU 102          HD12      LEU 102   6.111  -5.248  19.351
  848   HD13  LEU 102          HD13      LEU 102   5.125  -5.571  17.910
  849   HD21  LEU 102          HD21      LEU 102   6.607  -8.872  18.748
  850   HD22  LEU 102          HD22      LEU 102   6.653  -7.517  17.640
  851   HD23  LEU 102          HD23      LEU 102   7.427  -7.355  19.230
  852    H    GLN 103           H        GLN 103   6.312  -8.984  23.515
  853    HA   GLN 103           HA       GLN 103   3.632  -9.198  24.853
  854    HB2  GLN 103           HB2      GLN 103   4.763 -10.858  25.697
  855    HB3  GLN 103           HB3      GLN 103   6.337 -10.038  25.759
  856    HG2  GLN 103           HG2      GLN 103   5.790  -9.004  27.822
  857    HG3  GLN 103           HG3      GLN 103   4.076  -8.879  27.432
  858   HE21  GLN 103          HE22      GLN 103   2.695 -10.856  27.479
  859   HE22  GLN 103          HE21      GLN 103   3.127 -12.109  28.628
  860    H    LEU 104           H        LEU 104   2.827  -7.325  25.645
  861    HA   LEU 104           HA       LEU 104   4.125  -4.797  25.350
  862    HB2  LEU 104           HB2      LEU 104   1.541  -5.892  26.126
  863    HB3  LEU 104           HB3      LEU 104   2.042  -4.800  27.399
  864    HG   LEU 104           HG       LEU 104   2.006  -4.084  24.445
  865   HD11  LEU 104          HD11      LEU 104  -0.090  -3.473  26.566
  866   HD12  LEU 104          HD12      LEU 104  -0.066  -2.869  24.890
  867   HD13  LEU 104          HD13      LEU 104  -0.267  -4.593  25.199
  868   HD21  LEU 104          HD21      LEU 104   2.549  -2.517  26.992
  869   HD22  LEU 104          HD22      LEU 104   3.489  -2.609  25.493
  870   HD23  LEU 104          HD23      LEU 104   1.963  -1.717  25.516
  871    H    VAL 105           H        VAL 105   5.423  -3.655  26.823
  872    HA   VAL 105           HA       VAL 105   6.693  -5.395  28.758
  873    HB   VAL 105           HB       VAL 105   7.309  -2.612  27.770
  874   HG11  VAL 105          HG11      VAL 105   9.045  -4.375  29.536
  875   HG12  VAL 105          HG12      VAL 105   9.564  -2.874  28.731
  876   HG13  VAL 105          HG13      VAL 105   8.321  -2.817  29.984
  877   HG21  VAL 105          HG21      VAL 105   8.923  -3.549  26.328
  878   HG22  VAL 105          HG22      VAL 105   8.924  -5.117  27.178
  879   HG23  VAL 105          HG23      VAL 105   7.557  -4.644  26.167
  880    H    SER 106           H        SER 106   4.850  -2.317  28.948
  881    HA   SER 106           HA       SER 106   4.805  -2.546  31.912
  882    HB2  SER 106           HB2      SER 106   3.808  -0.371  30.044
  883    HB3  SER 106           HB3      SER 106   3.806  -0.306  31.814
  884    HG   SER 106           HG       SER 106   5.960  -0.247  29.996
  885    H    GLY 107           H        GLY 107   2.775  -3.152  29.136
  886    HA2  GLY 107           HA2      GLY 107   0.914  -4.734  29.425
  887    HA3  GLY 107           HA3      GLY 107   0.535  -3.946  30.954
  888    H    ASP 108           H        ASP 108  -1.603  -3.901  29.809
  889    HA   ASP 108           HA       ASP 108  -2.225  -2.533  27.519
  890    HB2  ASP 108           HB2      ASP 108  -3.758  -4.022  28.469
  891    HB3  ASP 108           HB3      ASP 108  -3.724  -3.231  30.040
  892    H    ALA 109           H        ALA 109  -1.458  -1.175  30.633
  893    HA   ALA 109           HA       ALA 109  -2.636   1.358  30.505
  894    HB1  ALA 109           HB1      ALA 109   0.103   0.581  31.594
  895    HB2  ALA 109           HB2      ALA 109  -0.803   2.049  32.014
  896    HB3  ALA 109           HB3      ALA 109  -1.438   0.454  32.481
  897    H    GLU 110           H        GLU 110   0.177   0.170  28.701
  898    HA   GLU 110           HA       GLU 110   0.882   2.895  27.970
  899    HB2  GLU 110           HB2      GLU 110   2.349   0.278  27.872
  900    HB3  GLU 110           HB3      GLU 110   2.893   1.574  26.803
  901    HG2  GLU 110           HG2      GLU 110   2.552   1.871  29.802
  902    HG3  GLU 110           HG3      GLU 110   4.082   1.535  28.982
  903    H    ILE 111           H        ILE 111  -1.443   1.505  26.939
  904    HA   ILE 111           HA       ILE 111  -1.011   1.705  23.991
  905    HB   ILE 111           HB       ILE 111  -3.403   0.721  25.599
  906   HG12  ILE 111          HG12      ILE 111  -1.664  -0.910  23.677
  907   HG13  ILE 111          HG13      ILE 111  -1.345  -0.844  25.429
  908   HG21  ILE 111          HG21      ILE 111  -4.374   0.089  23.408
  909   HG22  ILE 111          HG22      ILE 111  -4.106   1.818  23.515
  910   HG23  ILE 111          HG23      ILE 111  -2.974   0.823  22.598
  911   HD11  ILE 111          HD11      ILE 111  -2.643  -2.839  24.940
  912   HD12  ILE 111          HD12      ILE 111  -3.663  -1.714  25.847
  913   HD13  ILE 111          HD13      ILE 111  -3.880  -1.896  24.108
  914    H    ASN 112           H        ASN 112  -1.929   3.385  22.842
  915    HA   ASN 112           HA       ASN 112  -3.641   5.377  24.264
  916    HB2  ASN 112           HB2      ASN 112  -1.519   6.513  23.893
  917    HB3  ASN 112           HB3      ASN 112  -1.466   5.945  22.215
  918   HD21  ASN 112          HD22      ASN 112  -1.169   8.485  22.045
  919   HD22  ASN 112          HD21      ASN 112  -2.660   9.365  21.796
  920    H    MET 113           H        MET 113  -5.640   5.165  23.382
  921    HA   MET 113           HA       MET 113  -5.872   3.620  20.886
  922    HB2  MET 113           HB2      MET 113  -7.954   4.414  22.939
  923    HB3  MET 113           HB3      MET 113  -8.224   3.296  21.606
  924    HG2  MET 113           HG2      MET 113  -5.976   2.715  23.502
  925    HG3  MET 113           HG3      MET 113  -7.610   2.498  24.083
  926    HE1  MET 113           HE1      MET 113  -5.904   0.000  20.550
  927    HE2  MET 113           HE2      MET 113  -6.522   1.633  20.300
  928    HE3  MET 113           HE3      MET 113  -5.038   1.395  21.249
  929    H    GLN 114           H        GLN 114  -5.358   6.758  21.253
  930    HA   GLN 114           HA       GLN 114  -7.186   7.724  19.205
  931    HB2  GLN 114           HB2      GLN 114  -7.014   8.952  21.979
  932    HB3  GLN 114           HB3      GLN 114  -7.866   9.604  20.565
  933    HG2  GLN 114           HG2      GLN 114  -9.338   7.486  20.621
  934    HG3  GLN 114           HG3      GLN 114  -8.547   7.047  22.120
  935   HE21  GLN 114          HE22      GLN 114 -10.240   9.949  20.666
  936   HE22  GLN 114          HE21      GLN 114 -11.084  10.366  22.135
  937    H    THR 115           H        THR 115  -5.047   7.391  18.380
  938    HA   THR 115           HA       THR 115  -2.624   8.529  19.224
  939    HB   THR 115           HB       THR 115  -2.255   8.173  16.625
  940    HG1  THR 115           HG1      THR 115  -3.786   6.863  15.693
  941   HG21  THR 115          HG21      THR 115  -3.000   5.907  18.562
  942   HG22  THR 115          HG22      THR 115  -2.098   5.688  17.036
  943   HG23  THR 115          HG23      THR 115  -1.382   6.631  18.359
  944    H    SER 116           H        SER 116  -4.683   9.492  16.553
  945    HA   SER 116           HA       SER 116  -3.614  12.250  16.532
  946    HB2  SER 116           HB2      SER 116  -5.049  10.581  14.434
  947    HB3  SER 116           HB3      SER 116  -4.599  12.283  14.218
  948    HG   SER 116           HG       SER 116  -3.006  10.837  13.392
  949    H    SER 117           H        SER 117  -5.378  13.954  15.774
  950    HA   SER 117           HA       SER 117  -7.414  14.209  17.706
  951    HB2  SER 117           HB2      SER 117  -7.430  15.330  14.868
  952    HB3  SER 117           HB3      SER 117  -8.225  16.012  16.298
  953    HG   SER 117           HG       SER 117  -6.229  17.073  15.812
  954    H    THR 118           H        THR 118  -7.360  12.665  14.506
  955    HA   THR 118           HA       THR 118 -10.078  11.573  14.760
  956    HB   THR 118           HB       THR 118  -8.834  10.262  12.750
  957    HG1  THR 118           HG1      THR 118  -7.740  11.782  11.476
  958   HG21  THR 118          HG21      THR 118 -10.493  12.782  12.606
  959   HG22  THR 118          HG22      THR 118 -10.202  11.648  11.251
  960   HG23  THR 118          HG23      THR 118 -11.055  11.086  12.698
  961    HA   PRO 119           HA       PRO 119  -7.748   8.361  17.023
  962    HB2  PRO 119           HB2      PRO 119  -9.841   6.629  17.493
  963    HB3  PRO 119           HB3      PRO 119  -9.480   8.068  18.507
  964    HG2  PRO 119           HG2      PRO 119 -11.521   7.810  16.297
  965    HG3  PRO 119           HG3      PRO 119 -11.705   8.567  17.913
  966    HD2  PRO 119           HD2      PRO 119 -11.197  10.016  15.637
  967    HD3  PRO 119           HD3      PRO 119 -10.551  10.516  17.229
  968    H    GLU 120           H        GLU 120  -6.627   6.911  15.790
  969    HA   GLU 120           HA       GLU 120  -7.630   5.867  13.229
  970    HB2  GLU 120           HB2      GLU 120  -5.160   5.293  14.922
  971    HB3  GLU 120           HB3      GLU 120  -5.472   4.495  13.388
  972    HG2  GLU 120           HG2      GLU 120  -5.299   7.520  13.601
  973    HG3  GLU 120           HG3      GLU 120  -3.899   6.486  13.333
  974    H    PHE 121           H        PHE 121  -9.409   5.284  15.536
  975    HA   PHE 121           HA       PHE 121  -9.252   2.364  15.751
  976    HB2  PHE 121           HB2      PHE 121  -7.759   3.814  17.414
  977    HB3  PHE 121           HB3      PHE 121  -9.305   4.265  18.120
  978    HD1  PHE 121           HD1      PHE 121  -7.346   1.310  16.919
  979    HD2  PHE 121           HD2      PHE 121 -10.057   2.924  19.870
  980    HE1  PHE 121           HE1      PHE 121  -7.187  -0.784  18.199
  981    HE2  PHE 121           HE2      PHE 121  -9.873   0.871  21.169
  982    HZ   PHE 121           HZ       PHE 121  -8.504  -1.077  20.261
  983    H    ASP 122           H        ASP 122 -11.226   1.495  16.783
  984    HA   ASP 122           HA       ASP 122 -13.278   3.381  17.628
  985    HB2  ASP 122           HB2      ASP 122 -13.592   3.060  15.129
  986    HB3  ASP 122           HB3      ASP 122 -13.978   1.381  15.462
  987    H    GLY 123           H        GLY 123 -11.522   0.993  18.663
  988    HA2  GLY 123           HA2      GLY 123 -12.878   0.484  20.907
  989    HA3  GLY 123           HA3      GLY 123 -13.707  -0.666  19.861
  990    H    TRP 124           H        TRP 124 -12.125  -1.238  22.293
  991    HA   TRP 124           HA       TRP 124 -10.176  -3.146  21.134
  992    HB2  TRP 124           HB2      TRP 124  -8.396  -2.324  22.110
  993    HB3  TRP 124           HB3      TRP 124  -9.298  -0.844  22.358
  994    HD1  TRP 124           HD1      TRP 124  -7.119  -3.023  24.089
  995    HE1  TRP 124           HE1      TRP 124  -7.074  -2.494  26.585
  996    HE3  TRP 124           HE3      TRP 124 -11.469  -0.337  24.425
  997    HZ2  TRP 124           HZ2      TRP 124  -8.871  -1.372  28.550
  998    HZ3  TRP 124           HZ3      TRP 124 -12.261   0.471  26.633
  999    HH2  TRP 124           HH2      TRP 124 -10.984  -0.044  28.700
 1000    H    ARG 125           H        ARG 125  -9.770  -5.011  22.399
 1001    HA   ARG 125           HA       ARG 125 -10.845  -5.265  25.043
 1002    HB2  ARG 125           HB2      ARG 125 -12.277  -7.237  24.655
 1003    HB3  ARG 125           HB3      ARG 125 -12.911  -5.771  23.933
 1004    HG2  ARG 125           HG2      ARG 125 -11.764  -6.653  21.719
 1005    HG3  ARG 125           HG3      ARG 125 -11.778  -8.206  22.546
 1006    HD2  ARG 125           HD2      ARG 125 -14.189  -6.399  22.066
 1007    HD3  ARG 125           HD3      ARG 125 -13.786  -7.808  21.089
 1008    HE   ARG 125           HE       ARG 125 -13.968  -8.683  23.770
 1009   HH11  ARG 125          HH11      ARG 125 -16.138  -7.318  21.307
 1010   HH12  ARG 125          HH12      ARG 125 -17.560  -8.063  21.943
 1011   HH21  ARG 125          HH21      ARG 125 -15.865  -9.690  24.617
 1012   HH22  ARG 125          HH22      ARG 125 -17.393  -9.441  23.860
 1013    H    TRP 126           H        TRP 126  -9.954  -7.144  26.116
 1014    HA   TRP 126           HA       TRP 126  -7.718  -8.473  24.639
 1015    HB2  TRP 126           HB2      TRP 126  -8.070  -7.731  27.560
 1016    HB3  TRP 126           HB3      TRP 126  -6.926  -8.947  27.025
 1017    HD1  TRP 126           HD1      TRP 126  -7.439  -5.116  26.889
 1018    HE1  TRP 126           HE1      TRP 126  -5.226  -4.024  26.686
 1019    HE3  TRP 126           HE3      TRP 126  -4.592  -9.291  25.948
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.463  -4.810  26.337
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.144  -9.065  25.742
 1022    HH2  TRP 126           HH2      TRP 126  -1.057  -6.828  26.032
 1023    H    VAL 127           H        VAL 127  -8.135 -10.616  24.205
 1024    HA   VAL 127           HA       VAL 127 -10.287 -12.027  25.730
 1025    HB   VAL 127           HB       VAL 127 -10.982 -12.876  23.388
 1026   HG11  VAL 127          HG11      VAL 127 -12.423 -11.471  24.779
 1027   HG12  VAL 127          HG12      VAL 127 -11.595 -10.006  24.207
 1028   HG13  VAL 127          HG13      VAL 127 -12.563 -10.986  23.084
 1029   HG21  VAL 127          HG21      VAL 127 -10.691 -11.404  21.493
 1030   HG22  VAL 127          HG22      VAL 127  -9.719 -10.276  22.453
 1031   HG23  VAL 127          HG23      VAL 127  -9.100 -11.904  22.097
 1032    H    SER 128           H        SER 128 -10.146 -14.351  25.690
 1033    HA   SER 128           HA       SER 128  -7.601 -15.519  25.640
 1034    HB2  SER 128           HB2      SER 128 -10.317 -16.787  25.102
 1035    HB3  SER 128           HB3      SER 128  -8.866 -17.622  25.716
 1036    HG   SER 128           HG       SER 128 -10.316 -17.039  27.424
 1037    H    TYR 129           H        TYR 129  -6.382 -16.579  24.043
 1038    HA   TYR 129           HA       TYR 129  -6.382 -15.529  21.548
 1039    HB2  TYR 129           HB2      TYR 129  -5.076 -17.862  21.013
 1040    HB3  TYR 129           HB3      TYR 129  -4.400 -16.456  21.777
 1041    HD1  TYR 129           HD1      TYR 129  -6.357 -19.503  22.844
 1042    HD2  TYR 129           HD2      TYR 129  -3.018 -16.873  23.625
 1043    HE1  TYR 129           HE1      TYR 129  -5.788 -20.839  24.848
 1044    HE2  TYR 129           HE2      TYR 129  -2.417 -18.252  25.593
 1045    HH   TYR 129           HH       TYR 129  -3.001 -20.062  26.985
 1046    H    TRP 130           H        TRP 130  -8.346 -18.458  22.275
 1047    HA   TRP 130           HA       TRP 130  -8.672 -18.897  19.398
 1048    HB2  TRP 130           HB2      TRP 130 -10.053 -20.279  21.710
 1049    HB3  TRP 130           HB3      TRP 130 -10.014 -20.809  20.032
 1050    HD1  TRP 130           HD1      TRP 130  -8.547 -21.796  23.075
 1051    HE1  TRP 130           HE1      TRP 130  -6.211 -22.817  22.869
 1052    HE3  TRP 130           HE3      TRP 130  -7.407 -20.337  18.269
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.071 -22.859  20.972
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.211 -20.927  17.295
 1055    HH2  TRP 130           HH2      TRP 130  -3.514 -22.137  18.649
 1056    H    TYR 131           H        TYR 131 -10.413 -17.040  21.805
 1057    HA   TYR 131           HA       TYR 131 -12.999 -17.208  20.607
 1058    HB2  TYR 131           HB2      TYR 131 -12.786 -16.532  22.854
 1059    HB3  TYR 131           HB3      TYR 131 -11.748 -15.165  22.445
 1060    HD1  TYR 131           HD1      TYR 131 -15.224 -16.504  22.242
 1061    HD2  TYR 131           HD2      TYR 131 -12.691 -13.063  21.641
 1062    HE1  TYR 131           HE1      TYR 131 -17.230 -15.073  21.988
 1063    HE2  TYR 131           HE2      TYR 131 -14.682 -11.622  21.409
 1064    HH   TYR 131           HH       TYR 131 -17.027 -11.531  21.376
 1065    HA   PRO 132           HA       PRO 132 -12.078 -13.069  18.356
 1066    HB2  PRO 132           HB2      PRO 132  -9.516 -12.654  17.381
 1067    HB3  PRO 132           HB3      PRO 132 -10.164 -12.002  18.926
 1068    HG2  PRO 132           HG2      PRO 132  -8.487 -14.475  18.515
 1069    HG3  PRO 132           HG3      PRO 132  -8.268 -13.157  19.717
 1070    HD2  PRO 132           HD2      PRO 132  -9.483 -15.427  20.371
 1071    HD3  PRO 132           HD3      PRO 132 -10.137 -13.888  20.983
 1072    H    VAL 133           H        VAL 133 -10.489 -16.103  17.549
 1073    HA   VAL 133           HA       VAL 133 -10.497 -15.854  14.698
 1074    HB   VAL 133           HB       VAL 133 -10.754 -18.412  16.340
 1075   HG11  VAL 133          HG11      VAL 133  -9.359 -17.915  13.670
 1076   HG12  VAL 133          HG12      VAL 133  -9.513 -19.466  14.522
 1077   HG13  VAL 133          HG13      VAL 133 -10.948 -18.686  13.872
 1078   HG21  VAL 133          HG21      VAL 133  -8.254 -18.533  16.360
 1079   HG22  VAL 133          HG22      VAL 133  -8.178 -16.882  15.699
 1080   HG23  VAL 133          HG23      VAL 133  -8.841 -17.184  17.318
 1081    H    ARG 134           H        ARG 134 -12.980 -16.692  17.129
 1082    HA   ARG 134           HA       ARG 134 -14.778 -18.077  15.405
 1083    HB2  ARG 134           HB2      ARG 134 -15.451 -16.328  17.802
 1084    HB3  ARG 134           HB3      ARG 134 -16.436 -17.632  17.140
 1085    HG2  ARG 134           HG2      ARG 134 -13.735 -18.054  18.472
 1086    HG3  ARG 134           HG3      ARG 134 -15.273 -18.133  19.315
 1087    HD2  ARG 134           HD2      ARG 134 -14.569 -19.839  16.918
 1088    HD3  ARG 134           HD3      ARG 134 -14.289 -20.320  18.618
 1089    HE   ARG 134           HE       ARG 134 -16.985 -19.572  18.425
 1090   HH11  ARG 134          HH11      ARG 134 -14.912 -22.159  17.131
 1091   HH12  ARG 134          HH12      ARG 134 -16.198 -23.296  16.959
 1092   HH21  ARG 134          HH21      ARG 134 -18.699 -21.091  18.192
 1093   HH22  ARG 134          HH22      ARG 134 -18.396 -22.679  17.593
 1094    H    GLN 135           H        GLN 135 -14.197 -14.584  15.909
 1095    HA   GLN 135           HA       GLN 135 -16.774 -13.844  14.807
 1096    HB2  GLN 135           HB2      GLN 135 -14.319 -12.330  15.721
 1097    HB3  GLN 135           HB3      GLN 135 -15.567 -11.498  14.811
 1098    HG2  GLN 135           HG2      GLN 135 -15.940 -11.223  17.200
 1099    HG3  GLN 135           HG3      GLN 135 -17.279 -12.079  16.430
 1100   HE21  GLN 135          HE22      GLN 135 -14.257 -12.621  18.318
 1101   HE22  GLN 135          HE21      GLN 135 -14.752 -14.143  19.019
 1102    H    VAL 136           H        VAL 136 -13.625 -14.406  13.287
 1103    HA   VAL 136           HA       VAL 136 -14.389 -12.849  10.933
 1104    HB   VAL 136           HB       VAL 136 -12.153 -13.648  10.125
 1105   HG11  VAL 136          HG11      VAL 136 -10.932 -12.030  11.498
 1106   HG12  VAL 136          HG12      VAL 136 -12.553 -11.416  11.145
 1107   HG13  VAL 136          HG13      VAL 136 -12.196 -12.095  12.742
 1108   HG21  VAL 136          HG21      VAL 136 -10.510 -14.509  11.609
 1109   HG22  VAL 136          HG22      VAL 136 -11.607 -14.467  12.997
 1110   HG23  VAL 136          HG23      VAL 136 -11.881 -15.624  11.674
 1111    H    VAL 137           H        VAL 137 -14.081 -13.926   8.717
 1112    HA   VAL 137           HA       VAL 137 -15.970 -16.173   8.617
 1113    HB   VAL 137           HB       VAL 137 -16.319 -15.590   6.372
 1114   HG11  VAL 137          HG11      VAL 137 -16.868 -13.271   6.332
 1115   HG12  VAL 137          HG12      VAL 137 -17.145 -13.863   7.978
 1116   HG13  VAL 137          HG13      VAL 137 -15.703 -12.881   7.607
 1117   HG21  VAL 137          HG21      VAL 137 -13.561 -14.326   6.465
 1118   HG22  VAL 137          HG22      VAL 137 -14.221 -15.560   5.372
 1119   HG23  VAL 137          HG23      VAL 137 -14.749 -13.880   5.200
 1120    H    SER 138           H        SER 138 -15.436 -17.766   6.626
 1121    HA   SER 138           HA       SER 138 -13.677 -19.588   7.624
 1122    HB2  SER 138           HB2      SER 138 -14.485 -19.284   4.710
 1123    HB3  SER 138           HB3      SER 138 -14.088 -20.798   5.560
 1124    HG   SER 138           HG       SER 138 -16.367 -20.456   5.410
 1125    H    PHE 139           H        PHE 139 -12.854 -17.376   4.831
 1126    HA   PHE 139           HA       PHE 139 -10.301 -18.674   4.513
 1127    HB2  PHE 139           HB2      PHE 139  -9.831 -17.006   2.835
 1128    HB3  PHE 139           HB3      PHE 139 -11.413 -17.716   2.626
 1129    HD1  PHE 139           HD2      PHE 139  -9.565 -14.622   3.495
 1130    HD2  PHE 139           HD1      PHE 139 -13.467 -16.346   2.815
 1131    HE1  PHE 139           HE2      PHE 139 -10.550 -12.354   3.297
 1132    HE2  PHE 139           HE1      PHE 139 -14.421 -14.076   2.571
 1133    HZ   PHE 139           HZ       PHE 139 -12.972 -12.076   2.831
 1134    H    LYS 140           H        LYS 140 -11.328 -15.734   6.231
 1135    HA   LYS 140           HA       LYS 140  -8.587 -14.981   6.961
 1136    HB2  LYS 140           HB2      LYS 140 -11.365 -14.065   7.752
 1137    HB3  LYS 140           HB3      LYS 140  -9.942 -13.544   8.686
 1138    HG2  LYS 140           HG2      LYS 140  -8.955 -12.423   6.874
 1139    HG3  LYS 140           HG3      LYS 140  -9.908 -13.275   5.669
 1140    HD2  LYS 140           HD2      LYS 140 -10.524 -10.860   6.018
 1141    HD3  LYS 140           HD3      LYS 140 -11.868 -12.012   6.119
 1142    HE2  LYS 140           HE2      LYS 140 -11.820 -11.964   8.564
 1143    HE3  LYS 140           HE3      LYS 140 -10.371 -10.951   8.557
 1144    HZ1  LYS 140           HZ1      LYS 140 -13.023 -10.066   7.498
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.345  -9.568   8.907
 1146    HZ3  LYS 140           HZ3      LYS 140 -11.655  -9.167   7.488
 1147    H    ARG 141           H        ARG 141 -11.293 -16.578   8.671
 1148    HA   ARG 141           HA       ARG 141 -10.171 -17.259  11.103
 1149    HB2  ARG 141           HB2      ARG 141 -11.754 -19.031   9.203
 1150    HB3  ARG 141           HB3      ARG 141 -11.148 -19.668  10.735
 1151    HG2  ARG 141           HG2      ARG 141 -12.347 -18.017  11.993
 1152    HG3  ARG 141           HG3      ARG 141 -12.963 -17.267  10.517
 1153    HD2  ARG 141           HD2      ARG 141 -14.140 -19.392   9.954
 1154    HD3  ARG 141           HD3      ARG 141 -13.525 -20.108  11.465
 1155    HE   ARG 141           HE       ARG 141 -14.950 -17.594  11.838
 1156   HH11  ARG 141          HH21      ARG 141 -15.592 -21.040  11.222
 1157   HH12  ARG 141          HH22      ARG 141 -17.106 -21.052  12.053
 1158   HH21  ARG 141          HH11      ARG 141 -16.849 -17.663  13.140
 1159   HH22  ARG 141          HH12      ARG 141 -17.878 -19.057  13.090
 1160    H    ASP 142           H        ASP 142  -9.285 -18.992   8.023
 1161    HA   ASP 142           HA       ASP 142  -7.583 -20.811   9.359
 1162    HB2  ASP 142           HB2      ASP 142  -8.277 -21.172   7.031
 1163    HB3  ASP 142           HB3      ASP 142  -7.271 -19.800   6.519
 1164    H    VAL 143           H        VAL 143  -6.846 -17.596   7.961
 1165    HA   VAL 143           HA       VAL 143  -4.046 -17.682   8.687
 1166    HB   VAL 143           HB       VAL 143  -5.987 -15.403   8.091
 1167   HG11  VAL 143          HG11      VAL 143  -3.957 -13.946   7.908
 1168   HG12  VAL 143          HG12      VAL 143  -4.333 -14.401   9.568
 1169   HG13  VAL 143          HG13      VAL 143  -3.013 -15.224   8.706
 1170   HG21  VAL 143          HG21      VAL 143  -4.656 -15.235   6.007
 1171   HG22  VAL 143          HG22      VAL 143  -3.718 -16.660   6.494
 1172   HG23  VAL 143          HG23      VAL 143  -5.456 -16.801   6.160
 1173    H    TYR 144           H        TYR 144  -6.979 -16.366  10.316
 1174    HA   TYR 144           HA       TYR 144  -5.507 -15.201  12.429
 1175    HB2  TYR 144           HB2      TYR 144  -8.427 -15.843  12.007
 1176    HB3  TYR 144           HB3      TYR 144  -7.863 -15.212  13.535
 1177    HD1  TYR 144           HD1      TYR 144  -6.857 -14.235   9.975
 1178    HD2  TYR 144           HD2      TYR 144  -8.619 -13.007  13.718
 1179    HE1  TYR 144           HE1      TYR 144  -7.015 -11.957   9.129
 1180    HE2  TYR 144           HE2      TYR 144  -8.817 -10.694  12.829
 1181    HH   TYR 144           HH       TYR 144  -7.816  -9.799   9.504
 1182    H    ARG 145           H        ARG 145  -6.861 -18.530  12.156
 1183    HA   ARG 145           HA       ARG 145  -6.139 -19.141  14.906
 1184    HB2  ARG 145           HB2      ARG 145  -6.794 -21.320  14.515
 1185    HB3  ARG 145           HB3      ARG 145  -7.797 -20.390  13.411
 1186    HG2  ARG 145           HG2      ARG 145  -5.795 -20.976  11.713
 1187    HG3  ARG 145           HG3      ARG 145  -5.554 -22.325  12.828
 1188    HD2  ARG 145           HD2      ARG 145  -7.983 -22.905  12.461
 1189    HD3  ARG 145           HD3      ARG 145  -8.085 -21.517  11.369
 1190    HE   ARG 145           HE       ARG 145  -6.676 -22.588   9.770
 1191   HH11  ARG 145          HH11      ARG 145  -7.384 -24.854  12.451
 1192   HH12  ARG 145          HH12      ARG 145  -6.985 -26.239  11.498
 1193   HH21  ARG 145          HH21      ARG 145  -6.227 -24.284   8.599
 1194   HH22  ARG 145          HH22      ARG 145  -6.284 -25.932   9.209
 1195    H    ARG 146           H        ARG 146  -4.343 -19.465  11.747
 1196    HA   ARG 146           HA       ARG 146  -2.039 -20.640  12.940
 1197    HB2  ARG 146           HB2      ARG 146  -2.612 -19.146  10.350
 1198    HB3  ARG 146           HB3      ARG 146  -0.942 -19.308  10.889
 1199    HG2  ARG 146           HG2      ARG 146  -1.139 -21.140   9.556
 1200    HG3  ARG 146           HG3      ARG 146  -1.394 -21.808  11.167
 1201    HD2  ARG 146           HD2      ARG 146  -3.887 -21.736  10.680
 1202    HD3  ARG 146           HD3      ARG 146  -3.483 -21.267   9.019
 1203    HE   ARG 146           HE       ARG 146  -2.688 -23.812  10.397
 1204   HH11  ARG 146          HH11      ARG 146  -3.842 -22.330   7.341
 1205   HH12  ARG 146          HH12      ARG 146  -3.176 -23.582   6.363
 1206   HH21  ARG 146          HH21      ARG 146  -2.040 -25.561   9.072
 1207   HH22  ARG 146          HH22      ARG 146  -2.304 -25.519   7.370
 1208    H    VAL 147           H        VAL 147  -2.911 -17.168  12.524
 1209    HA   VAL 147           HA       VAL 147  -0.576 -16.056  13.556
 1210    HB   VAL 147           HB       VAL 147  -3.471 -15.111  13.713
 1211   HG11  VAL 147          HG11      VAL 147  -2.562 -12.800  13.912
 1212   HG12  VAL 147          HG12      VAL 147  -2.223 -13.774  15.335
 1213   HG13  VAL 147          HG13      VAL 147  -0.932 -13.478  14.152
 1214   HG21  VAL 147          HG21      VAL 147  -1.185 -14.411  11.833
 1215   HG22  VAL 147          HG22      VAL 147  -2.565 -15.400  11.407
 1216   HG23  VAL 147          HG23      VAL 147  -2.840 -13.717  11.788
 1217    H    MET 148           H        MET 148  -2.980 -17.868  15.310
 1218    HA   MET 148           HA       MET 148  -2.001 -16.879  17.890
 1219    HB2  MET 148           HB2      MET 148  -4.282 -18.796  17.375
 1220    HB3  MET 148           HB3      MET 148  -3.789 -18.129  18.948
 1221    HG2  MET 148           HG2      MET 148  -4.758 -16.403  16.650
 1222    HG3  MET 148           HG3      MET 148  -5.813 -17.121  17.853
 1223    HE1  MET 148           HE1      MET 148  -2.459 -14.698  17.784
 1224    HE2  MET 148           HE2      MET 148  -3.867 -14.265  16.777
 1225    HE3  MET 148           HE3      MET 148  -3.476 -13.301  18.207
 1226    H    LYS 149           H        LYS 149  -2.556 -20.020  16.187
 1227    HA   LYS 149           HA       LYS 149  -1.173 -21.631  18.010
 1228    HB2  LYS 149           HB2      LYS 149  -2.695 -22.497  16.508
 1229    HB3  LYS 149           HB3      LYS 149  -1.852 -21.899  15.081
 1230    HG2  LYS 149           HG2      LYS 149  -0.752 -24.088  16.900
 1231    HG3  LYS 149           HG3      LYS 149  -1.799 -24.379  15.515
 1232    HD2  LYS 149           HD2      LYS 149  -0.007 -22.986  14.168
 1233    HD3  LYS 149           HD3      LYS 149   1.069 -23.409  15.503
 1234    HE2  LYS 149           HE2      LYS 149  -0.507 -25.384  13.794
 1235    HE3  LYS 149           HE3      LYS 149   1.180 -24.939  13.529
 1236    HZ1  LYS 149           HZ1      LYS 149   1.708 -25.886  15.725
 1237    HZ2  LYS 149           HZ2      LYS 149   0.143 -26.324  15.954
 1238    HZ3  LYS 149           HZ3      LYS 149   1.016 -27.007  14.765
 1239    H    GLU 150           H        GLU 150   0.280 -19.808  15.219
 1240    HA   GLU 150           HA       GLU 150   2.733 -21.019  15.240
 1241    HB2  GLU 150           HB2      GLU 150   1.713 -19.369  13.590
 1242    HB3  GLU 150           HB3      GLU 150   2.054 -18.095  14.751
 1243    HG2  GLU 150           HG2      GLU 150   3.916 -17.971  13.486
 1244    HG3  GLU 150           HG3      GLU 150   4.509 -19.123  14.653
 1245    H    PHE 151           H        PHE 151   1.443 -18.501  17.385
 1246    HA   PHE 151           HA       PHE 151   4.046 -18.319  18.842
 1247    HB2  PHE 151           HB2      PHE 151   1.740 -16.414  19.140
 1248    HB3  PHE 151           HB3      PHE 151   3.456 -16.206  19.506
 1249    HD1  PHE 151           HD1      PHE 151   4.864 -16.979  17.017
 1250    HD2  PHE 151           HD2      PHE 151   1.193 -14.736  17.579
 1251    HE1  PHE 151           HE1      PHE 151   5.040 -16.063  14.778
 1252    HE2  PHE 151           HE2      PHE 151   1.524 -13.671  15.388
 1253    HZ   PHE 151           HZ       PHE 151   3.467 -14.323  13.976
 1254    H    ALA 152           H        ALA 152   0.923 -19.719  19.156
 1255    HA   ALA 152           HA       ALA 152   0.239 -19.364  21.807
 1256    HB1  ALA 152           HB1      ALA 152  -1.172 -20.530  20.112
 1257    HB2  ALA 152           HB2      ALA 152  -0.028 -21.886  20.087
 1258    HB3  ALA 152           HB3      ALA 152  -0.964 -21.538  21.556
 1259    H    SER 153           H        SER 153   2.584 -21.644  20.434
 1260    HA   SER 153           HA       SER 153   3.057 -23.134  22.813
 1261    HB2  SER 153           HB2      SER 153   4.954 -22.669  20.475
 1262    HB3  SER 153           HB3      SER 153   4.938 -24.058  21.582
 1263    HG   SER 153           HG       SER 153   3.881 -24.571  19.613
 1264    H    VAL 154           H        VAL 154   4.347 -20.044  21.615
 1265    HA   VAL 154           HA       VAL 154   6.454 -19.905  23.651
 1266    HB   VAL 154           HB       VAL 154   5.248 -17.720  21.904
 1267   HG11  VAL 154          HG11      VAL 154   7.244 -16.419  22.503
 1268   HG12  VAL 154          HG12      VAL 154   6.304 -16.798  23.962
 1269   HG13  VAL 154          HG13      VAL 154   7.786 -17.711  23.590
 1270   HG21  VAL 154          HG21      VAL 154   7.410 -17.952  20.616
 1271   HG22  VAL 154          HG22      VAL 154   7.779 -19.396  21.572
 1272   HG23  VAL 154          HG23      VAL 154   6.371 -19.370  20.486
 1273    H    VAL 155           H        VAL 155   3.124 -18.682  23.126
 1274    HA   VAL 155           HA       VAL 155   3.024 -17.118  25.437
 1275    HB   VAL 155           HB       VAL 155   0.707 -18.537  24.079
 1276   HG11  VAL 155          HG11      VAL 155   0.000 -17.912  26.329
 1277   HG12  VAL 155          HG12      VAL 155   0.797 -16.326  26.189
 1278   HG13  VAL 155          HG13      VAL 155  -0.657 -16.722  25.196
 1279   HG21  VAL 155          HG21      VAL 155   1.769 -15.666  23.906
 1280   HG22  VAL 155          HG22      VAL 155   1.901 -16.893  22.626
 1281   HG23  VAL 155          HG23      VAL 155   0.315 -16.286  23.087
 1282    H    MET 156           H        MET 156   2.229 -20.678  25.212
 1283    HA   MET 156           HA       MET 156   1.244 -20.917  27.774
 1284    HB2  MET 156           HB2      MET 156   3.192 -22.837  26.375
 1285    HB3  MET 156           HB3      MET 156   2.136 -23.278  27.726
 1286    HG2  MET 156           HG2      MET 156   1.316 -22.581  24.907
 1287    HG3  MET 156           HG3      MET 156   1.136 -24.121  25.709
 1288    HE1  MET 156           HE1      MET 156  -2.402 -22.143  24.851
 1289    HE2  MET 156           HE2      MET 156  -0.867 -21.502  24.233
 1290    HE3  MET 156           HE3      MET 156  -1.210 -23.252  24.139
 1291    H    SER 157           H        SER 157   4.608 -21.165  26.720
 1292    HA   SER 157           HA       SER 157   5.679 -21.500  29.341
 1293    HB2  SER 157           HB2      SER 157   6.676 -21.043  26.526
 1294    HB3  SER 157           HB3      SER 157   7.846 -21.129  27.891
 1295    HG   SER 157           HG       SER 157   7.486 -23.189  26.901
 1296    H    LEU 158           H        LEU 158   4.994 -18.696  27.342
 1297    HA   LEU 158           HA       LEU 158   6.455 -16.744  28.793
 1298    HB2  LEU 158           HB2      LEU 158   5.298 -16.517  26.496
 1299    HB3  LEU 158           HB3      LEU 158   3.753 -16.488  27.359
 1300    HG   LEU 158           HG       LEU 158   4.534 -14.423  28.576
 1301   HD11  LEU 158          HD11      LEU 158   6.361 -13.160  27.477
 1302   HD12  LEU 158          HD12      LEU 158   6.944 -14.681  28.155
 1303   HD13  LEU 158          HD13      LEU 158   6.686 -14.560  26.410
 1304   HD21  LEU 158          HD21      LEU 158   4.074 -14.606  25.572
 1305   HD22  LEU 158          HD22      LEU 158   2.881 -14.373  26.874
 1306   HD23  LEU 158          HD23      LEU 158   4.020 -13.064  26.446
 1307    H    GLN 159           H        GLN 159   3.144 -18.038  29.153
 1308    HA   GLN 159           HA       GLN 159   2.454 -16.504  31.473
 1309    HB2  GLN 159           HB2      GLN 159   1.502 -19.360  30.946
 1310    HB3  GLN 159           HB3      GLN 159   0.770 -18.147  31.979
 1311    HG2  GLN 159           HG2      GLN 159   0.404 -16.756  29.805
 1312    HG3  GLN 159           HG3      GLN 159   0.825 -18.257  28.960
 1313   HE21  GLN 159          HE22      GLN 159  -1.362 -17.373  31.724
 1314   HE22  GLN 159          HE21      GLN 159  -2.666 -18.425  31.181
 1315    H    GLU 160           H        GLU 160   4.074 -19.670  31.158
 1316    HA   GLU 160           HA       GLU 160   4.076 -20.223  33.914
 1317    HB2  GLU 160           HB2      GLU 160   5.741 -21.329  31.622
 1318    HB3  GLU 160           HB3      GLU 160   5.874 -21.936  33.274
 1319    HG2  GLU 160           HG2      GLU 160   3.457 -22.428  33.320
 1320    HG3  GLU 160           HG3      GLU 160   3.307 -21.858  31.662
 1321    H    ASN 161           H        ASN 161   6.416 -18.482  31.919
 1322    HA   ASN 161           HA       ASN 161   8.449 -18.545  34.086
 1323    HB2  ASN 161           HB2      ASN 161   8.488 -17.630  31.187
 1324    HB3  ASN 161           HB3      ASN 161   9.775 -17.233  32.334
 1325   HD21  ASN 161          HD22      ASN 161   8.095 -19.969  30.765
 1326   HD22  ASN 161          HD21      ASN 161   9.390 -21.132  31.020
 1327    H    THR 162           H        THR 162   6.064 -16.428  32.586
 1328    HA   THR 162           HA       THR 162   5.761 -14.214  32.548
 1329    HB   THR 162           HB       THR 162   4.446 -14.852  34.360
 1330    HG1  THR 162           HG1      THR 162   5.799 -12.514  35.186
 1331   HG21  THR 162          HG21      THR 162   5.068 -14.729  36.734
 1332   HG22  THR 162          HG22      THR 162   5.850 -16.047  35.862
 1333   HG23  THR 162          HG23      THR 162   6.780 -14.586  36.270
 1334    HA   PRO 163           HA       PRO 163  10.248 -13.843  32.785
 1335    HB2  PRO 163           HB2      PRO 163  10.062 -12.588  30.064
 1336    HB3  PRO 163           HB3      PRO 163  11.208 -13.817  30.687
 1337    HG2  PRO 163           HG2      PRO 163   9.115 -14.540  29.092
 1338    HG3  PRO 163           HG3      PRO 163   9.570 -15.540  30.508
 1339    HD2  PRO 163           HD2      PRO 163   7.418 -13.386  30.369
 1340    HD3  PRO 163           HD3      PRO 163   7.268 -15.070  30.943
 1341    H    LYS 164           H        LYS 164  11.822 -11.949  32.512
 1342    HA   LYS 164           HA       LYS 164  10.504  -9.598  33.684
 1343    HB2  LYS 164           HB2      LYS 164  13.478 -10.223  33.639
 1344    HB3  LYS 164           HB3      LYS 164  12.618  -9.125  34.707
 1345    HG2  LYS 164           HG2      LYS 164  12.401 -12.177  34.673
 1346    HG3  LYS 164           HG3      LYS 164  13.308 -11.205  35.838
 1347    HD2  LYS 164           HD2      LYS 164  11.211 -10.205  36.696
 1348    HD3  LYS 164           HD3      LYS 164  10.278 -11.051  35.463
 1349    HE2  LYS 164           HE2      LYS 164  10.000 -12.270  37.480
 1350    HE3  LYS 164           HE3      LYS 164  10.992 -13.243  36.390
 1351    HZ1  LYS 164           HZ1      LYS 164  11.827 -13.239  38.675
 1352    HZ2  LYS 164           HZ2      LYS 164  12.943 -12.582  37.686
 1353    HZ3  LYS 164           HZ3      LYS 164  12.033 -11.620  38.655
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1  -0.230   0.917  -0.145
    2    H2   MET   1           H2       MET   1   0.722  -0.024   0.797
    3    H3   MET   1           H3       MET   1   1.164   1.522   0.457
    4    HA   MET   1           HA       MET   1   1.423   1.007  -1.881
    5    HB2  MET   1           HB2      MET   1   3.414   0.752  -0.312
    6    HB3  MET   1           HB3      MET   1   3.046  -0.955  -0.162
    7    HG2  MET   1           HG2      MET   1   3.253  -1.096  -2.758
    8    HG3  MET   1           HG3      MET   1   3.836   0.562  -2.693
    9    HE1  MET   1           HE1      MET   1   4.512  -3.110  -2.624
   10    HE2  MET   1           HE2      MET   1   6.039  -3.329  -1.728
   11    HE3  MET   1           HE3      MET   1   4.543  -2.942  -0.847
   12    H    ILE   2           H        ILE   2   0.901  -0.325  -3.635
   13    HA   ILE   2           HA       ILE   2   0.262  -3.206  -3.174
   14    HB   ILE   2           HB       ILE   2  -1.256  -1.457  -5.120
   15   HG12  ILE   2          HG12      ILE   2  -1.846  -2.241  -2.285
   16   HG13  ILE   2          HG13      ILE   2  -2.258  -0.762  -3.170
   17   HG21  ILE   2          HG21      ILE   2  -1.580  -4.389  -4.275
   18   HG22  ILE   2          HG22      ILE   2  -2.523  -3.542  -5.534
   19   HG23  ILE   2          HG23      ILE   2  -0.834  -3.856  -5.776
   20   HD11  ILE   2          HD11      ILE   2  -3.545  -3.470  -3.225
   21   HD12  ILE   2          HD12      ILE   2  -4.285  -1.958  -2.686
   22   HD13  ILE   2          HD13      ILE   2  -3.991  -2.221  -4.430
   23    H    ASP   3           H        ASP   3   1.557  -4.421  -4.420
   24    HA   ASP   3           HA       ASP   3   3.549  -3.151  -6.121
   25    HB2  ASP   3           HB2      ASP   3   3.819  -5.369  -4.850
   26    HB3  ASP   3           HB3      ASP   3   2.738  -6.032  -6.137
   27    H    ASP   4           H        ASP   4   3.563  -3.259  -8.261
   28    HA   ASP   4           HA       ASP   4   1.246  -3.077  -9.718
   29    HB2  ASP   4           HB2      ASP   4   3.431  -2.212 -10.484
   30    HB3  ASP   4           HB3      ASP   4   4.017  -3.866 -10.697
   31    H    ASP   5           H        ASP   5   2.878  -6.087  -8.929
   32    HA   ASP   5           HA       ASP   5   1.488  -7.648 -10.903
   33    HB2  ASP   5           HB2      ASP   5   3.687  -8.246  -9.839
   34    HB3  ASP   5           HB3      ASP   5   2.799  -8.627  -8.358
   35    H    GLY   6           H        GLY   6   0.203  -6.045  -8.305
   36    HA2  GLY   6           HA2      GLY   6  -1.914  -6.048  -7.481
   37    HA3  GLY   6           HA3      GLY   6  -2.304  -7.543  -8.367
   38    H    TYR   7           H        TYR   7   0.459  -7.320  -6.201
   39    HA   TYR   7           HA       TYR   7  -1.052  -8.621  -4.000
   40    HB2  TYR   7           HB2      TYR   7   1.740  -9.328  -4.968
   41    HB3  TYR   7           HB3      TYR   7   1.105  -9.786  -3.393
   42    HD1  TYR   7           HD1      TYR   7  -1.102 -11.130  -3.287
   43    HD2  TYR   7           HD2      TYR   7   1.266 -10.712  -6.867
   44    HE1  TYR   7           HE1      TYR   7  -2.234 -13.109  -4.267
   45    HE2  TYR   7           HE2      TYR   7   0.176 -12.707  -7.832
   46    HH   TYR   7           HH       TYR   7  -1.420 -14.395  -7.536
   47    H    ARG   8           H        ARG   8  -0.010  -8.081  -1.865
   48    HA   ARG   8           HA       ARG   8   1.573  -5.596  -1.899
   49    HB2  ARG   8           HB2      ARG   8  -0.036  -4.372  -0.482
   50    HB3  ARG   8           HB3      ARG   8  -0.735  -4.745  -2.062
   51    HG2  ARG   8           HG2      ARG   8  -1.786  -6.799  -0.944
   52    HG3  ARG   8           HG3      ARG   8  -1.416  -6.015   0.608
   53    HD2  ARG   8           HD2      ARG   8  -2.837  -4.641  -1.676
   54    HD3  ARG   8           HD3      ARG   8  -3.719  -5.654  -0.469
   55    HE   ARG   8           HE       ARG   8  -2.021  -3.588   0.718
   56   HH11  ARG   8          HH11      ARG   8  -5.251  -4.078  -0.718
   57   HH12  ARG   8          HH12      ARG   8  -5.966  -2.758   0.131
   58   HH21  ARG   8          HH21      ARG   8  -3.005  -1.851   1.863
   59   HH22  ARG   8          HH22      ARG   8  -4.666  -1.472   1.614
   60    HA   PRO   9           HA       PRO   9   2.913  -8.151   1.524
   61    HB2  PRO   9           HB2      PRO   9   5.170  -6.839   2.288
   62    HB3  PRO   9           HB3      PRO   9   5.030  -7.684   0.731
   63    HG2  PRO   9           HG2      PRO   9   4.785  -4.717   1.257
   64    HG3  PRO   9           HG3      PRO   9   5.647  -5.555  -0.058
   65    HD2  PRO   9           HD2      PRO   9   3.094  -4.468  -0.214
   66    HD3  PRO   9           HD3      PRO   9   3.721  -5.759  -1.283
   67    H    ASN  10           H        ASN  10   2.259  -8.239   3.703
   68    HA   ASN  10           HA       ASN  10   1.503  -5.700   5.066
   69    HB2  ASN  10           HB2      ASN  10  -0.443  -6.559   3.792
   70    HB3  ASN  10           HB3      ASN  10  -0.239  -8.139   4.520
   71   HD21  ASN  10          HD22      ASN  10  -1.751  -5.023   4.928
   72   HD22  ASN  10          HD21      ASN  10  -2.422  -5.377   6.499
   73    H    VAL  11           H        VAL  11   1.253  -5.952   7.384
   74    HA   VAL  11           HA       VAL  11   2.402  -8.407   8.512
   75    HB   VAL  11           HB       VAL  11   3.840  -7.069  10.044
   76   HG11  VAL  11          HG11      VAL  11   4.469  -7.381   7.211
   77   HG12  VAL  11          HG12      VAL  11   5.572  -6.433   8.246
   78   HG13  VAL  11          HG13      VAL  11   5.152  -8.088   8.680
   79   HG21  VAL  11          HG21      VAL  11   2.770  -4.828   9.777
   80   HG22  VAL  11          HG22      VAL  11   4.500  -4.799   9.430
   81   HG23  VAL  11          HG23      VAL  11   3.346  -4.762   8.092
   82    H    GLY  12           H        GLY  12   1.871  -8.678  10.756
   83    HA2  GLY  12           HA2      GLY  12  -0.275  -6.917  11.787
   84    HA3  GLY  12           HA3      GLY  12  -0.602  -8.625  11.562
   85    H    ILE  13           H        ILE  13  -0.653  -7.199  14.078
   86    HA   ILE  13           HA       ILE  13   1.630  -8.423  15.474
   87    HB   ILE  13           HB       ILE  13   0.328  -5.781  16.269
   88   HG12  ILE  13          HG12      ILE  13   2.798  -4.994  15.501
   89   HG13  ILE  13          HG13      ILE  13   2.582  -6.288  14.329
   90   HG21  ILE  13          HG21      ILE  13   1.406  -7.006  18.047
   91   HG22  ILE  13          HG22      ILE  13   2.827  -7.344  17.020
   92   HG23  ILE  13          HG23      ILE  13   2.502  -5.711  17.601
   93   HD11  ILE  13          HD11      ILE  13   1.965  -4.116  13.403
   94   HD12  ILE  13          HD12      ILE  13   0.509  -5.127  13.502
   95   HD13  ILE  13          HD13      ILE  13   0.792  -3.848  14.709
   96    H    VAL  14           H        VAL  14   1.160  -9.421  17.358
   97    HA   VAL  14           HA       VAL  14  -1.642  -9.412  18.379
   98    HB   VAL  14           HB       VAL  14   0.319 -11.729  18.634
   99   HG11  VAL  14          HG11      VAL  14  -1.598 -11.645  20.214
  100   HG12  VAL  14          HG12      VAL  14  -2.720 -11.623  18.827
  101   HG13  VAL  14          HG13      VAL  14  -1.680 -13.035  19.128
  102   HG21  VAL  14          HG21      VAL  14  -1.752 -11.448  16.426
  103   HG22  VAL  14          HG22      VAL  14   0.018 -11.525  16.217
  104   HG23  VAL  14          HG23      VAL  14  -0.836 -12.920  16.854
  105    H    ILE  15           H        ILE  15  -1.646  -8.974  20.675
  106    HA   ILE  15           HA       ILE  15   1.021  -8.934  21.954
  107    HB   ILE  15           HB       ILE  15  -1.184  -7.043  22.788
  108   HG12  ILE  15          HG12      ILE  15  -0.378  -6.339  20.534
  109   HG13  ILE  15          HG13      ILE  15  -0.010  -5.195  21.817
  110   HG21  ILE  15          HG21      ILE  15   0.355  -7.636  24.580
  111   HG22  ILE  15          HG22      ILE  15   1.751  -7.267  23.557
  112   HG23  ILE  15          HG23      ILE  15   0.640  -5.980  24.052
  113   HD11  ILE  15          HD11      ILE  15   1.854  -5.477  20.214
  114   HD12  ILE  15          HD12      ILE  15   2.321  -5.882  21.878
  115   HD13  ILE  15          HD13      ILE  15   2.003  -7.180  20.702
  116    H    CYS  16           H        CYS  16   1.147 -10.019  23.929
  117    HA   CYS  16           HA       CYS  16  -1.393 -11.227  24.943
  118    HB2  CYS  16           HB2      CYS  16  -0.005 -13.181  25.665
  119    HB3  CYS  16           HB3      CYS  16  -0.023 -12.968  23.904
  120    HG   CYS  16           HG       CYS  16   2.402 -13.673  24.664
  121    H    ASN  17           H        ASN  17  -1.474 -11.654  27.199
  122    HA   ASN  17           HA       ASN  17   0.480 -10.167  28.871
  123    HB2  ASN  17           HB2      ASN  17  -1.209  -9.483  30.393
  124    HB3  ASN  17           HB3      ASN  17  -1.723  -8.998  28.789
  125   HD21  ASN  17          HD22      ASN  17  -3.807  -8.823  30.226
  126   HD22  ASN  17          HD21      ASN  17  -4.815 -10.255  30.277
  127    H    ARG  18           H        ARG  18   0.483 -11.271  31.229
  128    HA   ARG  18           HA       ARG  18   1.025 -14.084  30.681
  129    HB2  ARG  18           HB2      ARG  18   1.205 -12.487  33.281
  130    HB3  ARG  18           HB3      ARG  18   1.580 -14.201  33.151
  131    HG2  ARG  18           HG2      ARG  18   3.661 -13.617  32.664
  132    HG3  ARG  18           HG3      ARG  18   3.042 -13.272  31.047
  133    HD2  ARG  18           HD2      ARG  18   2.661 -10.913  31.740
  134    HD3  ARG  18           HD3      ARG  18   3.364 -11.266  33.323
  135    HE   ARG  18           HE       ARG  18   4.748 -11.397  30.662
  136   HH11  ARG  18          HH11      ARG  18   5.125 -10.837  34.160
  137   HH12  ARG  18          HH12      ARG  18   6.833 -10.608  34.043
  138   HH21  ARG  18          HH21      ARG  18   6.897 -11.020  30.504
  139   HH22  ARG  18          HH22      ARG  18   7.904 -10.833  31.911
  140    H    GLN  19           H        GLN  19  -1.881 -12.637  31.185
  141    HA   GLN  19           HA       GLN  19  -3.052 -14.749  32.834
  142    HB2  GLN  19           HB2      GLN  19  -4.652 -12.672  31.334
  143    HB3  GLN  19           HB3      GLN  19  -5.078 -13.520  32.810
  144    HG2  GLN  19           HG2      GLN  19  -3.041 -11.293  32.453
  145    HG3  GLN  19           HG3      GLN  19  -4.614 -11.157  33.213
  146   HE21  GLN  19          HE22      GLN  19  -2.164 -10.375  34.528
  147   HE22  GLN  19          HE21      GLN  19  -1.928 -11.439  35.892
  148    H    GLY  20           H        GLY  20  -2.171 -14.383  29.538
  149    HA2  GLY  20           HA2      GLY  20  -2.617 -15.796  27.760
  150    HA3  GLY  20           HA3      GLY  20  -3.789 -16.699  28.740
  151    H    GLN  21           H        GLN  21  -3.775 -13.103  28.272
  152    HA   GLN  21           HA       GLN  21  -6.222 -13.409  26.595
  153    HB2  GLN  21           HB2      GLN  21  -5.338 -10.985  28.187
  154    HB3  GLN  21           HB3      GLN  21  -6.801 -11.121  27.227
  155    HG2  GLN  21           HG2      GLN  21  -7.669 -12.881  28.737
  156    HG3  GLN  21           HG3      GLN  21  -6.184 -12.796  29.696
  157   HE21  GLN  21          HE22      GLN  21  -9.346 -11.361  29.283
  158   HE22  GLN  21          HE21      GLN  21  -9.101 -10.058  30.418
  159    H    VAL  22           H        VAL  22  -6.286 -12.017  24.716
  160    HA   VAL  22           HA       VAL  22  -3.660 -10.934  23.897
  161    HB   VAL  22           HB       VAL  22  -4.173 -11.430  21.556
  162   HG11  VAL  22          HG11      VAL  22  -3.765 -13.899  21.653
  163   HG12  VAL  22          HG12      VAL  22  -2.751 -12.972  22.777
  164   HG13  VAL  22          HG13      VAL  22  -4.161 -13.842  23.396
  165   HG21  VAL  22          HG21      VAL  22  -6.564 -11.500  21.461
  166   HG22  VAL  22          HG22      VAL  22  -5.962 -13.100  20.994
  167   HG23  VAL  22          HG23      VAL  22  -6.664 -12.860  22.612
  168    H    MET  23           H        MET  23  -3.679  -9.052  22.720
  169    HA   MET  23           HA       MET  23  -5.782  -7.116  23.224
  170    HB2  MET  23           HB2      MET  23  -3.545  -6.321  23.009
  171    HB3  MET  23           HB3      MET  23  -3.255  -7.270  21.547
  172    HG2  MET  23           HG2      MET  23  -4.782  -5.827  20.261
  173    HG3  MET  23           HG3      MET  23  -5.030  -4.811  21.690
  174    HE1  MET  23           HE1      MET  23  -3.505  -2.961  22.349
  175    HE2  MET  23           HE2      MET  23  -2.521  -4.258  23.082
  176    HE3  MET  23           HE3      MET  23  -1.732  -2.970  22.142
  177    H    TRP  24           H        TRP  24  -7.472  -6.480  21.810
  178    HA   TRP  24           HA       TRP  24  -7.437  -7.432  19.029
  179    HB2  TRP  24           HB2      TRP  24  -8.541  -9.099  20.638
  180    HB3  TRP  24           HB3      TRP  24  -9.818  -7.918  20.845
  181    HD1  TRP  24           HD1      TRP  24  -8.162  -9.054  17.502
  182    HE1  TRP  24           HE1      TRP  24  -9.891 -10.302  16.099
  183    HE3  TRP  24           HE3      TRP  24 -12.028  -9.035  20.829
  184    HZ2  TRP  24           HZ2      TRP  24 -12.562 -11.364  16.463
  185    HZ3  TRP  24           HZ3      TRP  24 -14.163 -10.181  20.276
  186    HH2  TRP  24           HH2      TRP  24 -14.419 -11.351  18.123
  187    H    ALA  25           H        ALA  25  -8.639  -5.787  17.681
  188    HA   ALA  25           HA       ALA  25 -10.031  -3.640  19.157
  189    HB1  ALA  25           HB1      ALA  25  -7.619  -2.981  19.269
  190    HB2  ALA  25           HB2      ALA  25  -7.513  -3.110  17.514
  191    HB3  ALA  25           HB3      ALA  25  -8.553  -1.876  18.266
  192    H    ARG  26           H        ARG  26 -11.363  -2.288  17.781
  193    HA   ARG  26           HA       ARG  26 -11.935  -3.578  15.153
  194    HB2  ARG  26           HB2      ARG  26 -14.226  -2.977  15.281
  195    HB3  ARG  26           HB3      ARG  26 -13.784  -4.003  16.641
  196    HG2  ARG  26           HG2      ARG  26 -13.784  -2.037  18.131
  197    HG3  ARG  26           HG3      ARG  26 -14.177  -0.987  16.751
  198    HD2  ARG  26           HD2      ARG  26 -16.231  -2.486  16.382
  199    HD3  ARG  26           HD3      ARG  26 -15.885  -3.175  17.978
  200    HE   ARG  26           HE       ARG  26 -16.205  -0.217  17.628
  201   HH11  ARG  26          HH11      ARG  26 -17.708  -3.196  18.913
  202   HH12  ARG  26          HH12      ARG  26 -18.882  -2.319  19.828
  203   HH21  ARG  26          HH21      ARG  26 -17.661   0.849  18.705
  204   HH22  ARG  26          HH22      ARG  26 -18.876   0.097  19.732
  205    H    ARG  27           H        ARG  27 -12.087  -2.257  13.341
  206    HA   ARG  27           HA       ARG  27 -10.407   0.077  13.615
  207    HB2  ARG  27           HB2      ARG  27 -10.340  -1.698  11.853
  208    HB3  ARG  27           HB3      ARG  27 -11.761  -0.987  11.107
  209    HG2  ARG  27           HG2      ARG  27 -10.601   1.031  10.550
  210    HG3  ARG  27           HG3      ARG  27  -9.281   0.683  11.674
  211    HD2  ARG  27           HD2      ARG  27  -9.869  -0.849   9.108
  212    HD3  ARG  27           HD3      ARG  27  -8.569   0.314   9.330
  213    HE   ARG  27           HE       ARG  27  -8.659  -2.467  10.211
  214   HH11  ARG  27          HH11      ARG  27  -6.969   0.632  10.824
  215   HH12  ARG  27          HH12      ARG  27  -5.755  -0.126  11.829
  216   HH21  ARG  27          HH21      ARG  27  -7.105  -3.370  11.549
  217   HH22  ARG  27          HH22      ARG  27  -5.778  -2.384  12.180
  218    H    PHE  28           H        PHE  28 -10.851   2.212  12.679
  219    HA   PHE  28           HA       PHE  28 -12.946   3.531  13.831
  220    HB2  PHE  28           HB2      PHE  28 -10.964   4.601  12.866
  221    HB3  PHE  28           HB3      PHE  28 -11.520   4.227  11.240
  222    HD1  PHE  28           HD1      PHE  28 -12.599   6.039  14.377
  223    HD2  PHE  28           HD2      PHE  28 -12.812   5.834  10.065
  224    HE1  PHE  28           HE1      PHE  28 -13.855   8.177  14.332
  225    HE2  PHE  28           HE2      PHE  28 -14.072   7.973  10.034
  226    HZ   PHE  28           HZ       PHE  28 -14.594   9.150  12.170
  227    H    GLY  29           H        GLY  29 -15.065   3.579  13.561
  228    HA2  GLY  29           HA2      GLY  29 -17.131   3.709  12.619
  229    HA3  GLY  29           HA3      GLY  29 -16.383   3.760  11.016
  230    H    GLN  30           H        GLN  30 -15.359   0.944  12.764
  231    HA   GLN  30           HA       GLN  30 -17.252  -0.699  11.152
  232    HB2  GLN  30           HB2      GLN  30 -14.572  -1.597  12.233
  233    HB3  GLN  30           HB3      GLN  30 -15.593  -2.387  11.027
  234    HG2  GLN  30           HG2      GLN  30 -13.915   0.108  10.718
  235    HG3  GLN  30           HG3      GLN  30 -13.740  -1.426   9.882
  236   HE21  GLN  30          HE22      GLN  30 -14.665   1.692   9.360
  237   HE22  GLN  30          HE21      GLN  30 -15.813   1.447   8.048
  238    H    HIS  31           H        HIS  31 -17.883  -2.750  12.054
  239    HA   HIS  31           HA       HIS  31 -18.192  -2.695  15.022
  240    HB2  HIS  31           HB2      HIS  31 -20.183  -3.668  12.955
  241    HB3  HIS  31           HB3      HIS  31 -20.422  -3.607  14.704
  242    HD1  HIS  31           HD1      HIS  31 -21.255  -1.592  11.760
  243    HD2  HIS  31           HD2      HIS  31 -20.029  -0.875  15.726
  244    HE1  HIS  31           HE1      HIS  31 -21.876   0.820  12.275
  245    H    SER  32           H        SER  32 -16.179  -4.106  13.150
  246    HA   SER  32           HA       SER  32 -16.581  -6.878  14.151
  247    HB2  SER  32           HB2      SER  32 -15.487  -6.096  11.425
  248    HB3  SER  32           HB3      SER  32 -15.726  -7.736  12.044
  249    HG   SER  32           HG       SER  32 -17.456  -7.046  10.660
  250    H    TRP  33           H        TRP  33 -14.700  -7.843  14.944
  251    HA   TRP  33           HA       TRP  33 -12.632  -5.863  15.686
  252    HB2  TRP  33           HB2      TRP  33 -13.384  -8.563  16.777
  253    HB3  TRP  33           HB3      TRP  33 -12.141  -7.493  17.444
  254    HD1  TRP  33           HD1      TRP  33 -15.942  -7.889  17.170
  255    HE1  TRP  33           HE1      TRP  33 -17.091  -6.381  18.869
  256    HE3  TRP  33           HE3      TRP  33 -11.840  -5.390  18.868
  257    HZ2  TRP  33           HZ2      TRP  33 -16.317  -4.261  20.725
  258    HZ3  TRP  33           HZ3      TRP  33 -12.074  -3.587  20.552
  259    HH2  TRP  33           HH2      TRP  33 -14.304  -2.988  21.457
  260    H    GLN  34           H        GLN  34 -10.382  -6.332  15.612
  261    HA   GLN  34           HA       GLN  34  -9.500  -8.394  13.672
  262    HB2  GLN  34           HB2      GLN  34  -8.894  -5.392  13.585
  263    HB3  GLN  34           HB3      GLN  34  -8.159  -6.616  12.546
  264    HG2  GLN  34           HG2      GLN  34 -10.381  -7.080  11.534
  265    HG3  GLN  34           HG3      GLN  34 -11.092  -5.804  12.532
  266   HE21  GLN  34          HE22      GLN  34 -11.478  -5.483   9.873
  267   HE22  GLN  34          HE21      GLN  34 -10.411  -4.280   9.204
  268    H    PHE  35           H        PHE  35  -7.202  -8.760  13.766
  269    HA   PHE  35           HA       PHE  35  -5.910  -8.008  16.328
  270    HB2  PHE  35           HB2      PHE  35  -4.942  -9.644  13.963
  271    HB3  PHE  35           HB3      PHE  35  -4.003  -9.325  15.428
  272    HD1  PHE  35           HD1      PHE  35  -5.782  -9.882  17.654
  273    HD2  PHE  35           HD2      PHE  35  -5.323 -11.956  13.876
  274    HE1  PHE  35           HE1      PHE  35  -6.574 -11.975  18.696
  275    HE2  PHE  35           HE2      PHE  35  -6.047 -14.053  14.969
  276    HZ   PHE  35           HZ       PHE  35  -6.715 -14.071  17.353
  277    HA   PRO  36           HA       PRO  36  -4.505  -4.242  14.418
  278    HB2  PRO  36           HB2      PRO  36  -1.896  -4.751  15.875
  279    HB3  PRO  36           HB3      PRO  36  -2.821  -3.222  15.747
  280    HG2  PRO  36           HG2      PRO  36  -2.994  -4.751  17.967
  281    HG3  PRO  36           HG3      PRO  36  -4.479  -4.016  17.283
  282    HD2  PRO  36           HD2      PRO  36  -3.499  -6.861  17.060
  283    HD3  PRO  36           HD3      PRO  36  -5.161  -6.236  17.265
  284    H    GLN  37           H        GLN  37  -3.466  -3.665  12.435
  285    HA   GLN  37           HA       GLN  37  -1.187  -5.163  11.467
  286    HB2  GLN  37           HB2      GLN  37  -2.303  -6.314   9.604
  287    HB3  GLN  37           HB3      GLN  37  -2.990  -6.836  11.131
  288    HG2  GLN  37           HG2      GLN  37  -4.846  -5.040  10.694
  289    HG3  GLN  37           HG3      GLN  37  -4.211  -4.997   9.045
  290   HE21  GLN  37          HE22      GLN  37  -5.689  -7.094  11.565
  291   HE22  GLN  37          HE21      GLN  37  -6.337  -8.270  10.428
  292    H    GLY  38           H        GLY  38  -0.582  -4.584   9.209
  293    HA2  GLY  38           HA2      GLY  38  -1.870  -2.415   7.851
  294    HA3  GLY  38           HA3      GLY  38  -0.482  -1.823   8.770
  295    H    GLY  39           H        GLY  39  -0.323  -1.517   6.058
  296    HA2  GLY  39           HA2      GLY  39   0.812  -3.774   4.671
  297    HA3  GLY  39           HA3      GLY  39   0.670  -2.109   4.114
  298    H    ILE  40           H        ILE  40   2.905  -3.915   4.041
  299    HA   ILE  40           HA       ILE  40   5.050  -2.707   5.689
  300    HB   ILE  40           HB       ILE  40   4.970  -4.695   3.394
  301   HG12  ILE  40          HG12      ILE  40   6.126  -5.129   6.158
  302   HG13  ILE  40          HG13      ILE  40   4.417  -5.394   5.849
  303   HG21  ILE  40          HG21      ILE  40   7.397  -4.953   3.512
  304   HG22  ILE  40          HG22      ILE  40   7.034  -3.275   3.166
  305   HG23  ILE  40          HG23      ILE  40   7.489  -3.760   4.813
  306   HD11  ILE  40          HD11      ILE  40   6.529  -6.807   4.174
  307   HD12  ILE  40          HD12      ILE  40   6.051  -7.412   5.743
  308   HD13  ILE  40          HD13      ILE  40   4.825  -7.228   4.468
  309    H    ASN  41           H        ASN  41   5.834  -0.734   5.183
  310    HA   ASN  41           HA       ASN  41   4.790   0.659   2.840
  311    HB2  ASN  41           HB2      ASN  41   6.709   1.633   5.021
  312    HB3  ASN  41           HB3      ASN  41   6.050   2.620   3.738
  313   HD21  ASN  41          HD22      ASN  41   5.184   0.633   6.520
  314   HD22  ASN  41          HD21      ASN  41   3.606   1.359   6.849
  315    HA   PRO  42           HA       PRO  42   7.630  -0.414  -0.056
  316    HB2  PRO  42           HB2      PRO  42   8.669   2.395  -0.535
  317    HB3  PRO  42           HB3      PRO  42   8.037   1.210  -1.714
  318    HG2  PRO  42           HG2      PRO  42   6.518   3.305  -0.831
  319    HG3  PRO  42           HG3      PRO  42   5.790   1.698  -1.101
  320    HD2  PRO  42           HD2      PRO  42   6.625   2.975   1.495
  321    HD3  PRO  42           HD3      PRO  42   5.187   1.973   1.136
  322    H    GLY  43           H        GLY  43   9.498  -1.529   0.337
  323    HA2  GLY  43           HA2      GLY  43  11.732  -1.923   0.664
  324    HA3  GLY  43           HA3      GLY  43  12.004  -0.211   0.991
  325    H    GLU  44           H        GLU  44   9.512  -1.218   3.124
  326    HA   GLU  44           HA       GLU  44  11.311  -1.381   5.391
  327    HB2  GLU  44           HB2      GLU  44   8.319  -1.720   4.998
  328    HB3  GLU  44           HB3      GLU  44   9.084  -2.257   6.493
  329    HG2  GLU  44           HG2      GLU  44   9.996  -0.085   6.907
  330    HG3  GLU  44           HG3      GLU  44   9.243   0.564   5.429
  331    H    SER  45           H        SER  45  11.612  -3.246   6.786
  332    HA   SER  45           HA       SER  45  11.380  -5.869   5.429
  333    HB2  SER  45           HB2      SER  45  12.620  -6.700   7.353
  334    HB3  SER  45           HB3      SER  45  13.479  -5.328   6.628
  335    HG   SER  45           HG       SER  45  13.405  -5.099   8.873
  336    H    ALA  46           H        ALA  46  10.234  -7.585   6.860
  337    HA   ALA  46           HA       ALA  46   7.621  -6.715   7.465
  338    HB1  ALA  46           HB1      ALA  46   9.126  -9.174   8.455
  339    HB2  ALA  46           HB2      ALA  46   7.357  -8.967   8.458
  340    HB3  ALA  46           HB3      ALA  46   8.223  -9.034   6.910
  341    H    GLU  47           H        GLU  47  10.478  -7.042   9.537
  342    HA   GLU  47           HA       GLU  47   9.040  -6.730  12.037
  343    HB2  GLU  47           HB2      GLU  47  11.014  -8.032  11.869
  344    HB3  GLU  47           HB3      GLU  47  11.959  -6.689  11.210
  345    HG2  GLU  47           HG2      GLU  47  10.763  -6.096  13.863
  346    HG3  GLU  47           HG3      GLU  47  11.820  -7.502  13.866
  347    H    GLN  48           H        GLN  48  10.926  -4.527   9.874
  348    HA   GLN  48           HA       GLN  48  10.690  -2.267  11.611
  349    HB2  GLN  48           HB2      GLN  48  11.118  -2.498   8.609
  350    HB3  GLN  48           HB3      GLN  48  11.110  -0.952   9.469
  351    HG2  GLN  48           HG2      GLN  48  12.901  -3.259  10.292
  352    HG3  GLN  48           HG3      GLN  48  13.409  -2.035   9.112
  353   HE21  GLN  48          HE21      GLN  48  12.997  -2.831  12.459
  354   HE22  GLN  48          HE22      GLN  48  13.502  -1.283  13.134
  355    H    ALA  49           H        ALA  49   8.591  -3.577   8.985
  356    HA   ALA  49           HA       ALA  49   6.725  -1.398   9.067
  357    HB1  ALA  49           HB1      ALA  49   6.468  -4.276   8.149
  358    HB2  ALA  49           HB2      ALA  49   5.317  -2.967   7.810
  359    HB3  ALA  49           HB3      ALA  49   6.975  -2.876   7.141
  360    H    MET  50           H        MET  50   7.040  -4.519  10.849
  361    HA   MET  50           HA       MET  50   4.471  -4.464  12.057
  362    HB2  MET  50           HB2      MET  50   5.694  -6.451  12.216
  363    HB3  MET  50           HB3      MET  50   7.141  -5.679  12.843
  364    HG2  MET  50           HG2      MET  50   4.558  -5.664  14.368
  365    HG3  MET  50           HG3      MET  50   5.647  -7.036  14.430
  366    HE1  MET  50           HE1      MET  50   7.963  -7.069  15.244
  367    HE2  MET  50           HE2      MET  50   8.639  -5.546  14.614
  368    HE3  MET  50           HE3      MET  50   8.685  -5.881  16.352
  369    H    TYR  51           H        TYR  51   7.607  -2.993  13.187
  370    HA   TYR  51           HA       TYR  51   6.334  -1.755  15.410
  371    HB2  TYR  51           HB2      TYR  51   8.889  -1.031  13.936
  372    HB3  TYR  51           HB3      TYR  51   8.386  -0.347  15.492
  373    HD1  TYR  51           HD2      TYR  51   7.630  -2.292  17.296
  374    HD2  TYR  51           HD1      TYR  51  10.563  -2.650  14.144
  375    HE1  TYR  51           HE2      TYR  51   8.976  -3.801  18.714
  376    HE2  TYR  51           HE1      TYR  51  11.877  -4.188  15.541
  377    HH   TYR  51           HH       TYR  51  10.990  -5.039  18.911
  378    H    ARG  52           H        ARG  52   7.063  -0.376  12.095
  379    HA   ARG  52           HA       ARG  52   6.089   2.185  12.455
  380    HB2  ARG  52           HB2      ARG  52   7.201   1.135  10.450
  381    HB3  ARG  52           HB3      ARG  52   5.712   0.279  10.101
  382    HG2  ARG  52           HG2      ARG  52   5.596   2.026   8.611
  383    HG3  ARG  52           HG3      ARG  52   4.581   2.602   9.927
  384    HD2  ARG  52           HD2      ARG  52   6.019   4.378   9.146
  385    HD3  ARG  52           HD3      ARG  52   6.548   3.883  10.802
  386    HE   ARG  52           HE       ARG  52   7.947   2.418   8.803
  387   HH11  ARG  52          HH11      ARG  52   7.896   5.731  10.131
  388   HH12  ARG  52          HH12      ARG  52   9.538   6.066   9.719
  389   HH21  ARG  52          HH21      ARG  52  10.091   2.847   8.278
  390   HH22  ARG  52          HH22      ARG  52  10.831   4.377   8.625
  391    H    GLU  53           H        GLU  53   4.199  -0.722  11.433
  392    HA   GLU  53           HA       GLU  53   1.814   0.821  11.282
  393    HB2  GLU  53           HB2      GLU  53   2.236  -2.155  11.096
  394    HB3  GLU  53           HB3      GLU  53   0.700  -1.332  10.812
  395    HG2  GLU  53           HG2      GLU  53   3.294  -0.756   9.346
  396    HG3  GLU  53           HG3      GLU  53   1.979  -1.742   8.709
  397    H    LEU  54           H        LEU  54   3.247  -1.322  13.802
  398    HA   LEU  54           HA       LEU  54   1.025  -1.433  15.541
  399    HB2  LEU  54           HB2      LEU  54   3.170  -2.663  15.885
  400    HB3  LEU  54           HB3      LEU  54   3.983  -1.128  16.210
  401    HG   LEU  54           HG       LEU  54   2.368  -0.825  18.167
  402   HD11  LEU  54          HD11      LEU  54   0.629  -2.455  17.459
  403   HD12  LEU  54          HD12      LEU  54   1.805  -3.746  17.493
  404   HD13  LEU  54          HD13      LEU  54   1.327  -2.958  19.011
  405   HD21  LEU  54          HD21      LEU  54   4.281  -3.197  18.178
  406   HD22  LEU  54          HD22      LEU  54   4.709  -1.493  18.457
  407   HD23  LEU  54          HD23      LEU  54   3.680  -2.334  19.617
  408    H    PHE  55           H        PHE  55   3.580   1.136  15.181
  409    HA   PHE  55           HA       PHE  55   2.513   2.809  17.206
  410    HB2  PHE  55           HB2      PHE  55   4.752   3.105  16.212
  411    HB3  PHE  55           HB3      PHE  55   4.016   3.590  14.684
  412    HD1  PHE  55           HD1      PHE  55   4.428   4.532  18.269
  413    HD2  PHE  55           HD2      PHE  55   3.142   5.827  14.359
  414    HE1  PHE  55           HE1      PHE  55   4.218   6.858  19.108
  415    HE2  PHE  55           HE2      PHE  55   2.948   8.157  15.197
  416    HZ   PHE  55           HZ       PHE  55   3.477   8.675  17.577
  417    H    GLU  56           H        GLU  56   1.683   2.553  13.688
  418    HA   GLU  56           HA       GLU  56  -0.118   4.712  13.732
  419    HB2  GLU  56           HB2      GLU  56   0.138   2.313  11.908
  420    HB3  GLU  56           HB3      GLU  56  -1.065   3.576  11.650
  421    HG2  GLU  56           HG2      GLU  56   1.895   4.200  11.937
  422    HG3  GLU  56           HG3      GLU  56   1.160   3.798  10.388
  423    H    GLU  57           H        GLU  57  -0.508   1.389  14.875
  424    HA   GLU  57           HA       GLU  57  -3.433   1.466  14.724
  425    HB2  GLU  57           HB2      GLU  57  -1.397  -0.588  15.672
  426    HB3  GLU  57           HB3      GLU  57  -3.124  -0.836  15.806
  427    HG2  GLU  57           HG2      GLU  57  -1.769  -0.357  13.132
  428    HG3  GLU  57           HG3      GLU  57  -1.957  -1.944  13.865
  429    H    VAL  58           H        VAL  58  -0.946   1.153  17.304
  430    HA   VAL  58           HA       VAL  58  -3.007   1.827  19.378
  431    HB   VAL  58           HB       VAL  58  -1.401   0.352  20.821
  432   HG11  VAL  58          HG11      VAL  58  -3.754  -0.237  20.069
  433   HG12  VAL  58          HG12      VAL  58  -2.992  -1.192  18.776
  434   HG13  VAL  58          HG13      VAL  58  -2.655  -1.542  20.495
  435   HG21  VAL  58          HG21      VAL  58   0.391   0.184  19.126
  436   HG22  VAL  58          HG22      VAL  58  -0.193  -1.364  19.777
  437   HG23  VAL  58          HG23      VAL  58  -0.682  -0.826  18.142
  438    H    GLY  59           H        GLY  59  -0.376   3.281  17.871
  439    HA2  GLY  59           HA2      GLY  59   0.999   5.000  18.501
  440    HA3  GLY  59           HA3      GLY  59   0.078   5.106  20.002
  441    H    LEU  60           H        LEU  60   1.243   1.976  19.814
  442    HA   LEU  60           HA       LEU  60   3.181   2.375  21.879
  443    HB2  LEU  60           HB2      LEU  60   1.441   0.564  21.608
  444    HB3  LEU  60           HB3      LEU  60   2.398  -0.068  20.265
  445    HG   LEU  60           HG       LEU  60   4.227  -0.697  21.788
  446   HD11  LEU  60          HD11      LEU  60   3.877  -0.541  24.219
  447   HD12  LEU  60          HD12      LEU  60   4.004   1.073  23.505
  448   HD13  LEU  60          HD13      LEU  60   2.406   0.430  23.957
  449   HD21  LEU  60          HD21      LEU  60   1.363  -1.428  22.701
  450   HD22  LEU  60          HD22      LEU  60   2.247  -2.210  21.378
  451   HD23  LEU  60          HD23      LEU  60   2.824  -2.389  23.045
  452    H    SER  61           H        SER  61   5.392   1.911  21.768
  453    HA   SER  61           HA       SER  61   6.612   2.010  19.042
  454    HB2  SER  61           HB2      SER  61   7.501   3.492  21.556
  455    HB3  SER  61           HB3      SER  61   8.209   3.626  19.933
  456    HG   SER  61           HG       SER  61   6.725   5.335  20.417
  457    H    ARG  62           H        ARG  62   8.872   1.288  19.005
  458    HA   ARG  62           HA       ARG  62   9.347  -1.290  19.593
  459    HB2  ARG  62           HB2      ARG  62  11.366   1.006  19.502
  460    HB3  ARG  62           HB3      ARG  62  11.831  -0.688  19.629
  461    HG2  ARG  62           HG2      ARG  62  10.216  -1.015  17.588
  462    HG3  ARG  62           HG3      ARG  62  10.432   0.714  17.350
  463    HD2  ARG  62           HD2      ARG  62  12.031  -0.487  15.993
  464    HD3  ARG  62           HD3      ARG  62  12.914   0.325  17.320
  465    HE   ARG  62           HE       ARG  62  12.153  -2.380  17.985
  466   HH11  ARG  62          HH11      ARG  62  14.647  -0.565  16.224
  467   HH12  ARG  62          HH12      ARG  62  15.744  -1.901  16.133
  468   HH21  ARG  62          HH21      ARG  62  13.551  -4.162  17.805
  469   HH22  ARG  62          HH22      ARG  62  15.119  -3.984  17.101
  470    H    LYS  63           H        LYS  63  10.078   1.419  21.793
  471    HA   LYS  63           HA       LYS  63  11.700  -0.123  23.543
  472    HB2  LYS  63           HB2      LYS  63  10.225   2.438  24.285
  473    HB3  LYS  63           HB3      LYS  63  11.760   1.830  24.933
  474    HG2  LYS  63           HG2      LYS  63  11.270   3.039  22.200
  475    HG3  LYS  63           HG3      LYS  63  12.181   3.741  23.530
  476    HD2  LYS  63           HD2      LYS  63  12.911   1.092  22.278
  477    HD3  LYS  63           HD3      LYS  63  13.499   2.608  21.599
  478    HE2  LYS  63           HE2      LYS  63  13.947   1.799  24.515
  479    HE3  LYS  63           HE3      LYS  63  15.071   1.365  23.224
  480    HZ1  LYS  63           HZ1      LYS  63  15.395   3.737  22.782
  481    HZ2  LYS  63           HZ2      LYS  63  14.386   4.145  24.010
  482    HZ3  LYS  63           HZ3      LYS  63  15.788   3.371  24.317
  483    H    ASP  64           H        ASP  64   8.246   0.083  23.339
  484    HA   ASP  64           HA       ASP  64   8.112  -1.097  26.061
  485    HB2  ASP  64           HB2      ASP  64   7.069   1.233  25.613
  486    HB3  ASP  64           HB3      ASP  64   5.736   0.298  24.952
  487    H    VAL  65           H        VAL  65   8.471  -2.331  23.331
  488    HA   VAL  65           HA       VAL  65   6.736  -4.641  23.985
  489    HB   VAL  65           HB       VAL  65   6.626  -5.064  21.447
  490   HG11  VAL  65          HG11      VAL  65   4.530  -3.790  21.261
  491   HG12  VAL  65          HG12      VAL  65   4.681  -4.561  22.851
  492   HG13  VAL  65          HG13      VAL  65   4.997  -2.824  22.676
  493   HG21  VAL  65          HG21      VAL  65   8.215  -3.165  20.812
  494   HG22  VAL  65          HG22      VAL  65   6.674  -3.188  19.930
  495   HG23  VAL  65          HG23      VAL  65   6.916  -2.046  21.253
  496    H    ARG  66           H        ARG  66   7.558  -6.705  23.066
  497    HA   ARG  66           HA       ARG  66  10.334  -6.684  22.112
  498    HB2  ARG  66           HB2      ARG  66  11.068  -8.451  23.571
  499    HB3  ARG  66           HB3      ARG  66  10.654  -7.012  24.471
  500    HG2  ARG  66           HG2      ARG  66   8.508  -9.145  24.308
  501    HG3  ARG  66           HG3      ARG  66   9.972  -9.544  25.190
  502    HD2  ARG  66           HD2      ARG  66   8.266  -7.091  25.746
  503    HD3  ARG  66           HD3      ARG  66   8.198  -8.589  26.667
  504    HE   ARG  66           HE       ARG  66  10.291  -6.523  26.730
  505   HH11  ARG  66          HH21      ARG  66   9.681  -9.944  27.638
  506   HH12  ARG  66          HH22      ARG  66  10.902  -9.902  28.885
  507   HH21  ARG  66          HH11      ARG  66  11.747  -6.533  28.517
  508   HH22  ARG  66          HH12      ARG  66  11.885  -7.969  29.498
  509    H    ILE  67           H        ILE  67  10.642  -8.399  20.537
  510    HA   ILE  67           HA       ILE  67   8.125  -9.595  19.636
  511    HB   ILE  67           HB       ILE  67  10.933  -9.942  18.551
  512   HG12  ILE  67          HG12      ILE  67   8.800  -8.157  17.340
  513   HG13  ILE  67          HG13      ILE  67  10.036  -7.539  18.434
  514   HG21  ILE  67          HG21      ILE  67   8.199 -10.586  17.331
  515   HG22  ILE  67          HG22      ILE  67   9.765 -10.786  16.511
  516   HG23  ILE  67          HG23      ILE  67   9.383 -11.776  17.911
  517   HD11  ILE  67          HD11      ILE  67  11.804  -8.425  16.904
  518   HD12  ILE  67          HD12      ILE  67  10.531  -8.843  15.732
  519   HD13  ILE  67          HD13      ILE  67  10.791  -7.153  16.204
  520    H    LEU  68           H        LEU  68   7.399 -11.300  20.606
  521    HA   LEU  68           HA       LEU  68   9.222 -13.219  21.967
  522    HB2  LEU  68           HB2      LEU  68   6.185 -12.977  21.829
  523    HB3  LEU  68           HB3      LEU  68   7.082 -14.201  22.720
  524    HG   LEU  68           HG       LEU  68   7.034 -11.214  23.330
  525   HD11  LEU  68          HD11      LEU  68   5.794 -13.730  24.503
  526   HD12  LEU  68          HD12      LEU  68   6.080 -12.306  25.492
  527   HD13  LEU  68          HD13      LEU  68   5.041 -12.176  24.042
  528   HD21  LEU  68          HD21      LEU  68   8.579 -13.463  24.706
  529   HD22  LEU  68          HD22      LEU  68   9.275 -12.045  23.872
  530   HD23  LEU  68          HD23      LEU  68   8.354 -11.816  25.354
  531    H    ALA  69           H        ALA  69   7.110 -12.927  19.103
  532    HA   ALA  69           HA       ALA  69   8.084 -15.473  18.030
  533    HB1  ALA  69           HB1      ALA  69   6.081 -16.009  19.616
  534    HB2  ALA  69           HB2      ALA  69   5.096 -15.232  18.365
  535    HB3  ALA  69           HB3      ALA  69   6.076 -16.654  17.969
  536    H    SER  70           H        SER  70   7.220 -15.810  15.893
  537    HA   SER  70           HA       SER  70   5.641 -13.873  14.615
  538    HB2  SER  70           HB2      SER  70   7.327 -13.112  12.881
  539    HB3  SER  70           HB3      SER  70   7.490 -12.428  14.501
  540    HG   SER  70           HG       SER  70   9.536 -13.106  13.630
  541    H    THR  71           H        THR  71   5.127 -14.476  12.299
  542    HA   THR  71           HA       THR  71   4.843 -17.341  12.293
  543    HB   THR  71           HB       THR  71   3.888 -16.748   9.922
  544    HG1  THR  71           HG1      THR  71   4.596 -14.692   9.698
  545   HG21  THR  71          HG21      THR  71   1.828 -15.634  11.220
  546   HG22  THR  71          HG22      THR  71   2.180 -17.352  11.128
  547   HG23  THR  71          HG23      THR  71   2.660 -16.453  12.586
  548    H    ARG  72           H        ARG  72   5.738 -18.901  11.175
  549    HA   ARG  72           HA       ARG  72   8.438 -18.408  10.156
  550    HB2  ARG  72           HB2      ARG  72   6.770 -20.948  10.207
  551    HB3  ARG  72           HB3      ARG  72   8.510 -20.882   9.985
  552    HG2  ARG  72           HG2      ARG  72   8.955 -20.543  12.230
  553    HG3  ARG  72           HG3      ARG  72   7.513 -19.582  12.508
  554    HD2  ARG  72           HD2      ARG  72   6.221 -21.821  12.068
  555    HD3  ARG  72           HD3      ARG  72   7.754 -22.599  12.498
  556    HE   ARG  72           HE       ARG  72   5.766 -21.228  14.093
  557   HH11  ARG  72          HH11      ARG  72   9.208 -22.152  14.179
  558   HH12  ARG  72          HH12      ARG  72   9.338 -22.069  15.896
  559   HH21  ARG  72          HH21      ARG  72   5.938 -21.076  16.363
  560   HH22  ARG  72          HH22      ARG  72   7.419 -21.454  17.174
  561    H    ASN  73           H        ASN  73   5.267 -18.955   8.784
  562    HA   ASN  73           HA       ASN  73   6.289 -18.789   6.034
  563    HB2  ASN  73           HB2      ASN  73   4.632 -20.278   5.273
  564    HB3  ASN  73           HB3      ASN  73   5.270 -21.058   6.720
  565   HD21  ASN  73          HD22      ASN  73   3.901 -20.800   8.807
  566   HD22  ASN  73          HD21      ASN  73   2.190 -20.536   8.627
  567    H    TRP  74           H        TRP  74   4.793 -17.496   4.595
  568    HA   TRP  74           HA       TRP  74   3.538 -15.318   6.144
  569    HB2  TRP  74           HB2      TRP  74   3.772 -15.813   3.137
  570    HB3  TRP  74           HB3      TRP  74   2.992 -14.424   3.856
  571    HD1  TRP  74           HD1      TRP  74   6.498 -15.971   3.470
  572    HE1  TRP  74           HE1      TRP  74   8.258 -14.118   3.596
  573    HE3  TRP  74           HE3      TRP  74   3.457 -12.012   4.643
  574    HZ2  TRP  74           HZ2      TRP  74   8.371 -11.347   4.301
  575    HZ3  TRP  74           HZ3      TRP  74   4.417  -9.760   4.998
  576    HH2  TRP  74           HH2      TRP  74   6.883  -9.460   5.012
  577    H    LEU  75           H        LEU  75   1.409 -15.004   6.462
  578    HA   LEU  75           HA       LEU  75  -0.368 -17.278   5.735
  579    HB2  LEU  75           HB2      LEU  75  -1.022 -14.892   7.494
  580    HB3  LEU  75           HB3      LEU  75  -1.912 -16.400   7.310
  581    HG   LEU  75           HG       LEU  75   0.691 -15.908   8.771
  582   HD11  LEU  75          HD11      LEU  75  -1.409 -15.501   9.946
  583   HD12  LEU  75          HD12      LEU  75  -1.967 -17.156   9.628
  584   HD13  LEU  75          HD13      LEU  75  -0.549 -16.872  10.667
  585   HD21  LEU  75          HD21      LEU  75   1.188 -17.927   7.612
  586   HD22  LEU  75          HD22      LEU  75   0.783 -18.356   9.272
  587   HD23  LEU  75          HD23      LEU  75  -0.420 -18.627   7.988
  588    H    ARG  76           H        ARG  76  -1.458 -17.076   3.825
  589    HA   ARG  76           HA       ARG  76  -1.929 -14.331   2.720
  590    HB2  ARG  76           HB2      ARG  76   0.019 -15.793   1.825
  591    HB3  ARG  76           HB3      ARG  76  -1.221 -16.882   1.207
  592    HG2  ARG  76           HG2      ARG  76  -2.096 -14.908  -0.185
  593    HG3  ARG  76           HG3      ARG  76  -0.671 -14.001   0.384
  594    HD2  ARG  76           HD2      ARG  76   0.710 -16.023  -0.423
  595    HD3  ARG  76           HD3      ARG  76  -0.762 -16.552  -1.270
  596    HE   ARG  76           HE       ARG  76  -0.346 -13.893  -2.043
  597   HH11  ARG  76          HH21      ARG  76   1.453 -16.958  -2.319
  598   HH12  ARG  76          HH22      ARG  76   2.337 -16.479  -3.718
  599   HH21  ARG  76          HH11      ARG  76   0.855 -13.266  -3.959
  600   HH22  ARG  76          HH12      ARG  76   1.987 -14.352  -4.657
  601    H    TYR  77           H        TYR  77  -3.851 -14.134   1.471
  602    HA   TYR  77           HA       TYR  77  -5.527 -16.472   1.065
  603    HB2  TYR  77           HB2      TYR  77  -7.576 -15.548   1.878
  604    HB3  TYR  77           HB3      TYR  77  -6.423 -15.829   3.171
  605    HD1  TYR  77           HD1      TYR  77  -5.282 -13.939   4.297
  606    HD2  TYR  77           HD2      TYR  77  -8.398 -13.312   1.377
  607    HE1  TYR  77           HE1      TYR  77  -5.660 -11.681   5.189
  608    HE2  TYR  77           HE2      TYR  77  -8.738 -11.029   2.221
  609    HH   TYR  77           HH       TYR  77  -8.119  -9.415   3.835
  610    H    LYS  78           H        LYS  78  -6.771 -16.233  -0.833
  611    HA   LYS  78           HA       LYS  78  -6.257 -13.766  -2.437
  612    HB2  LYS  78           HB2      LYS  78  -7.142 -16.580  -3.109
  613    HB3  LYS  78           HB3      LYS  78  -7.751 -15.252  -4.084
  614    HG2  LYS  78           HG2      LYS  78  -5.814 -16.185  -5.124
  615    HG3  LYS  78           HG3      LYS  78  -5.513 -14.511  -4.653
  616    HD2  LYS  78           HD2      LYS  78  -4.124 -15.181  -2.798
  617    HD3  LYS  78           HD3      LYS  78  -4.567 -16.884  -2.963
  618    HE2  LYS  78           HE2      LYS  78  -3.086 -15.270  -5.098
  619    HE3  LYS  78           HE3      LYS  78  -2.270 -16.216  -3.852
  620    HZ1  LYS  78           HZ1      LYS  78  -3.336 -18.217  -4.741
  621    HZ2  LYS  78           HZ2      LYS  78  -4.068 -17.350  -5.925
  622    HZ3  LYS  78           HZ3      LYS  78  -2.448 -17.475  -5.888
  623    H    LEU  79           H        LEU  79  -7.871 -12.385  -2.899
  624    HA   LEU  79           HA       LEU  79 -10.180 -12.241  -1.190
  625    HB2  LEU  79           HB2      LEU  79  -9.542 -10.782  -3.798
  626    HB3  LEU  79           HB3      LEU  79 -10.775 -10.323  -2.627
  627    HG   LEU  79           HG       LEU  79  -7.755 -10.162  -2.338
  628   HD11  LEU  79          HD11      LEU  79  -9.975  -8.083  -2.324
  629   HD12  LEU  79          HD12      LEU  79  -8.235  -7.759  -2.099
  630   HD13  LEU  79          HD13      LEU  79  -8.826  -8.412  -3.642
  631   HD21  LEU  79          HD21      LEU  79  -8.515 -10.952  -0.240
  632   HD22  LEU  79          HD22      LEU  79  -8.193  -9.223  -0.067
  633   HD23  LEU  79          HD23      LEU  79  -9.880  -9.796  -0.202
  634    HA   PRO  80           HA       PRO  80 -12.977 -14.352  -4.123
  635    HB2  PRO  80           HB2      PRO  80 -15.379 -13.585  -2.979
  636    HB3  PRO  80           HB3      PRO  80 -14.346 -14.870  -2.267
  637    HG2  PRO  80           HG2      PRO  80 -14.487 -11.959  -1.542
  638    HG3  PRO  80           HG3      PRO  80 -14.556 -13.368  -0.431
  639    HD2  PRO  80           HD2      PRO  80 -12.236 -12.001  -0.870
  640    HD3  PRO  80           HD3      PRO  80 -12.231 -13.782  -0.684
  641    H    LYS  81           H        LYS  81 -14.212 -13.311  -6.013
  642    HA   LYS  81           HA       LYS  81 -12.987 -10.789  -6.425
  643    HB2  LYS  81           HB2      LYS  81 -15.029 -12.015  -8.241
  644    HB3  LYS  81           HB3      LYS  81 -13.855 -10.687  -8.568
  645    HG2  LYS  81           HG2      LYS  81 -11.981 -12.131  -8.449
  646    HG3  LYS  81           HG3      LYS  81 -12.960 -13.488  -7.883
  647    HD2  LYS  81           HD2      LYS  81 -12.394 -13.724 -10.248
  648    HD3  LYS  81           HD3      LYS  81 -14.140 -13.632  -9.986
  649    HE2  LYS  81           HE2      LYS  81 -14.143 -11.259 -10.738
  650    HE3  LYS  81           HE3      LYS  81 -12.390 -11.333 -10.973
  651    HZ1  LYS  81           HZ1      LYS  81 -14.378 -12.965 -12.452
  652    HZ2  LYS  81           HZ2      LYS  81 -13.572 -11.677 -13.049
  653    HZ3  LYS  81           HZ3      LYS  81 -12.750 -13.032 -12.671
  654    H    ARG  82           H        ARG  82 -16.060 -11.389  -4.993
  655    HA   ARG  82           HA       ARG  82 -17.191  -8.849  -5.524
  656    HB2  ARG  82           HB2      ARG  82 -18.541  -9.139  -3.547
  657    HB3  ARG  82           HB3      ARG  82 -18.485 -10.608  -4.532
  658    HG2  ARG  82           HG2      ARG  82 -16.673 -11.431  -2.843
  659    HG3  ARG  82           HG3      ARG  82 -17.180 -10.076  -1.831
  660    HD2  ARG  82           HD2      ARG  82 -18.997 -12.267  -2.909
  661    HD3  ARG  82           HD3      ARG  82 -18.335 -12.235  -1.276
  662    HE   ARG  82           HE       ARG  82 -20.488 -10.568  -2.420
  663   HH11  ARG  82          HH21      ARG  82 -18.463 -11.174   0.446
  664   HH12  ARG  82          HH22      ARG  82 -19.454 -10.247   1.510
  665   HH21  ARG  82          HH11      ARG  82 -21.806  -9.344  -1.003
  666   HH22  ARG  82          HH12      ARG  82 -21.409  -9.200   0.668
  667    H    LEU  83           H        LEU  83 -14.559  -9.724  -3.371
  668    HA   LEU  83           HA       LEU  83 -14.560  -7.068  -2.118
  669    HB2  LEU  83           HB2      LEU  83 -12.765  -9.455  -1.619
  670    HB3  LEU  83           HB3      LEU  83 -12.812  -7.977  -0.673
  671    HG   LEU  83           HG       LEU  83 -15.041 -10.021  -0.927
  672   HD11  LEU  83          HD11      LEU  83 -14.619 -10.552   1.387
  673   HD12  LEU  83          HD12      LEU  83 -13.109 -10.697   0.486
  674   HD13  LEU  83          HD13      LEU  83 -13.387  -9.272   1.502
  675   HD21  LEU  83          HD21      LEU  83 -15.073  -7.418   0.608
  676   HD22  LEU  83          HD22      LEU  83 -16.152  -7.925  -0.723
  677   HD23  LEU  83          HD23      LEU  83 -16.234  -8.750   0.831
  678    H    VAL  84           H        VAL  84 -13.015  -8.692  -4.764
  679    HA   VAL  84           HA       VAL  84 -10.555  -7.196  -4.800
  680    HB   VAL  84           HB       VAL  84 -12.147  -8.390  -7.117
  681   HG11  VAL  84          HG11      VAL  84  -9.290  -7.370  -6.903
  682   HG12  VAL  84          HG12      VAL  84  -9.844  -8.427  -8.216
  683   HG13  VAL  84          HG13      VAL  84 -10.565  -6.829  -8.014
  684   HG21  VAL  84          HG21      VAL  84  -9.685  -9.680  -5.920
  685   HG22  VAL  84          HG22      VAL  84 -11.303 -10.080  -5.324
  686   HG23  VAL  84          HG23      VAL  84 -10.922 -10.347  -7.035
  687    H    ARG  85           H        ARG  85 -10.225  -5.086  -5.364
  688    HA   ARG  85           HA       ARG  85 -12.480  -3.552  -6.445
  689    HB2  ARG  85           HB2      ARG  85 -10.377  -3.067  -4.518
  690    HB3  ARG  85           HB3      ARG  85 -10.196  -1.897  -5.831
  691    HG2  ARG  85           HG2      ARG  85 -12.781  -2.507  -4.418
  692    HG3  ARG  85           HG3      ARG  85 -11.697  -1.152  -4.007
  693    HD2  ARG  85           HD2      ARG  85 -11.932  -0.414  -6.469
  694    HD3  ARG  85           HD3      ARG  85 -13.289  -1.516  -6.608
  695    HE   ARG  85           HE       ARG  85 -13.103   1.033  -5.174
  696   HH11  ARG  85          HH21      ARG  85 -15.107  -1.919  -5.481
  697   HH12  ARG  85          HH22      ARG  85 -16.528  -1.162  -4.864
  698   HH21  ARG  85          HH11      ARG  85 -15.006   2.003  -4.367
  699   HH22  ARG  85          HH12      ARG  85 -16.469   1.100  -4.208
  700    H    TRP  86           H        TRP  86 -12.511  -4.299  -8.472
  701    HA   TRP  86           HA       TRP  86 -10.270  -4.299 -10.229
  702    HB2  TRP  86           HB2      TRP  86 -13.270  -4.329 -10.645
  703    HB3  TRP  86           HB3      TRP  86 -12.120  -4.501 -11.978
  704    HD1  TRP  86           HD1      TRP  86 -14.006  -6.586  -9.618
  705    HE1  TRP  86           HE1      TRP  86 -13.139  -8.969  -9.504
  706    HE3  TRP  86           HE3      TRP  86  -9.598  -5.932 -12.131
  707    HZ2  TRP  86           HZ2      TRP  86 -10.684 -10.386 -10.187
  708    HZ3  TRP  86           HZ3      TRP  86  -8.005  -7.820 -12.374
  709    HH2  TRP  86           HH2      TRP  86  -8.530 -10.044 -11.396
  710    H    ASP  87           H        ASP  87 -12.267  -1.683  -9.089
  711    HA   ASP  87           HA       ASP  87 -12.150  -0.056 -11.457
  712    HB2  ASP  87           HB2      ASP  87 -13.934   0.131  -9.795
  713    HB3  ASP  87           HB3      ASP  87 -12.771   0.635  -8.566
  714    H    THR  88           H        THR  88  -9.889  -0.519  -8.802
  715    HA   THR  88           HA       THR  88  -8.542   2.025  -9.425
  716    HB   THR  88           HB       THR  88  -9.465   1.615  -7.105
  717    HG1  THR  88           HG1      THR  88  -7.803   2.770  -6.259
  718   HG21  THR  88          HG21      THR  88  -6.953  -0.068  -6.724
  719   HG22  THR  88          HG22      THR  88  -8.245   0.281  -5.542
  720   HG23  THR  88          HG23      THR  88  -8.573  -0.775  -6.919
  721    H    LYS  89           H        LYS  89  -6.137   1.972  -9.155
  722    HA   LYS  89           HA       LYS  89  -5.000  -0.397 -10.505
  723    HB2  LYS  89           HB2      LYS  89  -4.550   2.473 -11.313
  724    HB3  LYS  89           HB3      LYS  89  -3.800   1.023 -12.003
  725    HG2  LYS  89           HG2      LYS  89  -6.285   0.213 -12.377
  726    HG3  LYS  89           HG3      LYS  89  -6.696   1.923 -12.113
  727    HD2  LYS  89           HD2      LYS  89  -5.097   2.515 -13.979
  728    HD3  LYS  89           HD3      LYS  89  -4.728   0.789 -14.137
  729    HE2  LYS  89           HE2      LYS  89  -6.257   1.342 -15.902
  730    HE3  LYS  89           HE3      LYS  89  -7.113   0.334 -14.733
  731    HZ1  LYS  89           HZ1      LYS  89  -7.341   3.298 -14.917
  732    HZ2  LYS  89           HZ2      LYS  89  -8.438   2.233 -15.478
  733    HZ3  LYS  89           HZ3      LYS  89  -8.181   2.351 -13.874
  734    HA   PRO  90           HA       PRO  90  -3.447  -1.662 -10.519
  735    HB2  PRO  90           HB2      PRO  90  -1.872  -3.359  -9.181
  736    HB3  PRO  90           HB3      PRO  90  -1.215  -2.104 -10.293
  737    HG2  PRO  90           HG2      PRO  90  -1.484  -1.965  -7.276
  738    HG3  PRO  90           HG3      PRO  90  -0.017  -1.614  -8.247
  739    HD2  PRO  90           HD2      PRO  90  -1.726   0.357  -7.402
  740    HD3  PRO  90           HD3      PRO  90  -0.904   0.444  -8.989
  741    H    VAL  91           H        VAL  91  -4.936  -3.300 -10.111
  742    HA   VAL  91           HA       VAL  91  -6.395  -3.266  -7.598
  743    HB   VAL  91           HB       VAL  91  -7.699  -3.624  -9.554
  744   HG11  VAL  91          HG11      VAL  91  -7.344  -5.422 -11.225
  745   HG12  VAL  91          HG12      VAL  91  -6.053  -4.228 -11.234
  746   HG13  VAL  91          HG13      VAL  91  -5.791  -5.814 -10.466
  747   HG21  VAL  91          HG21      VAL  91  -8.741  -5.791  -9.255
  748   HG22  VAL  91          HG22      VAL  91  -7.290  -6.460  -8.491
  749   HG23  VAL  91          HG23      VAL  91  -8.232  -5.210  -7.657
  750    H    CYS  92           H        CYS  92  -6.186  -4.674  -5.899
  751    HA   CYS  92           HA       CYS  92  -4.042  -6.678  -6.115
  752    HB2  CYS  92           HB2      CYS  92  -4.238  -6.806  -3.638
  753    HB3  CYS  92           HB3      CYS  92  -3.769  -5.226  -4.290
  754    HG   CYS  92           HG       CYS  92  -6.884  -6.130  -3.543
  755    H    ILE  93           H        ILE  93  -4.424  -8.850  -5.828
  756    HA   ILE  93           HA       ILE  93  -7.270  -9.635  -5.365
  757    HB   ILE  93           HB       ILE  93  -7.186 -11.376  -6.815
  758   HG12  ILE  93          HG12      ILE  93  -5.044 -12.394  -6.358
  759   HG13  ILE  93          HG13      ILE  93  -5.316 -12.222  -8.087
  760   HG21  ILE  93          HG21      ILE  93  -7.470  -9.167  -7.873
  761   HG22  ILE  93          HG22      ILE  93  -5.740  -9.115  -8.282
  762   HG23  ILE  93          HG23      ILE  93  -6.788 -10.355  -8.991
  763   HD11  ILE  93          HD11      ILE  93  -3.770 -10.168  -8.007
  764   HD12  ILE  93          HD12      ILE  93  -3.383 -10.681  -6.339
  765   HD13  ILE  93          HD13      ILE  93  -3.035 -11.749  -7.705
  766    H    GLY  94           H        GLY  94  -4.172  -9.718  -4.003
  767    HA2  GLY  94           HA2      GLY  94  -5.261 -11.106  -1.746
  768    HA3  GLY  94           HA3      GLY  94  -4.020 -12.072  -2.565
  769    H    GLN  95           H        GLN  95  -3.353 -11.438  -0.159
  770    HA   GLN  95           HA       GLN  95  -1.106  -9.580  -0.412
  771    HB2  GLN  95           HB2      GLN  95  -1.580  -8.280   1.530
  772    HB3  GLN  95           HB3      GLN  95  -2.931  -8.125   0.407
  773    HG2  GLN  95           HG2      GLN  95  -2.942  -9.807   2.934
  774    HG3  GLN  95           HG3      GLN  95  -3.635  -8.202   2.755
  775   HE21  GLN  95          HE22      GLN  95  -4.081 -11.603   2.087
  776   HE22  GLN  95          HE21      GLN  95  -5.684 -11.479   1.387
  777    H    LYS  96           H        LYS  96   0.579 -10.059   1.087
  778    HA   LYS  96           HA       LYS  96   0.336 -12.755   2.403
  779    HB2  LYS  96           HB2      LYS  96   2.749 -11.005   1.679
  780    HB3  LYS  96           HB3      LYS  96   2.831 -12.548   2.537
  781    HG2  LYS  96           HG2      LYS  96   1.997 -13.764   0.622
  782    HG3  LYS  96           HG3      LYS  96   1.710 -12.256  -0.261
  783    HD2  LYS  96           HD2      LYS  96   3.766 -13.384  -1.012
  784    HD3  LYS  96           HD3      LYS  96   4.077 -11.770  -0.381
  785    HE2  LYS  96           HE2      LYS  96   4.989 -12.707   1.729
  786    HE3  LYS  96           HE3      LYS  96   4.528 -14.338   1.237
  787    HZ1  LYS  96           HZ1      LYS  96   6.543 -12.642  -0.158
  788    HZ2  LYS  96           HZ2      LYS  96   6.874 -13.914   0.816
  789    HZ3  LYS  96           HZ3      LYS  96   6.122 -14.158  -0.612
  790    H    GLN  97           H        GLN  97   0.191 -12.730   4.674
  791    HA   GLN  97           HA       GLN  97   0.822 -10.157   6.045
  792    HB2  GLN  97           HB2      GLN  97  -1.012 -12.360   7.019
  793    HB3  GLN  97           HB3      GLN  97  -0.710 -10.777   7.754
  794    HG2  GLN  97           HG2      GLN  97  -1.607  -9.800   5.516
  795    HG3  GLN  97           HG3      GLN  97  -2.234 -11.419   5.213
  796   HE21  GLN  97          HE22      GLN  97  -2.473  -8.534   7.286
  797   HE22  GLN  97          HE21      GLN  97  -4.061  -8.903   7.916
  798    H    LYS  98           H        LYS  98   2.583 -10.181   7.353
  799    HA   LYS  98           HA       LYS  98   3.554 -12.807   8.437
  800    HB2  LYS  98           HB2      LYS  98   5.104 -11.515   7.018
  801    HB3  LYS  98           HB3      LYS  98   4.985 -10.128   8.123
  802    HG2  LYS  98           HG2      LYS  98   6.406 -11.084   9.601
  803    HG3  LYS  98           HG3      LYS  98   5.829 -12.740   9.336
  804    HD2  LYS  98           HD2      LYS  98   7.515 -11.246   7.311
  805    HD3  LYS  98           HD3      LYS  98   8.267 -12.100   8.644
  806    HE2  LYS  98           HE2      LYS  98   6.326 -13.553   6.779
  807    HE3  LYS  98           HE3      LYS  98   7.958 -13.198   6.261
  808    HZ1  LYS  98           HZ1      LYS  98   7.875 -15.387   7.274
  809    HZ2  LYS  98           HZ2      LYS  98   8.861 -14.430   8.135
  810    HZ3  LYS  98           HZ3      LYS  98   7.373 -14.802   8.721
  811    H    TRP  99           H        TRP  99   3.126 -13.118  10.599
  812    HA   TRP  99           HA       TRP  99   2.062 -10.779  12.079
  813    HB2  TRP  99           HB2      TRP  99   1.526 -13.736  12.344
  814    HB3  TRP  99           HB3      TRP  99   0.963 -12.510  13.478
  815    HD1  TRP  99           HD1      TRP  99   0.399 -13.670   9.869
  816    HE1  TRP  99           HE1      TRP  99  -1.861 -12.750   9.060
  817    HE3  TRP  99           HE3      TRP  99  -0.667 -10.612  13.814
  818    HZ2  TRP  99           HZ2      TRP  99  -3.753 -10.728   9.905
  819    HZ3  TRP  99           HZ3      TRP  99  -2.590  -9.061  13.713
  820    HH2  TRP  99           HH2      TRP  99  -4.159  -9.131  11.787
  821    H    PHE 100           H        PHE 100   2.699 -10.398  14.197
  822    HA   PHE 100           HA       PHE 100   5.137 -11.805  15.185
  823    HB2  PHE 100           HB2      PHE 100   4.514  -8.824  15.073
  824    HB3  PHE 100           HB3      PHE 100   5.837  -9.520  15.992
  825    HD1  PHE 100           HD2      PHE 100   4.516  -9.060  12.491
  826    HD2  PHE 100           HD1      PHE 100   7.956  -9.925  14.973
  827    HE1  PHE 100           HE2      PHE 100   6.001  -8.880  10.539
  828    HE2  PHE 100           HE1      PHE 100   9.421  -9.767  12.998
  829    HZ   PHE 100           HZ       PHE 100   8.460  -9.269  10.775
  830    H    LEU 101           H        LEU 101   4.923 -12.393  17.327
  831    HA   LEU 101           HA       LEU 101   2.598 -11.379  18.887
  832    HB2  LEU 101           HB2      LEU 101   3.300 -13.896  18.737
  833    HB3  LEU 101           HB3      LEU 101   4.636 -13.452  19.776
  834    HG   LEU 101           HG       LEU 101   1.796 -13.922  20.323
  835   HD11  LEU 101          HD11      LEU 101   3.868 -15.301  21.133
  836   HD12  LEU 101          HD12      LEU 101   4.076 -14.015  22.334
  837   HD13  LEU 101          HD13      LEU 101   2.580 -14.969  22.274
  838   HD21  LEU 101          HD21      LEU 101   1.802 -11.503  20.922
  839   HD22  LEU 101          HD22      LEU 101   1.500 -12.591  22.240
  840   HD23  LEU 101          HD23      LEU 101   3.109 -11.829  22.101
  841    H    LEU 102           H        LEU 102   3.102  -9.664  20.272
  842    HA   LEU 102           HA       LEU 102   5.911  -9.538  21.235
  843    HB2  LEU 102           HB2      LEU 102   4.257  -7.047  21.133
  844    HB3  LEU 102           HB3      LEU 102   5.988  -7.209  21.168
  845    HG   LEU 102           HG       LEU 102   4.245  -7.805  18.753
  846   HD11  LEU 102          HD11      LEU 102   4.239  -5.400  19.496
  847   HD12  LEU 102          HD12      LEU 102   6.007  -5.381  19.236
  848   HD13  LEU 102          HD13      LEU 102   4.902  -5.673  17.884
  849   HD21  LEU 102          HD21      LEU 102   6.365  -9.001  18.585
  850   HD22  LEU 102          HD22      LEU 102   6.403  -7.615  17.494
  851   HD23  LEU 102          HD23      LEU 102   7.266  -7.532  19.045
  852    H    GLN 103           H        GLN 103   6.118  -9.012  23.493
  853    HA   GLN 103           HA       GLN 103   3.511  -9.093  24.973
  854    HB2  GLN 103           HB2      GLN 103   4.768 -10.677  25.758
  855    HB3  GLN 103           HB3      GLN 103   6.297  -9.783  25.767
  856    HG2  GLN 103           HG2      GLN 103   5.809  -8.879  27.877
  857    HG3  GLN 103           HG3      GLN 103   4.111  -8.607  27.489
  858   HE21  GLN 103          HE22      GLN 103   2.567 -10.438  27.577
  859   HE22  GLN 103          HE21      GLN 103   2.932 -11.779  28.654
  860    H    LEU 104           H        LEU 104   2.758  -7.153  25.833
  861    HA   LEU 104           HA       LEU 104   3.934  -4.596  25.362
  862    HB2  LEU 104           HB2      LEU 104   1.445  -5.627  26.192
  863    HB3  LEU 104           HB3      LEU 104   2.073  -5.020  27.684
  864    HG   LEU 104           HG       LEU 104   0.872  -3.258  27.062
  865   HD11  LEU 104          HD11      LEU 104   3.293  -2.508  25.388
  866   HD12  LEU 104          HD12      LEU 104   2.109  -1.417  26.126
  867   HD13  LEU 104          HD13      LEU 104   3.171  -2.363  27.160
  868   HD21  LEU 104          HD21      LEU 104   1.335  -3.798  24.133
  869   HD22  LEU 104          HD22      LEU 104  -0.143  -4.102  25.106
  870   HD23  LEU 104          HD23      LEU 104   0.377  -2.453  24.805
  871    H    VAL 105           H        VAL 105   5.394  -3.401  26.745
  872    HA   VAL 105           HA       VAL 105   6.756  -5.052  28.744
  873    HB   VAL 105           HB       VAL 105   7.356  -2.356  27.551
  874   HG11  VAL 105          HG11      VAL 105   9.100  -4.011  29.415
  875   HG12  VAL 105          HG12      VAL 105   9.641  -2.589  28.489
  876   HG13  VAL 105          HG13      VAL 105   8.417  -2.401  29.745
  877   HG21  VAL 105          HG21      VAL 105   8.862  -4.965  27.149
  878   HG22  VAL 105          HG22      VAL 105   7.559  -4.462  26.073
  879   HG23  VAL 105          HG23      VAL 105   9.005  -3.464  26.194
  880    H    SER 106           H        SER 106   5.420  -1.701  28.787
  881    HA   SER 106           HA       SER 106   5.411  -1.615  31.695
  882    HB2  SER 106           HB2      SER 106   4.129   0.151  29.568
  883    HB3  SER 106           HB3      SER 106   4.155   0.514  31.302
  884    HG   SER 106           HG       SER 106   6.271   0.460  29.445
  885    H    GLY 107           H        GLY 107   3.183  -2.751  29.254
  886    HA2  GLY 107           HA2      GLY 107   1.299  -4.183  29.918
  887    HA3  GLY 107           HA3      GLY 107   1.023  -3.119  31.301
  888    H    ASP 108           H        ASP 108  -1.086  -3.441  29.812
  889    HA   ASP 108           HA       ASP 108  -1.367  -2.284  27.346
  890    HB2  ASP 108           HB2      ASP 108  -3.629  -2.742  27.595
  891    HB3  ASP 108           HB3      ASP 108  -2.855  -3.905  28.655
  892    H    ALA 109           H        ALA 109  -1.258  -0.676  30.369
  893    HA   ALA 109           HA       ALA 109  -2.565   1.759  29.987
  894    HB1  ALA 109           HB1      ALA 109  -0.814   2.711  31.450
  895    HB2  ALA 109           HB2      ALA 109  -1.338   1.119  32.043
  896    HB3  ALA 109           HB3      ALA 109   0.208   1.285  31.167
  897    H    GLU 110           H        GLU 110   0.398   0.640  28.386
  898    HA   GLU 110           HA       GLU 110   0.987   3.298  27.433
  899    HB2  GLU 110           HB2      GLU 110   2.481   0.692  27.441
  900    HB3  GLU 110           HB3      GLU 110   3.003   1.941  26.309
  901    HG2  GLU 110           HG2      GLU 110   2.676   2.334  29.295
  902    HG3  GLU 110           HG3      GLU 110   4.201   2.002  28.466
  903    H    ILE 111           H        ILE 111  -1.394   2.007  26.486
  904    HA   ILE 111           HA       ILE 111  -0.957   1.967  23.533
  905    HB   ILE 111           HB       ILE 111  -3.313   0.995  25.193
  906   HG12  ILE 111          HG12      ILE 111  -1.610  -0.687  23.296
  907   HG13  ILE 111          HG13      ILE 111  -1.112  -0.444  24.990
  908   HG21  ILE 111          HG21      ILE 111  -4.147   0.127  22.950
  909   HG22  ILE 111          HG22      ILE 111  -4.194   1.881  23.118
  910   HG23  ILE 111          HG23      ILE 111  -2.888   1.112  22.187
  911   HD11  ILE 111          HD11      ILE 111  -3.736  -1.713  24.097
  912   HD12  ILE 111          HD12      ILE 111  -2.345  -2.527  24.847
  913   HD13  ILE 111          HD13      ILE 111  -3.306  -1.360  25.757
  914    H    ASN 112           H        ASN 112  -1.916   3.484  22.239
  915    HA   ASN 112           HA       ASN 112  -3.728   5.553  23.380
  916    HB2  ASN 112           HB2      ASN 112  -1.584   6.680  23.214
  917    HB3  ASN 112           HB3      ASN 112  -1.273   5.953  21.635
  918   HD21  ASN 112          HD22      ASN 112  -0.939   8.147  20.724
  919   HD22  ASN 112          HD21      ASN 112  -2.363   9.074  20.293
  920    H    MET 113           H        MET 113  -5.555   5.750  22.086
  921    HA   MET 113           HA       MET 113  -5.699   4.046  19.655
  922    HB2  MET 113           HB2      MET 113  -7.779   5.415  21.399
  923    HB3  MET 113           HB3      MET 113  -8.179   4.516  19.930
  924    HG2  MET 113           HG2      MET 113  -6.496   3.192  22.078
  925    HG3  MET 113           HG3      MET 113  -8.252   3.299  22.252
  926    HE1  MET 113           HE1      MET 113  -5.276   1.477  20.690
  927    HE2  MET 113           HE2      MET 113  -6.193   0.665  21.989
  928    HE3  MET 113           HE3      MET 113  -6.147  -0.043  20.361
  929    H    GLN 114           H        GLN 114  -5.111   7.346  20.327
  930    HA   GLN 114           HA       GLN 114  -6.188   8.187  17.723
  931    HB2  GLN 114           HB2      GLN 114  -6.351  10.457  18.585
  932    HB3  GLN 114           HB3      GLN 114  -7.584   9.323  19.130
  933    HG2  GLN 114           HG2      GLN 114  -6.502   9.114  21.339
  934    HG3  GLN 114           HG3      GLN 114  -5.195  10.183  20.827
  935   HE21  GLN 114          HE22      GLN 114  -5.749  12.493  20.330
  936   HE22  GLN 114          HE21      GLN 114  -7.142  13.210  21.106
  937    H    THR 115           H        THR 115  -4.442   7.276  17.028
  938    HA   THR 115           HA       THR 115  -1.733   8.148  17.465
  939    HB   THR 115           HB       THR 115  -1.614   6.677  15.302
  940    HG1  THR 115           HG1      THR 115  -3.418   5.376  14.976
  941   HG21  THR 115          HG21      THR 115  -2.798   5.600  17.956
  942   HG22  THR 115          HG22      THR 115  -1.965   4.599  16.741
  943   HG23  THR 115          HG23      THR 115  -1.076   5.862  17.614
  944    H    SER 116           H        SER 116  -3.920   8.155  14.727
  945    HA   SER 116           HA       SER 116  -2.978  10.684  13.579
  946    HB2  SER 116           HB2      SER 116  -5.379   8.941  12.879
  947    HB3  SER 116           HB3      SER 116  -4.710  10.254  11.895
  948    HG   SER 116           HG       SER 116  -3.920   8.253  11.165
  949    H    SER 117           H        SER 117  -4.850  12.379  13.044
  950    HA   SER 117           HA       SER 117  -5.910  13.432  15.432
  951    HB2  SER 117           HB2      SER 117  -6.975  13.869  12.616
  952    HB3  SER 117           HB3      SER 117  -7.086  14.979  13.994
  953    HG   SER 117           HG       SER 117  -5.378  15.546  12.545
  954    H    THR 118           H        THR 118  -7.283  11.151  13.067
  955    HA   THR 118           HA       THR 118  -9.809  10.838  14.469
  956    HB   THR 118           HB       THR 118  -9.556   8.809  12.687
  957    HG1  THR 118           HG1      THR 118  -8.801   9.678  10.769
  958   HG21  THR 118          HG21      THR 118 -11.228  10.037  11.382
  959   HG22  THR 118          HG22      THR 118 -11.537  10.094  13.123
  960   HG23  THR 118          HG23      THR 118 -10.848  11.519  12.300
  961    HA   PRO 119           HA       PRO 119  -8.003   7.505  16.910
  962    HB2  PRO 119           HB2      PRO 119 -10.861   6.597  17.087
  963    HB3  PRO 119           HB3      PRO 119  -9.659   6.809  18.395
  964    HG2  PRO 119           HG2      PRO 119 -11.664   8.631  17.982
  965    HG3  PRO 119           HG3      PRO 119 -10.011   9.158  18.441
  966    HD2  PRO 119           HD2      PRO 119 -11.283   9.154  15.691
  967    HD3  PRO 119           HD3      PRO 119 -10.228  10.387  16.460
  968    H    GLU 120           H        GLU 120  -7.057   5.806  15.782
  969    HA   GLU 120           HA       GLU 120  -8.186   5.056  13.244
  970    HB2  GLU 120           HB2      GLU 120  -5.724   4.188  14.789
  971    HB3  GLU 120           HB3      GLU 120  -6.213   3.312  13.338
  972    HG2  GLU 120           HG2      GLU 120  -5.717   6.318  13.415
  973    HG3  GLU 120           HG3      GLU 120  -4.542   5.115  12.883
  974    H    PHE 121           H        PHE 121  -8.452   3.695  16.419
  975    HA   PHE 121           HA       PHE 121 -10.069   1.464  15.299
  976    HB2  PHE 121           HB2      PHE 121  -8.740   1.729  17.993
  977    HB3  PHE 121           HB3      PHE 121  -9.888   0.477  17.576
  978    HD1  PHE 121           HD1      PHE 121  -9.213  -0.780  15.187
  979    HD2  PHE 121           HD2      PHE 121  -6.515   0.994  18.033
  980    HE1  PHE 121           HE1      PHE 121  -7.422  -2.316  14.442
  981    HE2  PHE 121           HE2      PHE 121  -4.767  -0.604  17.361
  982    HZ   PHE 121           HZ       PHE 121  -5.203  -2.252  15.546
  983    H    ASP 122           H        ASP 122 -12.180   1.338  15.958
  984    HA   ASP 122           HA       ASP 122 -13.412   3.722  17.219
  985    HB2  ASP 122           HB2      ASP 122 -14.541   2.761  15.282
  986    HB3  ASP 122           HB3      ASP 122 -14.550   1.166  16.029
  987    H    GLY 123           H        GLY 123 -12.342   0.426  17.954
  988    HA2  GLY 123           HA2      GLY 123 -13.126   0.731  20.783
  989    HA3  GLY 123           HA3      GLY 123 -13.813  -0.634  19.862
  990    H    TRP 124           H        TRP 124 -11.879  -0.649  22.146
  991    HA   TRP 124           HA       TRP 124 -10.048  -2.605  20.941
  992    HB2  TRP 124           HB2      TRP 124  -8.450  -1.011  20.879
  993    HB3  TRP 124           HB3      TRP 124  -9.212  -0.022  22.113
  994    HD1  TRP 124           HD1      TRP 124  -7.436  -3.495  22.205
  995    HE1  TRP 124           HE1      TRP 124  -6.077  -3.626  24.355
  996    HE3  TRP 124           HE3      TRP 124  -8.350   1.212  23.985
  997    HZ2  TRP 124           HZ2      TRP 124  -5.483  -1.862  26.632
  998    HZ3  TRP 124           HZ3      TRP 124  -7.330   1.980  26.109
  999    HH2  TRP 124           HH2      TRP 124  -5.901   0.438  27.441
 1000    H    ARG 125           H        ARG 125  -9.666  -4.310  22.311
 1001    HA   ARG 125           HA       ARG 125 -10.606  -4.227  25.085
 1002    HB2  ARG 125           HB2      ARG 125 -12.206  -6.054  24.802
 1003    HB3  ARG 125           HB3      ARG 125 -12.667  -4.696  23.789
 1004    HG2  ARG 125           HG2      ARG 125 -11.552  -5.882  21.830
 1005    HG3  ARG 125           HG3      ARG 125 -11.356  -7.297  22.863
 1006    HD2  ARG 125           HD2      ARG 125 -14.043  -5.965  22.289
 1007    HD3  ARG 125           HD3      ARG 125 -13.361  -7.263  21.307
 1008    HE   ARG 125           HE       ARG 125 -13.538  -7.903  24.154
 1009   HH11  ARG 125          HH11      ARG 125 -15.430  -7.813  21.144
 1010   HH12  ARG 125          HH12      ARG 125 -16.528  -9.052  21.635
 1011   HH21  ARG 125          HH21      ARG 125 -14.996  -9.589  24.791
 1012   HH22  ARG 125          HH22      ARG 125 -16.230 -10.126  23.712
 1013    H    TRP 126           H        TRP 126 -10.200  -6.423  26.089
 1014    HA   TRP 126           HA       TRP 126  -7.957  -7.885  24.782
 1015    HB2  TRP 126           HB2      TRP 126  -8.291  -7.060  27.677
 1016    HB3  TRP 126           HB3      TRP 126  -7.362  -8.473  27.219
 1017    HD1  TRP 126           HD1      TRP 126  -7.255  -4.626  26.747
 1018    HE1  TRP 126           HE1      TRP 126  -4.828  -3.936  26.489
 1019    HE3  TRP 126           HE3      TRP 126  -5.126  -9.261  26.379
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.248  -5.207  26.193
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.680  -9.495  26.147
 1022    HH2  TRP 126           HH2      TRP 126  -1.219  -7.468  26.118
 1023    H    VAL 127           H        VAL 127  -8.212 -10.124  24.807
 1024    HA   VAL 127           HA       VAL 127 -10.812 -11.226  25.779
 1025    HB   VAL 127           HB       VAL 127 -10.620 -12.451  23.404
 1026   HG11  VAL 127          HG11      VAL 127 -12.564 -11.139  24.194
 1027   HG12  VAL 127          HG12      VAL 127 -11.735  -9.630  23.751
 1028   HG13  VAL 127          HG13      VAL 127 -12.223 -10.787  22.492
 1029   HG21  VAL 127          HG21      VAL 127  -9.431  -9.757  22.675
 1030   HG22  VAL 127          HG22      VAL 127  -8.574 -11.316  22.662
 1031   HG23  VAL 127          HG23      VAL 127  -9.946 -11.051  21.576
 1032    H    SER 128           H        SER 128 -10.781 -13.507  26.181
 1033    HA   SER 128           HA       SER 128  -8.404 -14.757  26.980
 1034    HB2  SER 128           HB2      SER 128 -10.923 -16.041  25.856
 1035    HB3  SER 128           HB3      SER 128  -9.742 -16.802  26.941
 1036    HG   SER 128           HG       SER 128 -11.579 -16.005  28.094
 1037    H    TYR 129           H        TYR 129  -6.903 -16.066  25.909
 1038    HA   TYR 129           HA       TYR 129  -5.964 -15.263  23.568
 1039    HB2  TYR 129           HB2      TYR 129  -4.903 -16.815  25.256
 1040    HB3  TYR 129           HB3      TYR 129  -5.719 -18.157  24.475
 1041    HD1  TYR 129           HD1      TYR 129  -5.064 -18.815  22.178
 1042    HD2  TYR 129           HD2      TYR 129  -3.041 -15.626  24.238
 1043    HE1  TYR 129           HE1      TYR 129  -3.327 -18.901  20.507
 1044    HE2  TYR 129           HE2      TYR 129  -1.394 -15.508  22.387
 1045    HH   TYR 129           HH       TYR 129  -0.683 -16.378  20.386
 1046    H    TRP 130           H        TRP 130  -8.027 -18.297  23.559
 1047    HA   TRP 130           HA       TRP 130  -7.846 -18.231  20.626
 1048    HB2  TRP 130           HB2      TRP 130  -8.977 -20.233  22.588
 1049    HB3  TRP 130           HB3      TRP 130  -9.130 -20.406  20.848
 1050    HD1  TRP 130           HD1      TRP 130  -6.488 -20.617  23.600
 1051    HE1  TRP 130           HE1      TRP 130  -4.448 -21.843  22.722
 1052    HE3  TRP 130           HE3      TRP 130  -7.666 -20.641  18.613
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.393 -22.664  20.201
 1054    HZ3  TRP 130           HZ3      TRP 130  -6.070 -21.624  16.980
 1055    HH2  TRP 130           HH2      TRP 130  -3.947 -22.652  17.780
 1056    H    TYR 131           H        TYR 131  -9.979 -16.729  22.752
 1057    HA   TYR 131           HA       TYR 131 -12.534 -17.277  21.702
 1058    HB2  TYR 131           HB2      TYR 131 -12.188 -16.149  23.790
 1059    HB3  TYR 131           HB3      TYR 131 -11.374 -14.807  23.011
 1060    HD1  TYR 131           HD1      TYR 131 -12.603 -13.081  21.758
 1061    HD2  TYR 131           HD2      TYR 131 -14.634 -16.276  23.834
 1062    HE1  TYR 131           HE1      TYR 131 -14.661 -11.721  21.838
 1063    HE2  TYR 131           HE2      TYR 131 -16.703 -14.922  23.897
 1064    HH   TYR 131           HH       TYR 131 -17.698 -12.854  23.387
 1065    HA   PRO 132           HA       PRO 132 -12.177 -13.379  18.915
 1066    HB2  PRO 132           HB2      PRO 132  -9.730 -12.667  17.815
 1067    HB3  PRO 132           HB3      PRO 132 -10.411 -12.040  19.349
 1068    HG2  PRO 132           HG2      PRO 132  -8.464 -14.330  19.012
 1069    HG3  PRO 132           HG3      PRO 132  -8.336 -12.900  20.099
 1070    HD2  PRO 132           HD2      PRO 132  -9.268 -15.183  21.041
 1071    HD3  PRO 132           HD3      PRO 132 -10.124 -13.678  21.465
 1072    H    VAL 133           H        VAL 133 -10.875 -16.449  18.203
 1073    HA   VAL 133           HA       VAL 133 -10.681 -16.103  15.298
 1074    HB   VAL 133           HB       VAL 133 -10.824 -18.665  16.941
 1075   HG11  VAL 133          HG11      VAL 133 -11.232 -19.006  14.518
 1076   HG12  VAL 133          HG12      VAL 133  -9.739 -18.128  14.124
 1077   HG13  VAL 133          HG13      VAL 133  -9.674 -19.684  14.986
 1078   HG21  VAL 133          HG21      VAL 133  -8.350 -17.102  16.044
 1079   HG22  VAL 133          HG22      VAL 133  -8.870 -17.373  17.721
 1080   HG23  VAL 133          HG23      VAL 133  -8.335 -18.736  16.745
 1081    H    ARG 134           H        ARG 134 -13.170 -16.824  17.746
 1082    HA   ARG 134           HA       ARG 134 -14.817 -18.395  15.973
 1083    HB2  ARG 134           HB2      ARG 134 -15.467 -16.912  18.562
 1084    HB3  ARG 134           HB3      ARG 134 -16.514 -18.103  17.797
 1085    HG2  ARG 134           HG2      ARG 134 -13.755 -18.636  18.993
 1086    HG3  ARG 134           HG3      ARG 134 -15.317 -19.034  19.709
 1087    HD2  ARG 134           HD2      ARG 134 -15.768 -20.547  17.724
 1088    HD3  ARG 134           HD3      ARG 134 -14.130 -20.208  17.162
 1089    HE   ARG 134           HE       ARG 134 -13.216 -21.514  18.803
 1090   HH11  ARG 134          HH11      ARG 134 -16.712 -21.231  19.456
 1091   HH12  ARG 134          HH12      ARG 134 -16.726 -22.486  20.644
 1092   HH21  ARG 134          HH21      ARG 134 -13.253 -23.188  20.375
 1093   HH22  ARG 134          HH22      ARG 134 -14.722 -23.611  21.176
 1094    H    GLN 135           H        GLN 135 -14.526 -14.926  16.476
 1095    HA   GLN 135           HA       GLN 135 -17.227 -14.437  15.460
 1096    HB2  GLN 135           HB2      GLN 135 -15.049 -12.484  16.294
 1097    HB3  GLN 135           HB3      GLN 135 -16.681 -12.050  15.836
 1098    HG2  GLN 135           HG2      GLN 135 -16.779 -12.072  18.176
 1099    HG3  GLN 135           HG3      GLN 135 -17.569 -13.560  17.682
 1100   HE21  GLN 135          HE22      GLN 135 -17.084 -14.094  20.075
 1101   HE22  GLN 135          HE21      GLN 135 -15.493 -14.735  20.434
 1102    H    VAL 136           H        VAL 136 -14.052 -14.529  13.896
 1103    HA   VAL 136           HA       VAL 136 -14.874 -12.651  11.837
 1104    HB   VAL 136           HB       VAL 136 -12.711 -13.105  10.890
 1105   HG11  VAL 136          HG11      VAL 136 -12.450 -12.751  13.898
 1106   HG12  VAL 136          HG12      VAL 136 -11.331 -12.197  12.644
 1107   HG13  VAL 136          HG13      VAL 136 -12.943 -11.481  12.761
 1108   HG21  VAL 136          HG21      VAL 136 -12.209 -15.137  13.085
 1109   HG22  VAL 136          HG22      VAL 136 -12.445 -15.502  11.356
 1110   HG23  VAL 136          HG23      VAL 136 -11.041 -14.557  11.889
 1111    H    VAL 137           H        VAL 137 -14.466 -13.473   9.415
 1112    HA   VAL 137           HA       VAL 137 -16.423 -15.628   8.963
 1113    HB   VAL 137           HB       VAL 137 -16.614 -14.908   6.782
 1114   HG11  VAL 137          HG11      VAL 137 -15.874 -12.276   8.125
 1115   HG12  VAL 137          HG12      VAL 137 -16.996 -12.555   6.782
 1116   HG13  VAL 137          HG13      VAL 137 -17.391 -13.164   8.395
 1117   HG21  VAL 137          HG21      VAL 137 -14.896 -13.322   5.697
 1118   HG22  VAL 137          HG22      VAL 137 -13.785 -13.836   7.006
 1119   HG23  VAL 137          HG23      VAL 137 -14.482 -15.031   5.890
 1120    H    SER 138           H        SER 138 -15.799 -17.200   7.100
 1121    HA   SER 138           HA       SER 138 -14.075 -19.048   8.122
 1122    HB2  SER 138           HB2      SER 138 -14.955 -18.739   5.232
 1123    HB3  SER 138           HB3      SER 138 -14.552 -20.261   6.067
 1124    HG   SER 138           HG       SER 138 -16.836 -19.869   6.005
 1125    H    PHE 139           H        PHE 139 -13.278 -16.924   5.245
 1126    HA   PHE 139           HA       PHE 139 -10.743 -18.227   4.928
 1127    HB2  PHE 139           HB2      PHE 139 -10.263 -16.628   3.230
 1128    HB3  PHE 139           HB3      PHE 139 -11.912 -17.181   3.064
 1129    HD1  PHE 139           HD1      PHE 139  -9.734 -14.298   3.933
 1130    HD2  PHE 139           HD2      PHE 139 -13.799 -15.607   3.256
 1131    HE1  PHE 139           HE1      PHE 139 -10.481 -11.942   3.769
 1132    HE2  PHE 139           HE2      PHE 139 -14.519 -13.249   3.054
 1133    HZ   PHE 139           HZ       PHE 139 -12.865 -11.409   3.315
 1134    H    LYS 140           H        LYS 140 -11.705 -15.271   6.671
 1135    HA   LYS 140           HA       LYS 140  -8.963 -14.595   7.429
 1136    HB2  LYS 140           HB2      LYS 140 -11.625 -13.774   8.667
 1137    HB3  LYS 140           HB3      LYS 140 -10.037 -13.111   9.109
 1138    HG2  LYS 140           HG2      LYS 140  -9.699 -12.434   6.703
 1139    HG3  LYS 140           HG3      LYS 140 -11.364 -12.921   6.371
 1140    HD2  LYS 140           HD2      LYS 140 -10.501 -10.753   8.327
 1141    HD3  LYS 140           HD3      LYS 140 -11.141 -10.495   6.693
 1142    HE2  LYS 140           HE2      LYS 140 -13.260 -11.653   7.368
 1143    HE3  LYS 140           HE3      LYS 140 -12.645 -11.781   9.024
 1144    HZ1  LYS 140           HZ1      LYS 140 -14.090  -9.805   8.725
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.572  -9.308   9.080
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.133  -9.222   7.544
 1147    H    ARG 141           H        ARG 141 -11.631 -16.426   8.955
 1148    HA   ARG 141           HA       ARG 141 -10.444 -17.142  11.364
 1149    HB2  ARG 141           HB2      ARG 141 -12.496 -18.324   9.618
 1150    HB3  ARG 141           HB3      ARG 141 -11.556 -19.596  10.342
 1151    HG2  ARG 141           HG2      ARG 141 -12.548 -19.351  12.340
 1152    HG3  ARG 141           HG3      ARG 141 -12.222 -17.622  12.355
 1153    HD2  ARG 141           HD2      ARG 141 -14.569 -17.848  12.484
 1154    HD3  ARG 141           HD3      ARG 141 -14.161 -17.258  10.864
 1155    HE   ARG 141           HE       ARG 141 -14.338 -20.118  10.849
 1156   HH11  ARG 141          HH11      ARG 141 -16.457 -17.270  11.138
 1157   HH12  ARG 141          HH12      ARG 141 -17.861 -18.087  10.524
 1158   HH21  ARG 141          HH21      ARG 141 -16.185 -21.177   9.958
 1159   HH22  ARG 141          HH22      ARG 141 -17.684 -20.336   9.796
 1160    H    ASP 142           H        ASP 142  -9.745 -18.703   8.186
 1161    HA   ASP 142           HA       ASP 142  -8.057 -20.666   9.305
 1162    HB2  ASP 142           HB2      ASP 142  -8.869 -20.778   6.992
 1163    HB3  ASP 142           HB3      ASP 142  -7.797 -19.439   6.548
 1164    H    VAL 143           H        VAL 143  -7.246 -17.390   8.093
 1165    HA   VAL 143           HA       VAL 143  -4.456 -17.562   8.751
 1166    HB   VAL 143           HB       VAL 143  -6.380 -15.219   8.378
 1167   HG11  VAL 143          HG11      VAL 143  -3.369 -15.111   8.785
 1168   HG12  VAL 143          HG12      VAL 143  -4.366 -13.768   8.173
 1169   HG13  VAL 143          HG13      VAL 143  -4.606 -14.365   9.818
 1170   HG21  VAL 143          HG21      VAL 143  -5.973 -16.502   6.327
 1171   HG22  VAL 143          HG22      VAL 143  -5.128 -14.958   6.236
 1172   HG23  VAL 143          HG23      VAL 143  -4.221 -16.439   6.595
 1173    H    TYR 144           H        TYR 144  -7.286 -16.297  10.612
 1174    HA   TYR 144           HA       TYR 144  -5.724 -15.327  12.758
 1175    HB2  TYR 144           HB2      TYR 144  -8.647 -16.038  12.433
 1176    HB3  TYR 144           HB3      TYR 144  -8.007 -15.629  14.011
 1177    HD1  TYR 144           HD1      TYR 144  -7.151 -14.029  10.666
 1178    HD2  TYR 144           HD2      TYR 144  -8.969 -13.573  14.564
 1179    HE1  TYR 144           HE1      TYR 144  -7.384 -11.624  10.268
 1180    HE2  TYR 144           HE2      TYR 144  -9.200 -11.141  14.154
 1181    HH   TYR 144           HH       TYR 144  -8.215  -9.590  11.078
 1182    H    ARG 145           H        ARG 145  -7.182 -18.615  12.274
 1183    HA   ARG 145           HA       ARG 145  -6.303 -19.438  14.903
 1184    HB2  ARG 145           HB2      ARG 145  -7.111 -21.538  14.455
 1185    HB3  ARG 145           HB3      ARG 145  -8.115 -20.507  13.448
 1186    HG2  ARG 145           HG2      ARG 145  -6.138 -21.183  11.658
 1187    HG3  ARG 145           HG3      ARG 145  -6.121 -22.613  12.693
 1188    HD2  ARG 145           HD2      ARG 145  -8.590 -22.820  12.288
 1189    HD3  ARG 145           HD3      ARG 145  -8.489 -21.344  11.317
 1190    HE   ARG 145           HE       ARG 145  -7.240 -22.460   9.615
 1191   HH11  ARG 145          HH11      ARG 145  -8.312 -24.829  12.076
 1192   HH12  ARG 145          HH12      ARG 145  -8.147 -26.167  10.995
 1193   HH21  ARG 145          HH21      ARG 145  -7.076 -24.087   8.280
 1194   HH22  ARG 145          HH22      ARG 145  -7.392 -25.753   8.732
 1195    H    ARG 146           H        ARG 146  -4.651 -19.506  11.656
 1196    HA   ARG 146           HA       ARG 146  -2.356 -20.885  12.691
 1197    HB2  ARG 146           HB2      ARG 146  -2.894 -19.085  10.278
 1198    HB3  ARG 146           HB3      ARG 146  -1.230 -19.405  10.770
 1199    HG2  ARG 146           HG2      ARG 146  -1.558 -21.042   9.217
 1200    HG3  ARG 146           HG3      ARG 146  -1.826 -21.901  10.735
 1201    HD2  ARG 146           HD2      ARG 146  -4.297 -21.742  10.358
 1202    HD3  ARG 146           HD3      ARG 146  -3.981 -20.813   8.891
 1203    HE   ARG 146           HE       ARG 146  -3.471 -22.646   7.717
 1204   HH11  ARG 146          HH21      ARG 146  -3.666 -23.708  11.129
 1205   HH12  ARG 146          HH22      ARG 146  -3.651 -25.382  10.726
 1206   HH21  ARG 146          HH11      ARG 146  -3.402 -24.861   7.225
 1207   HH22  ARG 146          HH12      ARG 146  -3.482 -26.054   8.469
 1208    H    VAL 147           H        VAL 147  -3.117 -17.338  12.580
 1209    HA   VAL 147           HA       VAL 147  -0.726 -16.408  13.666
 1210    HB   VAL 147           HB       VAL 147  -3.592 -15.402  14.041
 1211   HG11  VAL 147          HG11      VAL 147  -0.993 -13.936  14.621
 1212   HG12  VAL 147          HG12      VAL 147  -2.604 -13.179  14.536
 1213   HG13  VAL 147          HG13      VAL 147  -2.268 -14.365  15.793
 1214   HG21  VAL 147          HG21      VAL 147  -2.857 -15.371  11.694
 1215   HG22  VAL 147          HG22      VAL 147  -2.924 -13.733  12.310
 1216   HG23  VAL 147          HG23      VAL 147  -1.355 -14.570  12.163
 1217    H    MET 148           H        MET 148  -3.484 -17.847  15.292
 1218    HA   MET 148           HA       MET 148  -2.637 -17.297  17.997
 1219    HB2  MET 148           HB2      MET 148  -4.782 -19.097  16.837
 1220    HB3  MET 148           HB3      MET 148  -4.499 -18.899  18.564
 1221    HG2  MET 148           HG2      MET 148  -5.095 -16.546  16.722
 1222    HG3  MET 148           HG3      MET 148  -6.323 -17.505  17.527
 1223    HE1  MET 148           HE1      MET 148  -2.934 -15.361  18.697
 1224    HE2  MET 148           HE2      MET 148  -4.098 -14.499  17.654
 1225    HE3  MET 148           HE3      MET 148  -3.961 -14.090  19.379
 1226    H    LYS 149           H        LYS 149  -2.876 -20.360  16.006
 1227    HA   LYS 149           HA       LYS 149  -1.611 -21.936  17.946
 1228    HB2  LYS 149           HB2      LYS 149  -1.816 -23.651  16.549
 1229    HB3  LYS 149           HB3      LYS 149  -2.988 -22.544  15.848
 1230    HG2  LYS 149           HG2      LYS 149  -2.043 -23.414  13.996
 1231    HG3  LYS 149           HG3      LYS 149  -1.180 -21.876  14.170
 1232    HD2  LYS 149           HD2      LYS 149   0.816 -22.917  14.811
 1233    HD3  LYS 149           HD3      LYS 149  -0.007 -24.408  15.319
 1234    HE2  LYS 149           HE2      LYS 149  -0.552 -24.881  12.921
 1235    HE3  LYS 149           HE3      LYS 149   0.326 -23.423  12.440
 1236    HZ1  LYS 149           HZ1      LYS 149   1.530 -25.784  13.795
 1237    HZ2  LYS 149           HZ2      LYS 149   1.700 -25.405  12.219
 1238    HZ3  LYS 149           HZ3      LYS 149   2.357 -24.431  13.355
 1239    H    GLU 150           H        GLU 150  -0.136 -20.043  15.373
 1240    HA   GLU 150           HA       GLU 150   2.416 -21.049  15.431
 1241    HB2  GLU 150           HB2      GLU 150   1.121 -18.386  14.810
 1242    HB3  GLU 150           HB3      GLU 150   2.890 -18.426  14.891
 1243    HG2  GLU 150           HG2      GLU 150   1.391 -20.367  13.174
 1244    HG3  GLU 150           HG3      GLU 150   1.857 -18.737  12.690
 1245    H    PHE 151           H        PHE 151   0.917 -18.661  17.564
 1246    HA   PHE 151           HA       PHE 151   3.495 -18.313  19.027
 1247    HB2  PHE 151           HB2      PHE 151   1.099 -16.486  19.034
 1248    HB3  PHE 151           HB3      PHE 151   2.742 -16.153  19.548
 1249    HD1  PHE 151           HD2      PHE 151   4.114 -17.362  16.852
 1250    HD2  PHE 151           HD1      PHE 151   0.927 -14.538  17.659
 1251    HE1  PHE 151           HE2      PHE 151   4.360 -16.434  14.664
 1252    HE2  PHE 151           HE1      PHE 151   1.335 -13.489  15.477
 1253    HZ   PHE 151           HZ       PHE 151   3.041 -14.459  13.930
 1254    H    ALA 152           H        ALA 152   0.384 -19.699  19.370
 1255    HA   ALA 152           HA       ALA 152  -0.448 -19.288  21.934
 1256    HB1  ALA 152           HB1      ALA 152  -1.702 -20.654  20.281
 1257    HB2  ALA 152           HB2      ALA 152  -0.437 -21.881  20.271
 1258    HB3  ALA 152           HB3      ALA 152  -1.418 -21.623  21.734
 1259    H    SER 153           H        SER 153   2.032 -21.527  20.827
 1260    HA   SER 153           HA       SER 153   2.371 -22.885  23.309
 1261    HB2  SER 153           HB2      SER 153   4.341 -22.641  20.995
 1262    HB3  SER 153           HB3      SER 153   4.262 -23.949  22.190
 1263    HG   SER 153           HG       SER 153   3.223 -24.556  20.236
 1264    H    VAL 154           H        VAL 154   3.785 -19.909  21.993
 1265    HA   VAL 154           HA       VAL 154   5.925 -19.776  23.959
 1266    HB   VAL 154           HB       VAL 154   4.606 -17.529  22.378
 1267   HG11  VAL 154          HG11      VAL 154   5.859 -16.683  24.337
 1268   HG12  VAL 154          HG12      VAL 154   7.278 -17.639  23.843
 1269   HG13  VAL 154          HG13      VAL 154   6.696 -16.313  22.816
 1270   HG21  VAL 154          HG21      VAL 154   5.538 -19.102  20.781
 1271   HG22  VAL 154          HG22      VAL 154   6.662 -17.749  20.914
 1272   HG23  VAL 154          HG23      VAL 154   7.027 -19.270  21.741
 1273    H    VAL 155           H        VAL 155   2.577 -18.521  23.694
 1274    HA   VAL 155           HA       VAL 155   2.773 -16.926  26.008
 1275    HB   VAL 155           HB       VAL 155   0.242 -18.126  24.822
 1276   HG11  VAL 155          HG11      VAL 155  -0.226 -17.312  27.085
 1277   HG12  VAL 155          HG12      VAL 155   0.748 -15.847  26.818
 1278   HG13  VAL 155          HG13      VAL 155  -0.803 -16.087  25.958
 1279   HG21  VAL 155          HG21      VAL 155   0.144 -15.724  23.883
 1280   HG22  VAL 155          HG22      VAL 155   1.837 -15.562  24.366
 1281   HG23  VAL 155          HG23      VAL 155   1.348 -16.787  23.152
 1282    H    MET 156           H        MET 156   1.713 -20.390  25.774
 1283    HA   MET 156           HA       MET 156   0.756 -20.596  28.339
 1284    HB2  MET 156           HB2      MET 156   2.540 -22.629  26.874
 1285    HB3  MET 156           HB3      MET 156   1.439 -23.028  28.201
 1286    HG2  MET 156           HG2      MET 156   0.684 -22.099  25.422
 1287    HG3  MET 156           HG3      MET 156   0.384 -23.676  26.119
 1288    HE1  MET 156           HE1      MET 156  -1.401 -20.838  24.820
 1289    HE2  MET 156           HE2      MET 156  -1.940 -22.530  24.645
 1290    HE3  MET 156           HE3      MET 156  -2.986 -21.333  25.449
 1291    H    SER 157           H        SER 157   4.095 -20.913  27.247
 1292    HA   SER 157           HA       SER 157   5.138 -21.395  29.892
 1293    HB2  SER 157           HB2      SER 157   6.144 -21.154  27.063
 1294    HB3  SER 157           HB3      SER 157   7.317 -21.270  28.420
 1295    HG   SER 157           HG       SER 157   6.771 -23.332  27.549
 1296    H    LEU 158           H        LEU 158   4.666 -18.566  27.857
 1297    HA   LEU 158           HA       LEU 158   6.326 -16.728  29.257
 1298    HB2  LEU 158           HB2      LEU 158   5.145 -16.458  26.978
 1299    HB3  LEU 158           HB3      LEU 158   3.631 -16.299  27.877
 1300    HG   LEU 158           HG       LEU 158   4.641 -14.264  29.029
 1301   HD11  LEU 158          HD11      LEU 158   6.581 -14.558  26.686
 1302   HD12  LEU 158          HD12      LEU 158   6.441 -13.136  27.757
 1303   HD13  LEU 158          HD13      LEU 158   6.998 -14.687  28.401
 1304   HD21  LEU 158          HD21      LEU 158   2.876 -14.107  27.467
 1305   HD22  LEU 158          HD22      LEU 158   4.100 -12.923  26.882
 1306   HD23  LEU 158          HD23      LEU 158   3.945 -14.491  26.087
 1307    H    GLN 159           H        GLN 159   2.922 -17.744  29.670
 1308    HA   GLN 159           HA       GLN 159   2.340 -16.110  31.935
 1309    HB2  GLN 159           HB2      GLN 159   1.204 -18.909  31.508
 1310    HB3  GLN 159           HB3      GLN 159   0.528 -17.603  32.463
 1311    HG2  GLN 159           HG2      GLN 159   0.207 -16.324  30.232
 1312    HG3  GLN 159           HG3      GLN 159   0.608 -17.863  29.455
 1313   HE21  GLN 159          HE22      GLN 159  -1.545 -16.916  32.208
 1314   HE22  GLN 159          HE21      GLN 159  -2.880 -17.938  31.681
 1315    H    GLU 160           H        GLU 160   3.777 -19.355  31.742
 1316    HA   GLU 160           HA       GLU 160   3.631 -19.839  34.518
 1317    HB2  GLU 160           HB2      GLU 160   5.137 -21.168  32.246
 1318    HB3  GLU 160           HB3      GLU 160   5.222 -21.780  33.896
 1319    HG2  GLU 160           HG2      GLU 160   2.564 -21.291  32.542
 1320    HG3  GLU 160           HG3      GLU 160   3.462 -22.794  32.302
 1321    H    ASN 161           H        ASN 161   6.147 -18.384  32.520
 1322    HA   ASN 161           HA       ASN 161   8.193 -18.778  34.655
 1323    HB2  ASN 161           HB2      ASN 161   8.307 -18.017  31.722
 1324    HB3  ASN 161           HB3      ASN 161   9.689 -17.825  32.795
 1325   HD21  ASN 161          HD22      ASN 161   7.614 -20.225  31.229
 1326   HD22  ASN 161          HD21      ASN 161   8.637 -21.612  31.580
 1327    H    THR 162           H        THR 162   6.058 -16.298  33.479
 1328    HA   THR 162           HA       THR 162   6.158 -14.100  33.214
 1329    HB   THR 162           HB       THR 162   5.942 -13.131  35.329
 1330    HG1  THR 162           HG1      THR 162   7.826 -14.045  36.397
 1331   HG21  THR 162          HG21      THR 162   4.263 -14.815  34.593
 1332   HG22  THR 162          HG22      THR 162   5.076 -16.015  35.610
 1333   HG23  THR 162          HG23      THR 162   4.318 -14.583  36.354
 1334    HA   PRO 163           HA       PRO 163  10.644 -14.343  32.816
 1335    HB2  PRO 163           HB2      PRO 163  10.259 -13.354  29.987
 1336    HB3  PRO 163           HB3      PRO 163  11.338 -14.643  30.606
 1337    HG2  PRO 163           HG2      PRO 163   9.006 -15.288  29.384
 1338    HG3  PRO 163           HG3      PRO 163   9.502 -16.147  30.875
 1339    HD2  PRO 163           HD2      PRO 163   7.665 -13.723  30.670
 1340    HD3  PRO 163           HD3      PRO 163   7.329 -15.303  31.443
 1341    H    LYS 164           H        LYS 164  12.405 -12.711  32.057
 1342    HA   LYS 164           HA       LYS 164  11.651 -10.097  33.114
 1343    HB2  LYS 164           HB2      LYS 164  14.400 -10.946  32.132
 1344    HB3  LYS 164           HB3      LYS 164  14.009  -9.683  33.301
 1345    HG2  LYS 164           HG2      LYS 164  13.771 -12.704  33.712
 1346    HG3  LYS 164           HG3      LYS 164  15.008 -11.657  34.393
 1347    HD2  LYS 164           HD2      LYS 164  13.427 -10.546  35.841
 1348    HD3  LYS 164           HD3      LYS 164  12.039 -11.314  35.040
 1349    HE2  LYS 164           HE2      LYS 164  12.779 -13.537  35.736
 1350    HE3  LYS 164           HE3      LYS 164  14.221 -12.848  36.511
 1351    HZ1  LYS 164           HZ1      LYS 164  12.754 -11.673  38.051
 1352    HZ2  LYS 164           HZ2      LYS 164  11.419 -12.311  37.339
 1353    HZ3  LYS 164           HZ3      LYS 164  12.477 -13.276  38.130
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1   0.356  -0.242  -1.519
    2    H2   MET   1           H2       MET   1   1.080   1.111  -2.111
    3    H3   MET   1           H3       MET   1  -0.036   0.317  -3.006
    4    HA   MET   1           HA       MET   1   2.139  -0.150  -3.870
    5    HB2  MET   1           HB2      MET   1   3.200   0.191  -1.532
    6    HB3  MET   1           HB3      MET   1   2.802  -1.490  -1.198
    7    HG2  MET   1           HG2      MET   1   4.555  -0.448  -3.461
    8    HG3  MET   1           HG3      MET   1   5.133  -1.103  -1.940
    9    HE1  MET   1           HE1      MET   1   5.868  -3.492  -1.568
   10    HE2  MET   1           HE2      MET   1   4.137  -3.704  -1.218
   11    HE3  MET   1           HE3      MET   1   4.986  -4.866  -2.273
   12    H    ILE   2           H        ILE   2   1.906  -1.909  -5.244
   13    HA   ILE   2           HA       ILE   2   0.866  -4.488  -4.169
   14    HB   ILE   2           HB       ILE   2   0.112  -3.213  -6.812
   15   HG12  ILE   2          HG12      ILE   2  -1.182  -3.349  -4.190
   16   HG13  ILE   2          HG13      ILE   2  -1.536  -2.328  -5.581
   17   HG21  ILE   2          HG21      ILE   2  -0.575  -5.976  -5.760
   18   HG22  ILE   2          HG22      ILE   2  -1.116  -5.247  -7.301
   19   HG23  ILE   2          HG23      ILE   2   0.588  -5.635  -7.068
   20   HD11  ILE   2          HD11      ILE   2  -2.554  -5.111  -4.953
   21   HD12  ILE   2          HD12      ILE   2  -3.466  -3.593  -4.890
   22   HD13  ILE   2          HD13      ILE   2  -2.975  -4.221  -6.468
   23    H    ASP   3           H        ASP   3   2.359  -6.077  -4.658
   24    HA   ASP   3           HA       ASP   3   4.946  -5.296  -5.242
   25    HB2  ASP   3           HB2      ASP   3   4.369  -7.289  -3.932
   26    HB3  ASP   3           HB3      ASP   3   3.775  -8.071  -5.405
   27    H    ASP   4           H        ASP   4   3.018  -7.510  -7.295
   28    HA   ASP   4           HA       ASP   4   3.804  -6.166  -9.701
   29    HB2  ASP   4           HB2      ASP   4   5.872  -7.428  -9.336
   30    HB3  ASP   4           HB3      ASP   4   4.948  -8.909  -9.103
   31    H    ASP   5           H        ASP   5   2.771  -9.371  -8.556
   32    HA   ASP   5           HA       ASP   5   1.068  -9.690 -10.882
   33    HB2  ASP   5           HB2      ASP   5   2.740 -11.393 -10.190
   34    HB3  ASP   5           HB3      ASP   5   1.755 -11.730  -8.763
   35    H    GLY   6           H        GLY   6   0.302  -7.972  -8.512
   36    HA2  GLY   6           HA2      GLY   6  -1.861  -7.282  -7.896
   37    HA3  GLY   6           HA3      GLY   6  -2.522  -8.840  -8.364
   38    H    TYR   7           H        TYR   7   0.250  -9.201  -6.366
   39    HA   TYR   7           HA       TYR   7  -1.419  -9.540  -3.926
   40    HB2  TYR   7           HB2      TYR   7   1.329 -10.679  -4.571
   41    HB3  TYR   7           HB3      TYR   7   0.440 -10.917  -3.070
   42    HD1  TYR   7           HD2      TYR   7  -1.591 -12.329  -2.997
   43    HD2  TYR   7           HD1      TYR   7   0.704 -11.878  -6.615
   44    HE1  TYR   7           HE2      TYR   7  -2.829 -14.221  -4.019
   45    HE2  TYR   7           HE1      TYR   7  -0.489 -13.784  -7.627
   46    HH   TYR   7           HH       TYR   7  -2.169 -15.393  -7.362
   47    H    ARG   8           H        ARG   8  -0.542  -8.645  -1.915
   48    HA   ARG   8           HA       ARG   8   1.687  -6.747  -2.230
   49    HB2  ARG   8           HB2      ARG   8   0.493  -4.910  -1.161
   50    HB3  ARG   8           HB3      ARG   8  -0.285  -5.357  -2.691
   51    HG2  ARG   8           HG2      ARG   8  -1.424  -6.571  -0.184
   52    HG3  ARG   8           HG3      ARG   8  -1.662  -4.845  -0.461
   53    HD2  ARG   8           HD2      ARG   8  -2.634  -5.252  -2.653
   54    HD3  ARG   8           HD3      ARG   8  -2.304  -6.975  -2.544
   55    HE   ARG   8           HE       ARG   8  -4.023  -7.330  -1.056
   56   HH11  ARG   8          HH11      ARG   8  -3.795  -3.801  -1.602
   57   HH12  ARG   8          HH12      ARG   8  -5.240  -3.458  -0.732
   58   HH21  ARG   8          HH21      ARG   8  -5.798  -6.831   0.233
   59   HH22  ARG   8          HH22      ARG   8  -6.451  -5.220   0.288
   60    HA   PRO   9           HA       PRO   9   2.420  -8.726   1.629
   61    HB2  PRO   9           HB2      PRO   9   4.543  -6.770   2.267
   62    HB3  PRO   9           HB3      PRO   9   4.710  -8.503   1.853
   63    HG2  PRO   9           HG2      PRO   9   5.501  -6.522   0.140
   64    HG3  PRO   9           HG3      PRO   9   4.665  -7.990  -0.481
   65    HD2  PRO   9           HD2      PRO   9   3.410  -5.316   0.271
   66    HD3  PRO   9           HD3      PRO   9   3.328  -6.168  -1.286
   67    H    ASN  10           H        ASN  10   1.819  -8.715   3.836
   68    HA   ASN  10           HA       ASN  10   1.245  -6.086   5.125
   69    HB2  ASN  10           HB2      ASN  10  -0.772  -7.132   3.974
   70    HB3  ASN  10           HB3      ASN  10  -0.631  -8.498   5.062
   71   HD21  ASN  10          HD22      ASN  10  -2.044  -5.373   4.641
   72   HD22  ASN  10          HD21      ASN  10  -2.596  -5.181   6.283
   73    H    VAL  11           H        VAL  11   1.156  -6.233   7.513
   74    HA   VAL  11           HA       VAL  11   2.249  -8.709   8.638
   75    HB   VAL  11           HB       VAL  11   3.796  -7.420  10.097
   76   HG11  VAL  11          HG11      VAL  11   4.944  -8.634   8.745
   77   HG12  VAL  11          HG12      VAL  11   4.362  -7.872   7.258
   78   HG13  VAL  11          HG13      VAL  11   5.557  -7.051   8.310
   79   HG21  VAL  11          HG21      VAL  11   2.932  -5.111   9.769
   80   HG22  VAL  11          HG22      VAL  11   4.650  -5.250   9.366
   81   HG23  VAL  11          HG23      VAL  11   3.445  -5.168   8.063
   82    H    GLY  12           H        GLY  12   1.402  -9.141  10.641
   83    HA2  GLY  12           HA2      GLY  12  -0.502  -7.163  11.821
   84    HA3  GLY  12           HA3      GLY  12  -0.802  -8.888  11.731
   85    H    ILE  13           H        ILE  13  -0.670  -7.237  14.150
   86    HA   ILE  13           HA       ILE  13   1.654  -8.444  15.516
   87    HB   ILE  13           HB       ILE  13   0.420  -5.739  16.178
   88   HG12  ILE  13          HG12      ILE  13   2.884  -5.023  15.305
   89   HG13  ILE  13          HG13      ILE  13   2.579  -6.354  14.185
   90   HG21  ILE  13          HG21      ILE  13   2.595  -5.557  17.437
   91   HG22  ILE  13          HG22      ILE  13   1.532  -6.840  18.001
   92   HG23  ILE  13          HG23      ILE  13   2.942  -7.233  16.968
   93   HD11  ILE  13          HD11      ILE  13   0.781  -3.918  14.596
   94   HD12  ILE  13          HD12      ILE  13   1.927  -4.156  13.261
   95   HD13  ILE  13          HD13      ILE  13   0.515  -5.211  13.405
   96    H    VAL  14           H        VAL  14   1.147  -9.370  17.484
   97    HA   VAL  14           HA       VAL  14  -1.666  -9.120  18.480
   98    HB   VAL  14           HB       VAL  14   0.121 -11.584  18.681
   99   HG11  VAL  14          HG11      VAL  14  -1.887 -12.718  19.426
  100   HG12  VAL  14          HG12      VAL  14  -1.661 -11.295  20.432
  101   HG13  VAL  14          HG13      VAL  14  -2.880 -11.260  19.137
  102   HG21  VAL  14          HG21      VAL  14  -0.368 -11.344  16.322
  103   HG22  VAL  14          HG22      VAL  14  -1.348 -12.635  17.019
  104   HG23  VAL  14          HG23      VAL  14  -2.094 -11.052  16.662
  105    H    ILE  15           H        ILE  15  -1.729  -8.591  20.686
  106    HA   ILE  15           HA       ILE  15   0.854  -8.734  22.147
  107    HB   ILE  15           HB       ILE  15  -1.385  -6.835  22.943
  108   HG12  ILE  15          HG12      ILE  15  -0.573  -6.039  20.784
  109   HG13  ILE  15          HG13      ILE  15  -0.064  -4.987  22.094
  110   HG21  ILE  15          HG21      ILE  15   0.096  -7.644  24.722
  111   HG22  ILE  15          HG22      ILE  15   1.486  -6.992  23.826
  112   HG23  ILE  15          HG23      ILE  15   0.160  -5.915  24.405
  113   HD11  ILE  15          HD11      ILE  15   1.742  -7.099  20.814
  114   HD12  ILE  15          HD12      ILE  15   1.702  -5.375  20.377
  115   HD13  ILE  15          HD13      ILE  15   2.214  -5.868  22.002
  116    H    CYS  16           H        CYS  16   0.863 -10.117  23.887
  117    HA   CYS  16           HA       CYS  16  -1.777 -11.139  24.817
  118    HB2  CYS  16           HB2      CYS  16   0.719 -12.872  24.691
  119    HB3  CYS  16           HB3      CYS  16  -0.936 -13.363  25.067
  120    HG   CYS  16           HG       CYS  16  -0.286 -14.303  22.688
  121    H    ASN  17           H        ASN  17  -1.934 -11.502  27.037
  122    HA   ASN  17           HA       ASN  17   0.263 -10.331  28.683
  123    HB2  ASN  17           HB2      ASN  17  -1.347  -9.565  30.240
  124    HB3  ASN  17           HB3      ASN  17  -1.898  -9.073  28.650
  125   HD21  ASN  17          HD22      ASN  17  -3.910  -8.824  30.202
  126   HD22  ASN  17          HD21      ASN  17  -4.954 -10.222  30.290
  127    H    ARG  18           H        ARG  18   0.131 -11.374  31.073
  128    HA   ARG  18           HA       ARG  18   0.630 -14.230  30.641
  129    HB2  ARG  18           HB2      ARG  18   0.908 -12.344  33.033
  130    HB3  ARG  18           HB3      ARG  18   1.028 -14.087  33.239
  131    HG2  ARG  18           HG2      ARG  18   3.171 -13.866  32.849
  132    HG3  ARG  18           HG3      ARG  18   2.692 -13.884  31.164
  133    HD2  ARG  18           HD2      ARG  18   4.259 -12.138  31.418
  134    HD3  ARG  18           HD3      ARG  18   2.678 -11.341  31.220
  135    HE   ARG  18           HE       ARG  18   2.993 -11.579  33.960
  136   HH11  ARG  18          HH11      ARG  18   4.863 -10.016  31.335
  137   HH12  ARG  18          HH12      ARG  18   5.530  -8.806  32.378
  138   HH21  ARG  18          HH21      ARG  18   3.892  -9.954  35.314
  139   HH22  ARG  18          HH22      ARG  18   4.961  -8.766  34.678
  140    H    GLN  19           H        GLN  19  -2.254 -12.849  30.814
  141    HA   GLN  19           HA       GLN  19  -3.435 -14.962  32.492
  142    HB2  GLN  19           HB2      GLN  19  -4.964 -12.732  31.133
  143    HB3  GLN  19           HB3      GLN  19  -5.480 -13.723  32.489
  144    HG2  GLN  19           HG2      GLN  19  -3.359 -11.538  32.483
  145    HG3  GLN  19           HG3      GLN  19  -4.966 -11.425  33.161
  146   HE21  GLN  19          HE22      GLN  19  -2.617 -10.858  34.695
  147   HE22  GLN  19          HE21      GLN  19  -2.498 -12.062  35.959
  148    H    GLY  20           H        GLY  20  -2.390 -14.612  29.324
  149    HA2  GLY  20           HA2      GLY  20  -2.857 -15.827  27.439
  150    HA3  GLY  20           HA3      GLY  20  -4.098 -16.742  28.308
  151    H    GLN  21           H        GLN  21  -4.187 -13.159  28.290
  152    HA   GLN  21           HA       GLN  21  -6.531 -13.299  26.459
  153    HB2  GLN  21           HB2      GLN  21  -5.648 -10.994  28.219
  154    HB3  GLN  21           HB3      GLN  21  -7.072 -11.063  27.193
  155    HG2  GLN  21           HG2      GLN  21  -6.624 -12.876  29.602
  156    HG3  GLN  21           HG3      GLN  21  -7.545 -11.384  29.624
  157   HE21  GLN  21          HE22      GLN  21  -7.628 -14.792  28.785
  158   HE22  GLN  21          HE21      GLN  21  -9.252 -14.799  28.121
  159    H    VAL  22           H        VAL  22  -6.448 -12.099  24.564
  160    HA   VAL  22           HA       VAL  22  -3.832 -10.967  23.791
  161    HB   VAL  22           HB       VAL  22  -4.219 -11.599  21.542
  162   HG11  VAL  22          HG11      VAL  22  -3.927 -13.962  21.713
  163   HG12  VAL  22          HG12      VAL  22  -3.301 -13.283  23.227
  164   HG13  VAL  22          HG13      VAL  22  -4.885 -14.054  23.223
  165   HG21  VAL  22          HG21      VAL  22  -6.133 -13.007  20.810
  166   HG22  VAL  22          HG22      VAL  22  -6.933 -12.750  22.376
  167   HG23  VAL  22          HG23      VAL  22  -6.644 -11.380  21.285
  168    H    MET  23           H        MET  23  -3.853  -9.032  22.618
  169    HA   MET  23           HA       MET  23  -5.990  -7.159  23.170
  170    HB2  MET  23           HB2      MET  23  -3.751  -6.346  23.027
  171    HB3  MET  23           HB3      MET  23  -3.464  -7.151  21.475
  172    HG2  MET  23           HG2      MET  23  -5.006  -5.622  20.342
  173    HG3  MET  23           HG3      MET  23  -5.351  -4.798  21.865
  174    HE1  MET  23           HE1      MET  23  -2.963  -4.112  23.389
  175    HE2  MET  23           HE2      MET  23  -2.265  -2.697  22.553
  176    HE3  MET  23           HE3      MET  23  -4.029  -2.851  22.727
  177    H    TRP  24           H        TRP  24  -7.630  -6.463  21.847
  178    HA   TRP  24           HA       TRP  24  -7.803  -7.365  19.023
  179    HB2  TRP  24           HB2      TRP  24  -8.944  -8.877  20.695
  180    HB3  TRP  24           HB3      TRP  24  -9.978  -7.545  21.160
  181    HD1  TRP  24           HD1      TRP  24 -12.232  -8.414  20.453
  182    HE1  TRP  24           HE1      TRP  24 -13.269  -9.602  18.446
  183    HE3  TRP  24           HE3      TRP  24  -8.017  -9.186  17.687
  184    HZ2  TRP  24           HZ2      TRP  24 -12.437 -10.519  15.863
  185    HZ3  TRP  24           HZ3      TRP  24  -8.154 -10.455  15.571
  186    HH2  TRP  24           HH2      TRP  24 -10.385 -11.070  14.615
  187    H    ALA  25           H        ALA  25  -8.255  -5.371  17.807
  188    HA   ALA  25           HA       ALA  25  -9.417  -3.092  19.270
  189    HB1  ALA  25           HB1      ALA  25  -7.305  -1.732  19.061
  190    HB2  ALA  25           HB2      ALA  25  -7.066  -3.138  20.081
  191    HB3  ALA  25           HB3      ALA  25  -6.464  -3.156  18.419
  192    H    ARG  26           H        ARG  26  -9.675  -1.098  17.828
  193    HA   ARG  26           HA       ARG  26  -9.078  -1.416  15.029
  194    HB2  ARG  26           HB2      ARG  26 -11.308  -2.820  15.640
  195    HB3  ARG  26           HB3      ARG  26 -12.061  -1.247  15.515
  196    HG2  ARG  26           HG2      ARG  26 -12.368  -2.107  13.398
  197    HG3  ARG  26           HG3      ARG  26 -10.935  -1.159  13.118
  198    HD2  ARG  26           HD2      ARG  26 -11.156  -4.153  13.452
  199    HD3  ARG  26           HD3      ARG  26 -10.715  -3.289  11.996
  200    HE   ARG  26           HE       ARG  26  -9.066  -3.794  14.426
  201   HH11  ARG  26          HH11      ARG  26  -9.048  -2.128  11.244
  202   HH12  ARG  26          HH12      ARG  26  -7.323  -2.059  11.195
  203   HH21  ARG  26          HH21      ARG  26  -6.836  -3.838  14.223
  204   HH22  ARG  26          HH22      ARG  26  -6.026  -2.951  12.967
  205    H    ARG  27           H        ARG  27 -10.221   0.260  13.650
  206    HA   ARG  27           HA       ARG  27  -9.033   2.658  14.337
  207    HB2  ARG  27           HB2      ARG  27  -9.693   1.477  12.046
  208    HB3  ARG  27           HB3      ARG  27 -11.198   2.336  12.247
  209    HG2  ARG  27           HG2      ARG  27  -9.900   3.697  10.804
  210    HG3  ARG  27           HG3      ARG  27  -9.785   4.509  12.353
  211    HD2  ARG  27           HD2      ARG  27  -7.575   3.216  12.709
  212    HD3  ARG  27           HD3      ARG  27  -7.689   2.709  11.035
  213    HE   ARG  27           HE       ARG  27  -7.052   5.355  12.128
  214   HH11  ARG  27          HH11      ARG  27  -7.996   3.655   9.127
  215   HH12  ARG  27          HH12      ARG  27  -7.396   4.895   8.090
  216   HH21  ARG  27          HH21      ARG  27  -6.169   6.909  10.775
  217   HH22  ARG  27          HH22      ARG  27  -6.341   6.807   9.042
  218    H    PHE  28           H        PHE  28  -9.848   4.773  14.507
  219    HA   PHE  28           HA       PHE  28 -12.118   5.254  16.186
  220    HB2  PHE  28           HB2      PHE  28 -10.149   6.675  16.129
  221    HB3  PHE  28           HB3      PHE  28 -10.368   7.005  14.422
  222    HD1  PHE  28           HD1      PHE  28 -11.911   7.554  17.803
  223    HD2  PHE  28           HD2      PHE  28 -11.621   8.883  13.702
  224    HE1  PHE  28           HE1      PHE  28 -13.116   9.642  18.389
  225    HE2  PHE  28           HE2      PHE  28 -12.789  10.979  14.305
  226    HZ   PHE  28           HZ       PHE  28 -13.552  11.364  16.645
  227    H    GLY  29           H        GLY  29 -14.224   5.684  15.628
  228    HA2  GLY  29           HA2      GLY  29 -16.080   6.066  14.348
  229    HA3  GLY  29           HA3      GLY  29 -15.055   6.361  12.939
  230    H    GLN  30           H        GLN  30 -14.150   3.310  14.175
  231    HA   GLN  30           HA       GLN  30 -16.104   1.901  12.419
  232    HB2  GLN  30           HB2      GLN  30 -13.309   1.071  13.285
  233    HB3  GLN  30           HB3      GLN  30 -14.416   0.061  12.365
  234    HG2  GLN  30           HG2      GLN  30 -13.363   2.751  11.457
  235    HG3  GLN  30           HG3      GLN  30 -12.708   1.175  10.985
  236   HE21  GLN  30          HE22      GLN  30 -13.502   2.944   8.969
  237   HE22  GLN  30          HE21      GLN  30 -14.952   2.341   8.203
  238    H    HIS  31           H        HIS  31 -16.754  -0.182  13.088
  239    HA   HIS  31           HA       HIS  31 -16.810  -0.633  16.037
  240    HB2  HIS  31           HB2      HIS  31 -19.183  -0.974  14.166
  241    HB3  HIS  31           HB3      HIS  31 -19.168  -1.200  15.911
  242    HD1  HIS  31           HD1      HIS  31 -20.345   1.283  13.592
  243    HD2  HIS  31           HD2      HIS  31 -18.131   1.347  17.178
  244    HE1  HIS  31           HE1      HIS  31 -20.566   3.641  14.529
  245    H    SER  32           H        SER  32 -15.344  -1.854  13.495
  246    HA   SER  32           HA       SER  32 -16.209  -4.675  13.719
  247    HB2  SER  32           HB2      SER  32 -14.303  -4.877  11.978
  248    HB3  SER  32           HB3      SER  32 -15.813  -4.080  11.500
  249    HG   SER  32           HG       SER  32 -14.069  -2.832  10.810
  250    H    TRP  33           H        TRP  33 -14.295  -6.285  14.118
  251    HA   TRP  33           HA       TRP  33 -12.219  -5.104  15.917
  252    HB2  TRP  33           HB2      TRP  33 -13.883  -7.596  16.429
  253    HB3  TRP  33           HB3      TRP  33 -12.480  -7.027  17.342
  254    HD1  TRP  33           HD1      TRP  33 -16.180  -6.190  16.835
  255    HE1  TRP  33           HE1      TRP  33 -16.907  -4.506  18.611
  256    HE3  TRP  33           HE3      TRP  33 -11.608  -5.204  18.868
  257    HZ2  TRP  33           HZ2      TRP  33 -15.627  -2.861  20.660
  258    HZ3  TRP  33           HZ3      TRP  33 -11.371  -3.557  20.689
  259    HH2  TRP  33           HH2      TRP  33 -13.375  -2.367  21.583
  260    H    GLN  34           H        GLN  34 -10.186  -5.867  15.507
  261    HA   GLN  34           HA       GLN  34  -9.700  -8.384  14.209
  262    HB2  GLN  34           HB2      GLN  34  -8.783  -5.855  12.770
  263    HB3  GLN  34           HB3      GLN  34  -8.293  -7.494  12.388
  264    HG2  GLN  34           HG2      GLN  34 -10.738  -8.031  11.944
  265    HG3  GLN  34           HG3      GLN  34 -11.051  -6.294  12.025
  266   HE21  GLN  34          HE21      GLN  34  -8.883  -5.185  10.548
  267   HE22  GLN  34          HE22      GLN  34  -8.994  -5.796   8.916
  268    H    PHE  35           H        PHE  35  -7.123  -8.567  14.045
  269    HA   PHE  35           HA       PHE  35  -5.924  -7.563  16.519
  270    HB2  PHE  35           HB2      PHE  35  -4.752  -8.997  14.125
  271    HB3  PHE  35           HB3      PHE  35  -3.913  -8.737  15.653
  272    HD1  PHE  35           HD2      PHE  35  -5.506  -9.592  17.765
  273    HD2  PHE  35           HD1      PHE  35  -5.291 -11.318  13.782
  274    HE1  PHE  35           HE2      PHE  35  -6.415 -11.719  18.627
  275    HE2  PHE  35           HE1      PHE  35  -6.165 -13.427  14.684
  276    HZ   PHE  35           HZ       PHE  35  -6.802 -13.631  17.071
  277    HA   PRO  36           HA       PRO  36  -4.153  -3.807  14.641
  278    HB2  PRO  36           HB2      PRO  36  -1.599  -4.637  16.019
  279    HB3  PRO  36           HB3      PRO  36  -2.374  -3.028  15.970
  280    HG2  PRO  36           HG2      PRO  36  -2.595  -4.604  18.158
  281    HG3  PRO  36           HG3      PRO  36  -4.030  -3.702  17.563
  282    HD2  PRO  36           HD2      PRO  36  -3.330  -6.620  17.161
  283    HD3  PRO  36           HD3      PRO  36  -4.909  -5.875  17.545
  284    H    GLN  37           H        GLN  37  -3.211  -3.519  12.540
  285    HA   GLN  37           HA       GLN  37  -1.041  -5.218  11.612
  286    HB2  GLN  37           HB2      GLN  37  -2.329  -6.317   9.817
  287    HB3  GLN  37           HB3      GLN  37  -2.936  -6.771  11.399
  288    HG2  GLN  37           HG2      GLN  37  -4.719  -4.872  11.066
  289    HG3  GLN  37           HG3      GLN  37  -4.194  -4.893   9.376
  290   HE21  GLN  37          HE22      GLN  37  -5.719  -6.767  11.993
  291   HE22  GLN  37          HE21      GLN  37  -6.418  -8.012  10.960
  292    H    GLY  38           H        GLY  38  -0.551  -4.790   9.205
  293    HA2  GLY  38           HA2      GLY  38  -1.822  -2.680   7.807
  294    HA3  GLY  38           HA3      GLY  38  -0.429  -2.016   8.658
  295    H    GLY  39           H        GLY  39  -0.282  -1.790   5.975
  296    HA2  GLY  39           HA2      GLY  39   0.796  -4.080   4.607
  297    HA3  GLY  39           HA3      GLY  39   0.671  -2.421   4.016
  298    H    ILE  40           H        ILE  40   2.888  -4.390   4.088
  299    HA   ILE  40           HA       ILE  40   4.998  -3.099   5.687
  300    HB   ILE  40           HB       ILE  40   5.314  -5.019   3.364
  301   HG12  ILE  40          HG12      ILE  40   5.064  -5.720   6.334
  302   HG13  ILE  40          HG13      ILE  40   3.856  -6.046   5.099
  303   HG21  ILE  40          HG21      ILE  40   7.507  -5.526   4.268
  304   HG22  ILE  40          HG22      ILE  40   7.389  -3.772   4.102
  305   HG23  ILE  40          HG23      ILE  40   7.222  -4.537   5.699
  306   HD11  ILE  40          HD11      ILE  40   6.432  -7.459   5.570
  307   HD12  ILE  40          HD12      ILE  40   4.815  -8.067   5.100
  308   HD13  ILE  40          HD13      ILE  40   5.861  -7.312   3.894
  309    H    ASN  41           H        ASN  41   5.878  -1.176   5.069
  310    HA   ASN  41           HA       ASN  41   5.121   0.017   2.496
  311    HB2  ASN  41           HB2      ASN  41   6.614   0.974   4.949
  312    HB3  ASN  41           HB3      ASN  41   6.899   1.768   3.412
  313   HD21  ASN  41          HD22      ASN  41   3.980   0.629   5.315
  314   HD22  ASN  41          HD21      ASN  41   3.057   2.063   4.961
  315    HA   PRO  42           HA       PRO  42   8.243  -1.876   0.246
  316    HB2  PRO  42           HB2      PRO  42   9.036  -0.014  -1.652
  317    HB3  PRO  42           HB3      PRO  42   7.505  -0.936  -1.686
  318    HG2  PRO  42           HG2      PRO  42   7.978   1.867  -0.641
  319    HG3  PRO  42           HG3      PRO  42   6.659   1.295  -1.713
  320    HD2  PRO  42           HD2      PRO  42   6.294   1.603   0.957
  321    HD3  PRO  42           HD3      PRO  42   5.552   0.222   0.096
  322    H    GLY  43           H        GLY  43  10.263  -2.381   0.882
  323    HA2  GLY  43           HA2      GLY  43  12.591  -1.978   1.012
  324    HA3  GLY  43           HA3      GLY  43  12.303  -0.283   1.392
  325    H    GLU  44           H        GLU  44  10.074  -1.307   3.469
  326    HA   GLU  44           HA       GLU  44  11.878  -1.657   5.690
  327    HB2  GLU  44           HB2      GLU  44   8.862  -1.550   5.320
  328    HB3  GLU  44           HB3      GLU  44   9.556  -2.113   6.828
  329    HG2  GLU  44           HG2      GLU  44   8.986   0.252   6.920
  330    HG3  GLU  44           HG3      GLU  44  10.683  -0.088   7.253
  331    H    SER  45           H        SER  45  11.927  -3.538   7.074
  332    HA   SER  45           HA       SER  45  11.496  -6.113   5.700
  333    HB2  SER  45           HB2      SER  45  12.506  -7.049   7.743
  334    HB3  SER  45           HB3      SER  45  13.548  -5.825   7.006
  335    HG   SER  45           HG       SER  45  13.192  -5.693   9.370
  336    H    ALA  46           H        ALA  46  10.237  -7.789   7.036
  337    HA   ALA  46           HA       ALA  46   7.627  -6.882   7.577
  338    HB1  ALA  46           HB1      ALA  46   7.299  -9.154   8.526
  339    HB2  ALA  46           HB2      ALA  46   8.200  -9.214   6.995
  340    HB3  ALA  46           HB3      ALA  46   9.066  -9.391   8.556
  341    H    GLU  47           H        GLU  47  10.372  -7.452   9.780
  342    HA   GLU  47           HA       GLU  47   8.907  -7.023  12.196
  343    HB2  GLU  47           HB2      GLU  47  10.936  -8.347  11.953
  344    HB3  GLU  47           HB3      GLU  47  11.876  -6.884  11.555
  345    HG2  GLU  47           HG2      GLU  47  11.280  -5.979  13.834
  346    HG3  GLU  47           HG3      GLU  47  10.468  -7.510  14.176
  347    H    GLN  48           H        GLN  48  10.801  -4.822  10.039
  348    HA   GLN  48           HA       GLN  48  10.513  -2.555  11.844
  349    HB2  GLN  48           HB2      GLN  48  11.126  -2.761   8.873
  350    HB3  GLN  48           HB3      GLN  48  11.017  -1.211   9.732
  351    HG2  GLN  48           HG2      GLN  48  12.761  -1.866  11.295
  352    HG3  GLN  48           HG3      GLN  48  12.849  -3.484  10.587
  353   HE21  GLN  48          HE22      GLN  48  13.647  -3.711   8.396
  354   HE22  GLN  48          HE21      GLN  48  14.683  -2.485   7.667
  355    H    ALA  49           H        ALA  49   8.526  -3.861   9.125
  356    HA   ALA  49           HA       ALA  49   6.667  -1.659   9.294
  357    HB1  ALA  49           HB1      ALA  49   5.202  -3.091   7.940
  358    HB2  ALA  49           HB2      ALA  49   6.837  -2.883   7.267
  359    HB3  ALA  49           HB3      ALA  49   6.387  -4.422   8.087
  360    H    MET  50           H        MET  50   6.948  -4.818  10.964
  361    HA   MET  50           HA       MET  50   4.426  -4.834  12.243
  362    HB2  MET  50           HB2      MET  50   5.768  -6.754  12.357
  363    HB3  MET  50           HB3      MET  50   7.166  -5.906  12.969
  364    HG2  MET  50           HG2      MET  50   4.634  -6.245  14.562
  365    HG3  MET  50           HG3      MET  50   5.961  -7.384  14.577
  366    HE1  MET  50           HE1      MET  50   8.698  -5.617  14.820
  367    HE2  MET  50           HE2      MET  50   8.725  -5.905  16.569
  368    HE3  MET  50           HE3      MET  50   8.151  -7.178  15.480
  369    H    TYR  51           H        TYR  51   7.535  -3.322  13.395
  370    HA   TYR  51           HA       TYR  51   6.279  -2.041  15.605
  371    HB2  TYR  51           HB2      TYR  51   8.772  -1.302  14.030
  372    HB3  TYR  51           HB3      TYR  51   8.291  -0.550  15.548
  373    HD1  TYR  51           HD2      TYR  51   7.650  -2.459  17.468
  374    HD2  TYR  51           HD1      TYR  51  10.535  -2.813  14.273
  375    HE1  TYR  51           HE2      TYR  51   9.074  -3.880  18.902
  376    HE2  TYR  51           HE1      TYR  51  11.942  -4.254  15.693
  377    HH   TYR  51           HH       TYR  51  11.114  -5.051  19.103
  378    H    ARG  52           H        ARG  52   6.940  -0.804  12.270
  379    HA   ARG  52           HA       ARG  52   6.094   1.854  12.586
  380    HB2  ARG  52           HB2      ARG  52   7.235   0.771  10.600
  381    HB3  ARG  52           HB3      ARG  52   5.678   0.033  10.191
  382    HG2  ARG  52           HG2      ARG  52   4.772   2.494  10.203
  383    HG3  ARG  52           HG3      ARG  52   6.491   2.940  10.134
  384    HD2  ARG  52           HD2      ARG  52   6.705   1.367   8.158
  385    HD3  ARG  52           HD3      ARG  52   4.949   1.179   8.163
  386    HE   ARG  52           HE       ARG  52   6.528   3.382   7.215
  387   HH11  ARG  52          HH21      ARG  52   3.237   2.600   8.404
  388   HH12  ARG  52          HH22      ARG  52   2.646   4.224   8.251
  389   HH21  ARG  52          HH11      ARG  52   5.599   5.455   6.668
  390   HH22  ARG  52          HH12      ARG  52   3.938   5.788   7.012
  391    H    GLU  53           H        GLU  53   4.145  -1.035  11.565
  392    HA   GLU  53           HA       GLU  53   1.816   0.573  11.310
  393    HB2  GLU  53           HB2      GLU  53   2.121  -2.422  11.204
  394    HB3  GLU  53           HB3      GLU  53   0.629  -1.532  10.856
  395    HG2  GLU  53           HG2      GLU  53   3.280  -1.154   9.443
  396    HG3  GLU  53           HG3      GLU  53   1.906  -2.034   8.782
  397    H    LEU  54           H        LEU  54   3.148  -1.513  13.924
  398    HA   LEU  54           HA       LEU  54   0.848  -1.509  15.566
  399    HB2  LEU  54           HB2      LEU  54   2.969  -2.790  15.991
  400    HB3  LEU  54           HB3      LEU  54   3.771  -1.272  16.406
  401    HG   LEU  54           HG       LEU  54   2.107  -1.002  18.289
  402   HD11  LEU  54          HD11      LEU  54   0.287  -2.468  17.428
  403   HD12  LEU  54          HD12      LEU  54   1.352  -3.850  17.479
  404   HD13  LEU  54          HD13      LEU  54   0.863  -3.062  18.993
  405   HD21  LEU  54          HD21      LEU  54   4.329  -1.795  18.756
  406   HD22  LEU  54          HD22      LEU  54   3.221  -2.839  19.657
  407   HD23  LEU  54          HD23      LEU  54   3.949  -3.417  18.144
  408    H    PHE  55           H        PHE  55   3.455   0.983  15.201
  409    HA   PHE  55           HA       PHE  55   2.353   2.787  17.116
  410    HB2  PHE  55           HB2      PHE  55   4.643   2.938  16.219
  411    HB3  PHE  55           HB3      PHE  55   4.010   3.372  14.637
  412    HD1  PHE  55           HD1      PHE  55   4.261   4.487  18.192
  413    HD2  PHE  55           HD2      PHE  55   3.371   5.636  14.133
  414    HE1  PHE  55           HE1      PHE  55   4.267   6.875  18.869
  415    HE2  PHE  55           HE2      PHE  55   3.384   8.029  14.809
  416    HZ   PHE  55           HZ       PHE  55   3.846   8.655  17.173
  417    H    GLU  56           H        GLU  56   1.723   2.393  13.565
  418    HA   GLU  56           HA       GLU  56  -0.012   4.601  13.394
  419    HB2  GLU  56           HB2      GLU  56   0.161   2.092  11.707
  420    HB3  GLU  56           HB3      GLU  56  -0.796   3.494  11.272
  421    HG2  GLU  56           HG2      GLU  56   2.107   4.017  11.879
  422    HG3  GLU  56           HG3      GLU  56   1.757   3.054  10.456
  423    H    GLU  57           H        GLU  57  -0.624   1.346  14.644
  424    HA   GLU  57           HA       GLU  57  -3.548   1.596  14.353
  425    HB2  GLU  57           HB2      GLU  57  -1.779  -0.568  15.550
  426    HB3  GLU  57           HB3      GLU  57  -3.525  -0.671  15.444
  427    HG2  GLU  57           HG2      GLU  57  -1.790  -0.428  12.961
  428    HG3  GLU  57           HG3      GLU  57  -2.082  -1.953  13.777
  429    H    VAL  58           H        VAL  58  -1.209   1.006  17.028
  430    HA   VAL  58           HA       VAL  58  -3.253   2.019  18.953
  431    HB   VAL  58           HB       VAL  58  -2.059   0.413  20.540
  432   HG11  VAL  58          HG11      VAL  58  -3.413  -0.848  18.103
  433   HG12  VAL  58          HG12      VAL  58  -3.273  -1.543  19.735
  434   HG13  VAL  58          HG13      VAL  58  -4.262  -0.112  19.472
  435   HG21  VAL  58          HG21      VAL  58   0.008   0.110  19.151
  436   HG22  VAL  58          HG22      VAL  58  -0.780  -1.401  19.637
  437   HG23  VAL  58          HG23      VAL  58  -0.974  -0.783  17.975
  438    H    GLY  59           H        GLY  59  -0.352   3.112  17.622
  439    HA2  GLY  59           HA2      GLY  59   0.995   4.851  18.246
  440    HA3  GLY  59           HA3      GLY  59  -0.097   5.157  19.593
  441    H    LEU  60           H        LEU  60   1.144   1.950  19.666
  442    HA   LEU  60           HA       LEU  60   2.928   2.441  21.910
  443    HB2  LEU  60           HB2      LEU  60   1.276   0.620  21.766
  444    HB3  LEU  60           HB3      LEU  60   2.041   0.053  20.275
  445    HG   LEU  60           HG       LEU  60   4.042  -0.699  21.548
  446   HD11  LEU  60          HD11      LEU  60   2.470   0.241  23.979
  447   HD12  LEU  60          HD12      LEU  60   3.951  -0.746  23.981
  448   HD13  LEU  60          HD13      LEU  60   4.001   0.926  23.395
  449   HD21  LEU  60          HD21      LEU  60   1.807  -1.998  21.138
  450   HD22  LEU  60          HD22      LEU  60   2.734  -2.585  22.530
  451   HD23  LEU  60          HD23      LEU  60   1.320  -1.535  22.760
  452    H    SER  61           H        SER  61   5.163   1.883  21.838
  453    HA   SER  61           HA       SER  61   6.425   1.859  19.132
  454    HB2  SER  61           HB2      SER  61   7.336   3.459  21.563
  455    HB3  SER  61           HB3      SER  61   8.044   3.484  19.936
  456    HG   SER  61           HG       SER  61   6.610   5.259  20.318
  457    H    ARG  62           H        ARG  62   8.714   1.128  19.226
  458    HA   ARG  62           HA       ARG  62   9.027  -1.466  19.997
  459    HB2  ARG  62           HB2      ARG  62  11.347   0.526  19.930
  460    HB3  ARG  62           HB3      ARG  62  11.412  -1.223  19.714
  461    HG2  ARG  62           HG2      ARG  62   9.785  -0.760  17.708
  462    HG3  ARG  62           HG3      ARG  62  10.389   0.898  17.827
  463    HD2  ARG  62           HD2      ARG  62  12.736  -0.002  17.738
  464    HD3  ARG  62           HD3      ARG  62  12.056  -1.623  17.451
  465    HE   ARG  62           HE       ARG  62  10.924   0.030  15.517
  466   HH11  ARG  62          HH11      ARG  62  14.179  -1.120  16.336
  467   HH12  ARG  62          HH12      ARG  62  14.839  -0.832  14.765
  468   HH21  ARG  62          HH21      ARG  62  11.820   0.494  13.434
  469   HH22  ARG  62          HH22      ARG  62  13.458   0.087  13.079
  470    H    LYS  63           H        LYS  63   9.782   1.403  21.943
  471    HA   LYS  63           HA       LYS  63  11.447   0.159  23.848
  472    HB2  LYS  63           HB2      LYS  63   9.653   2.570  24.373
  473    HB3  LYS  63           HB3      LYS  63  11.214   2.190  25.115
  474    HG2  LYS  63           HG2      LYS  63  10.719   3.145  22.284
  475    HG3  LYS  63           HG3      LYS  63  11.463   4.056  23.589
  476    HD2  LYS  63           HD2      LYS  63  12.565   1.441  22.543
  477    HD3  LYS  63           HD3      LYS  63  13.024   3.012  21.860
  478    HE2  LYS  63           HE2      LYS  63  13.818   3.737  24.134
  479    HE3  LYS  63           HE3      LYS  63  13.447   2.127  24.765
  480    HZ1  LYS  63           HZ1      LYS  63  15.107   1.219  23.221
  481    HZ2  LYS  63           HZ2      LYS  63  15.449   2.717  22.649
  482    HZ3  LYS  63           HZ3      LYS  63  15.782   2.339  24.199
  483    H    ASP  64           H        ASP  64   7.962   0.055  23.564
  484    HA   ASP  64           HA       ASP  64   7.910  -1.116  26.302
  485    HB2  ASP  64           HB2      ASP  64   6.752   1.179  25.858
  486    HB3  ASP  64           HB3      ASP  64   5.463   0.187  25.215
  487    H    VAL  65           H        VAL  65   8.422  -2.412  23.655
  488    HA   VAL  65           HA       VAL  65   6.582  -4.672  24.210
  489    HB   VAL  65           HB       VAL  65   6.578  -5.141  21.706
  490   HG11  VAL  65          HG11      VAL  65   4.630  -3.738  21.296
  491   HG12  VAL  65          HG12      VAL  65   4.592  -4.409  22.933
  492   HG13  VAL  65          HG13      VAL  65   5.059  -2.710  22.683
  493   HG21  VAL  65          HG21      VAL  65   8.339  -3.487  21.057
  494   HG22  VAL  65          HG22      VAL  65   6.834  -3.320  20.127
  495   HG23  VAL  65          HG23      VAL  65   7.194  -2.183  21.431
  496    H    ARG  66           H        ARG  66   7.372  -6.760  23.336
  497    HA   ARG  66           HA       ARG  66  10.218  -6.863  22.586
  498    HB2  ARG  66           HB2      ARG  66  10.729  -8.685  24.097
  499    HB3  ARG  66           HB3      ARG  66  10.340  -7.210  24.964
  500    HG2  ARG  66           HG2      ARG  66   8.010  -9.081  24.684
  501    HG3  ARG  66           HG3      ARG  66   9.372  -9.763  25.533
  502    HD2  ARG  66           HD2      ARG  66   8.176  -7.074  26.243
  503    HD3  ARG  66           HD3      ARG  66   7.697  -8.620  26.989
  504    HE   ARG  66           HE       ARG  66  10.550  -8.320  27.079
  505   HH11  ARG  66          HH21      ARG  66   7.640  -7.357  28.931
  506   HH12  ARG  66          HH22      ARG  66   8.559  -6.995  30.351
  507   HH21  ARG  66          HH11      ARG  66  11.652  -7.916  28.820
  508   HH22  ARG  66          HH12      ARG  66  10.951  -7.290  30.307
  509    H    ILE  67           H        ILE  67  10.476  -8.478  20.931
  510    HA   ILE  67           HA       ILE  67   7.959  -9.640  19.968
  511    HB   ILE  67           HB       ILE  67  10.765 -10.030  18.896
  512   HG12  ILE  67          HG12      ILE  67   8.732  -8.172  17.643
  513   HG13  ILE  67          HG13      ILE  67   9.949  -7.594  18.786
  514   HG21  ILE  67          HG21      ILE  67   8.023 -10.571  17.640
  515   HG22  ILE  67          HG22      ILE  67   9.589 -10.835  16.847
  516   HG23  ILE  67          HG23      ILE  67   9.151 -11.805  18.236
  517   HD11  ILE  67          HD11      ILE  67  10.466  -8.940  16.112
  518   HD12  ILE  67          HD12      ILE  67  10.776  -7.255  16.560
  519   HD13  ILE  67          HD13      ILE  67  11.726  -8.545  17.311
  520    H    LEU  68           H        LEU  68   7.237 -11.376  20.904
  521    HA   LEU  68           HA       LEU  68   9.099 -13.291  22.239
  522    HB2  LEU  68           HB2      LEU  68   6.066 -13.071  22.187
  523    HB3  LEU  68           HB3      LEU  68   7.007 -14.291  23.055
  524    HG   LEU  68           HG       LEU  68   6.896 -11.295  23.636
  525   HD11  LEU  68          HD11      LEU  68   6.028 -13.843  25.006
  526   HD12  LEU  68          HD12      LEU  68   6.123 -12.285  25.842
  527   HD13  LEU  68          HD13      LEU  68   5.033 -12.469  24.429
  528   HD21  LEU  68          HD21      LEU  68   8.700 -13.454  24.840
  529   HD22  LEU  68          HD22      LEU  68   9.217 -11.940  24.045
  530   HD23  LEU  68          HD23      LEU  68   8.387 -11.875  25.597
  531    H    ALA  69           H        ALA  69   6.932 -12.995  19.413
  532    HA   ALA  69           HA       ALA  69   7.833 -15.598  18.402
  533    HB1  ALA  69           HB1      ALA  69   5.836 -16.755  18.477
  534    HB2  ALA  69           HB2      ALA  69   5.790 -15.939  20.054
  535    HB3  ALA  69           HB3      ALA  69   4.854 -15.297  18.695
  536    H    SER  70           H        SER  70   6.907 -15.995  16.307
  537    HA   SER  70           HA       SER  70   5.393 -14.081  14.952
  538    HB2  SER  70           HB2      SER  70   7.086 -13.413  13.196
  539    HB3  SER  70           HB3      SER  70   7.270 -12.679  14.795
  540    HG   SER  70           HG       SER  70   9.298 -13.417  13.961
  541    H    THR  71           H        THR  71   4.875 -14.758  12.646
  542    HA   THR  71           HA       THR  71   4.640 -17.647  12.766
  543    HB   THR  71           HB       THR  71   3.544 -17.206  10.429
  544    HG1  THR  71           HG1      THR  71   4.088 -15.226   9.878
  545   HG21  THR  71          HG21      THR  71   1.473 -16.202  11.445
  546   HG22  THR  71          HG22      THR  71   2.048 -17.730  12.118
  547   HG23  THR  71          HG23      THR  71   2.342 -16.209  13.003
  548    H    ARG  72           H        ARG  72   5.479 -19.176  11.600
  549    HA   ARG  72           HA       ARG  72   8.160 -18.574  10.506
  550    HB2  ARG  72           HB2      ARG  72   6.703 -21.177  11.093
  551    HB3  ARG  72           HB3      ARG  72   8.428 -21.039  10.750
  552    HG2  ARG  72           HG2      ARG  72   8.935 -19.982  12.790
  553    HG3  ARG  72           HG3      ARG  72   7.308 -19.390  13.057
  554    HD2  ARG  72           HD2      ARG  72   8.319 -22.167  13.517
  555    HD3  ARG  72           HD3      ARG  72   7.623 -20.984  14.658
  556    HE   ARG  72           HE       ARG  72   5.483 -21.242  13.247
  557   HH11  ARG  72          HH22      ARG  72   7.710 -23.950  13.932
  558   HH12  ARG  72          HH21      ARG  72   6.479 -25.158  13.859
  559   HH21  ARG  72          HH11      ARG  72   3.853 -22.804  13.298
  560   HH22  ARG  72          HH12      ARG  72   4.238 -24.504  13.423
  561    H    ASN  73           H        ASN  73   5.030 -19.547   9.380
  562    HA   ASN  73           HA       ASN  73   5.915 -19.662   6.582
  563    HB2  ASN  73           HB2      ASN  73   4.106 -21.086   6.063
  564    HB3  ASN  73           HB3      ASN  73   4.848 -21.799   7.494
  565   HD21  ASN  73          HD22      ASN  73   3.670 -21.341   9.685
  566   HD22  ASN  73          HD21      ASN  73   1.970 -20.995   9.627
  567    H    TRP  74           H        TRP  74   4.484 -18.387   5.120
  568    HA   TRP  74           HA       TRP  74   3.364 -16.047   6.550
  569    HB2  TRP  74           HB2      TRP  74   3.865 -16.650   3.602
  570    HB3  TRP  74           HB3      TRP  74   2.959 -15.251   4.140
  571    HD1  TRP  74           HD1      TRP  74   6.535 -16.693   4.441
  572    HE1  TRP  74           HE1      TRP  74   8.190 -14.758   4.715
  573    HE3  TRP  74           HE3      TRP  74   3.228 -12.804   4.679
  574    HZ2  TRP  74           HZ2      TRP  74   8.083 -11.937   5.231
  575    HZ3  TRP  74           HZ3      TRP  74   4.020 -10.487   5.067
  576    HH2  TRP  74           HH2      TRP  74   6.437 -10.068   5.519
  577    H    LEU  75           H        LEU  75   1.257 -15.506   6.686
  578    HA   LEU  75           HA       LEU  75  -0.671 -17.680   6.077
  579    HB2  LEU  75           HB2      LEU  75  -1.102 -15.166   7.728
  580    HB3  LEU  75           HB3      LEU  75  -2.154 -16.572   7.574
  581    HG   LEU  75           HG       LEU  75   0.453 -16.319   9.076
  582   HD11  LEU  75          HD11      LEU  75  -1.624 -15.693  10.213
  583   HD12  LEU  75          HD12      LEU  75  -2.333 -17.291   9.889
  584   HD13  LEU  75          HD13      LEU  75  -0.920 -17.126  10.959
  585   HD21  LEU  75          HD21      LEU  75   0.296 -18.745   9.630
  586   HD22  LEU  75          HD22      LEU  75  -0.928 -18.928   8.347
  587   HD23  LEU  75          HD23      LEU  75   0.748 -18.415   7.961
  588    H    ARG  76           H        ARG  76  -0.342 -17.224   3.764
  589    HA   ARG  76           HA       ARG  76  -1.245 -14.673   2.667
  590    HB2  ARG  76           HB2      ARG  76   0.439 -16.377   1.646
  591    HB3  ARG  76           HB3      ARG  76  -0.972 -17.348   1.229
  592    HG2  ARG  76           HG2      ARG  76  -1.784 -15.337  -0.161
  593    HG3  ARG  76           HG3      ARG  76  -0.211 -14.591   0.185
  594    HD2  ARG  76           HD2      ARG  76   0.863 -16.724  -0.707
  595    HD3  ARG  76           HD3      ARG  76  -0.759 -17.193  -1.291
  596    HE   ARG  76           HE       ARG  76  -0.297 -14.635  -2.308
  597   HH11  ARG  76          HH11      ARG  76   1.298 -17.810  -2.572
  598   HH12  ARG  76          HH12      ARG  76   2.038 -17.474  -4.093
  599   HH21  ARG  76          HH21      ARG  76   0.659 -14.220  -4.400
  600   HH22  ARG  76          HH22      ARG  76   1.670 -15.405  -5.134
  601    H    TYR  77           H        TYR  77  -3.225 -14.268   1.618
  602    HA   TYR  77           HA       TYR  77  -5.181 -16.425   1.442
  603    HB2  TYR  77           HB2      TYR  77  -7.018 -15.264   2.482
  604    HB3  TYR  77           HB3      TYR  77  -5.766 -15.703   3.627
  605    HD1  TYR  77           HD1      TYR  77  -4.059 -13.881   4.330
  606    HD2  TYR  77           HD2      TYR  77  -7.825 -13.028   2.393
  607    HE1  TYR  77           HE1      TYR  77  -3.981 -11.591   5.198
  608    HE2  TYR  77           HE2      TYR  77  -7.778 -10.745   3.304
  609    HH   TYR  77           HH       TYR  77  -6.596  -9.171   4.614
  610    H    LYS  78           H        LYS  78  -6.677 -16.126  -0.170
  611    HA   LYS  78           HA       LYS  78  -6.302 -13.766  -1.951
  612    HB2  LYS  78           HB2      LYS  78  -7.424 -16.561  -2.401
  613    HB3  LYS  78           HB3      LYS  78  -7.906 -15.215  -3.418
  614    HG2  LYS  78           HG2      LYS  78  -6.192 -16.355  -4.536
  615    HG3  LYS  78           HG3      LYS  78  -5.579 -14.775  -4.046
  616    HD2  LYS  78           HD2      LYS  78  -4.121 -15.665  -2.442
  617    HD3  LYS  78           HD3      LYS  78  -5.019 -17.179  -2.273
  618    HE2  LYS  78           HE2      LYS  78  -3.507 -16.415  -4.812
  619    HE3  LYS  78           HE3      LYS  78  -2.767 -17.307  -3.483
  620    HZ1  LYS  78           HZ1      LYS  78  -5.101 -18.259  -5.069
  621    HZ2  LYS  78           HZ2      LYS  78  -3.573 -18.810  -5.184
  622    HZ3  LYS  78           HZ3      LYS  78  -4.418 -19.072  -3.816
  623    H    LEU  79           H        LEU  79  -8.042 -12.520  -2.458
  624    HA   LEU  79           HA       LEU  79 -10.279 -12.283  -0.627
  625    HB2  LEU  79           HB2      LEU  79  -9.896 -11.141  -3.441
  626    HB3  LEU  79           HB3      LEU  79 -11.059 -10.606  -2.242
  627    HG   LEU  79           HG       LEU  79  -8.046 -10.223  -2.218
  628   HD11  LEU  79          HD11      LEU  79 -10.401  -8.298  -2.356
  629   HD12  LEU  79          HD12      LEU  79  -8.679  -7.840  -2.306
  630   HD13  LEU  79          HD13      LEU  79  -9.319  -8.752  -3.689
  631   HD21  LEU  79          HD21      LEU  79  -8.670 -10.758   0.026
  632   HD22  LEU  79          HD22      LEU  79  -8.399  -9.000  -0.072
  633   HD23  LEU  79          HD23      LEU  79 -10.062  -9.644  -0.021
  634    HA   PRO  80           HA       PRO  80 -13.069 -14.848  -3.176
  635    HB2  PRO  80           HB2      PRO  80 -15.487 -13.891  -2.244
  636    HB3  PRO  80           HB3      PRO  80 -14.472 -15.009  -1.276
  637    HG2  PRO  80           HG2      PRO  80 -14.608 -12.005  -1.137
  638    HG3  PRO  80           HG3      PRO  80 -14.724 -13.166   0.225
  639    HD2  PRO  80           HD2      PRO  80 -12.368 -11.952  -0.367
  640    HD3  PRO  80           HD3      PRO  80 -12.400 -13.672   0.100
  641    H    LYS  81           H        LYS  81 -14.166 -14.189  -5.278
  642    HA   LYS  81           HA       LYS  81 -13.009 -11.737  -6.089
  643    HB2  LYS  81           HB2      LYS  81 -14.918 -13.364  -7.733
  644    HB3  LYS  81           HB3      LYS  81 -13.807 -12.052  -8.263
  645    HG2  LYS  81           HG2      LYS  81 -11.862 -13.327  -7.838
  646    HG3  LYS  81           HG3      LYS  81 -12.770 -14.601  -7.017
  647    HD2  LYS  81           HD2      LYS  81 -12.105 -15.268  -9.276
  648    HD3  LYS  81           HD3      LYS  81 -13.862 -15.263  -9.061
  649    HE2  LYS  81           HE2      LYS  81 -14.013 -13.118 -10.297
  650    HE3  LYS  81           HE3      LYS  81 -12.253 -13.116 -10.513
  651    HZ1  LYS  81           HZ1      LYS  81 -14.097 -15.174 -11.594
  652    HZ2  LYS  81           HZ2      LYS  81 -13.389 -13.987 -12.456
  653    HZ3  LYS  81           HZ3      LYS  81 -12.470 -15.165 -11.801
  654    H    ARG  82           H        ARG  82 -16.117 -12.196  -4.693
  655    HA   ARG  82           HA       ARG  82 -17.383  -9.902  -5.721
  656    HB2  ARG  82           HB2      ARG  82 -18.723  -9.850  -3.706
  657    HB3  ARG  82           HB3      ARG  82 -18.557 -11.490  -4.344
  658    HG2  ARG  82           HG2      ARG  82 -16.695 -11.795  -2.551
  659    HG3  ARG  82           HG3      ARG  82 -17.295 -10.286  -1.850
  660    HD2  ARG  82           HD2      ARG  82 -18.967 -12.760  -2.398
  661    HD3  ARG  82           HD3      ARG  82 -18.263 -12.350  -0.819
  662    HE   ARG  82           HE       ARG  82 -19.723 -10.102  -1.537
  663   HH11  ARG  82          HH11      ARG  82 -20.491 -13.520  -0.920
  664   HH12  ARG  82          HH12      ARG  82 -22.122 -13.209  -0.436
  665   HH21  ARG  82          HH21      ARG  82 -21.886  -9.684  -0.896
  666   HH22  ARG  82          HH22      ARG  82 -22.923 -10.975  -0.405
  667    H    LEU  83           H        LEU  83 -14.715 -10.080  -3.433
  668    HA   LEU  83           HA       LEU  83 -14.991  -7.245  -2.731
  669    HB2  LEU  83           HB2      LEU  83 -12.930  -9.274  -1.836
  670    HB3  LEU  83           HB3      LEU  83 -13.167  -7.663  -1.167
  671    HG   LEU  83           HG       LEU  83 -15.143  -9.963  -1.031
  672   HD11  LEU  83          HD11      LEU  83 -13.581  -8.657   1.218
  673   HD12  LEU  83          HD12      LEU  83 -14.652 -10.092   1.304
  674   HD13  LEU  83          HD13      LEU  83 -13.130 -10.173   0.414
  675   HD21  LEU  83          HD21      LEU  83 -16.456  -8.562   0.522
  676   HD22  LEU  83          HD22      LEU  83 -15.442  -7.170   0.086
  677   HD23  LEU  83          HD23      LEU  83 -16.467  -7.970  -1.139
  678    H    VAL  84           H        VAL  84 -13.272  -9.166  -5.030
  679    HA   VAL  84           HA       VAL  84 -10.906  -7.566  -5.277
  680    HB   VAL  84           HB       VAL  84 -12.335  -9.323  -7.333
  681   HG11  VAL  84          HG11      VAL  84 -10.765  -7.934  -8.507
  682   HG12  VAL  84          HG12      VAL  84  -9.522  -8.180  -7.262
  683   HG13  VAL  84          HG13      VAL  84  -9.997  -9.513  -8.323
  684   HG21  VAL  84          HG21      VAL  84  -9.894 -10.179  -5.756
  685   HG22  VAL  84          HG22      VAL  84 -11.532 -10.523  -5.181
  686   HG23  VAL  84          HG23      VAL  84 -11.021 -11.146  -6.759
  687    H    ARG  85           H        ARG  85 -10.584  -5.641  -6.359
  688    HA   ARG  85           HA       ARG  85 -12.792  -4.560  -7.998
  689    HB2  ARG  85           HB2      ARG  85 -10.853  -3.420  -6.108
  690    HB3  ARG  85           HB3      ARG  85 -10.776  -2.588  -7.672
  691    HG2  ARG  85           HG2      ARG  85 -13.346  -3.143  -6.206
  692    HG3  ARG  85           HG3      ARG  85 -12.411  -1.622  -6.085
  693    HD2  ARG  85           HD2      ARG  85 -12.566  -1.532  -8.666
  694    HD3  ARG  85           HD3      ARG  85 -13.844  -2.731  -8.554
  695    HE   ARG  85           HE       ARG  85 -13.867   0.101  -7.771
  696   HH11  ARG  85          HH21      ARG  85 -15.675  -2.960  -7.446
  697   HH12  ARG  85          HH22      ARG  85 -17.163  -2.187  -7.050
  698   HH21  ARG  85          HH12      ARG  85 -15.847   1.107  -7.239
  699   HH22  ARG  85          HH11      ARG  85 -17.263   0.172  -6.928
  700    H    TRP  86           H        TRP  86 -12.545  -5.781  -9.746
  701    HA   TRP  86           HA       TRP  86 -10.115  -6.074 -11.217
  702    HB2  TRP  86           HB2      TRP  86 -13.048  -6.293 -11.947
  703    HB3  TRP  86           HB3      TRP  86 -11.742  -6.742 -13.053
  704    HD1  TRP  86           HD1      TRP  86 -13.899  -8.225 -10.462
  705    HE1  TRP  86           HE1      TRP  86 -13.066 -10.519  -9.708
  706    HE3  TRP  86           HE3      TRP  86  -9.247  -8.122 -12.594
  707    HZ2  TRP  86           HZ2      TRP  86 -10.565 -12.003  -9.763
  708    HZ3  TRP  86           HZ3      TRP  86  -7.659  -9.999 -12.232
  709    HH2  TRP  86           HH2      TRP  86  -8.306 -11.936 -10.819
  710    H    ASP  87           H        ASP  87 -12.460  -3.462 -10.998
  711    HA   ASP  87           HA       ASP  87 -12.120  -2.391 -13.607
  712    HB2  ASP  87           HB2      ASP  87 -14.058  -1.899 -12.217
  713    HB3  ASP  87           HB3      ASP  87 -13.037  -1.075 -11.030
  714    H    THR  88           H        THR  88 -10.248  -1.928 -10.651
  715    HA   THR  88           HA       THR  88  -8.817   0.329 -11.875
  716    HB   THR  88           HB       THR  88  -9.989   0.603  -9.649
  717    HG1  THR  88           HG1      THR  88  -8.443   2.045  -9.059
  718   HG21  THR  88          HG21      THR  88  -9.066  -1.569  -8.655
  719   HG22  THR  88          HG22      THR  88  -7.495  -0.755  -8.557
  720   HG23  THR  88          HG23      THR  88  -8.900  -0.129  -7.645
  721    H    LYS  89           H        LYS  89  -6.457   0.388 -11.472
  722    HA   LYS  89           HA       LYS  89  -5.230  -2.276 -11.778
  723    HB2  LYS  89           HB2      LYS  89  -4.700   0.134 -13.555
  724    HB3  LYS  89           HB3      LYS  89  -3.934  -1.443 -13.697
  725    HG2  LYS  89           HG2      LYS  89  -6.907  -0.883 -14.074
  726    HG3  LYS  89           HG3      LYS  89  -5.722  -1.007 -15.381
  727    HD2  LYS  89           HD2      LYS  89  -5.228  -3.351 -14.740
  728    HD3  LYS  89           HD3      LYS  89  -6.467  -3.298 -13.486
  729    HE2  LYS  89           HE2      LYS  89  -6.979  -2.820 -16.462
  730    HE3  LYS  89           HE3      LYS  89  -7.149  -4.389 -15.662
  731    HZ1  LYS  89           HZ1      LYS  89  -8.755  -1.979 -14.982
  732    HZ2  LYS  89           HZ2      LYS  89  -9.263  -3.249 -15.869
  733    HZ3  LYS  89           HZ3      LYS  89  -8.927  -3.476 -14.292
  734    HA   PRO  90           HA       PRO  90  -3.471  -3.314 -11.561
  735    HB2  PRO  90           HB2      PRO  90  -1.893  -4.435  -9.708
  736    HB3  PRO  90           HB3      PRO  90  -1.259  -3.483 -11.092
  737    HG2  PRO  90           HG2      PRO  90  -1.750  -2.524  -8.243
  738    HG3  PRO  90           HG3      PRO  90  -0.249  -2.337  -9.214
  739    HD2  PRO  90           HD2      PRO  90  -2.156  -0.368  -9.050
  740    HD3  PRO  90           HD3      PRO  90  -1.238  -0.661 -10.557
  741    H    VAL  91           H        VAL  91  -4.769  -5.012 -10.786
  742    HA   VAL  91           HA       VAL  91  -6.561  -4.362  -8.589
  743    HB   VAL  91           HB       VAL  91  -7.573  -5.237 -10.537
  744   HG11  VAL  91          HG11      VAL  91  -5.736  -6.247 -11.757
  745   HG12  VAL  91          HG12      VAL  91  -5.600  -7.549 -10.544
  746   HG13  VAL  91          HG13      VAL  91  -7.037  -7.421 -11.582
  747   HG21  VAL  91          HG21      VAL  91  -7.396  -7.665  -8.706
  748   HG22  VAL  91          HG22      VAL  91  -8.401  -6.239  -8.386
  749   HG23  VAL  91          HG23      VAL  91  -8.706  -7.239  -9.813
  750    H    CYS  92           H        CYS  92  -6.664  -5.256  -6.621
  751    HA   CYS  92           HA       CYS  92  -4.440  -6.964  -5.732
  752    HB2  CYS  92           HB2      CYS  92  -5.544  -6.604  -3.488
  753    HB3  CYS  92           HB3      CYS  92  -4.945  -5.134  -4.281
  754    HG   CYS  92           HG       CYS  92  -8.037  -6.281  -4.448
  755    H    ILE  93           H        ILE  93  -4.713  -9.203  -5.711
  756    HA   ILE  93           HA       ILE  93  -7.523 -10.160  -5.307
  757    HB   ILE  93           HB       ILE  93  -7.291 -12.009  -6.592
  758   HG12  ILE  93          HG12      ILE  93  -5.136 -12.911  -6.031
  759   HG13  ILE  93          HG13      ILE  93  -5.326 -12.822  -7.772
  760   HG21  ILE  93          HG21      ILE  93  -6.838 -11.211  -8.845
  761   HG22  ILE  93          HG22      ILE  93  -7.685  -9.984  -7.886
  762   HG23  ILE  93          HG23      ILE  93  -5.951  -9.814  -8.224
  763   HD11  ILE  93          HD11      ILE  93  -3.911 -10.650  -7.663
  764   HD12  ILE  93          HD12      ILE  93  -3.554 -11.144  -5.985
  765   HD13  ILE  93          HD13      ILE  93  -3.104 -12.185  -7.337
  766    H    GLY  94           H        GLY  94  -4.367 -10.092  -3.879
  767    HA2  GLY  94           HA2      GLY  94  -5.388 -11.543  -1.623
  768    HA3  GLY  94           HA3      GLY  94  -4.196 -12.484  -2.539
  769    H    GLN  95           H        GLN  95  -3.305 -12.079  -0.226
  770    HA   GLN  95           HA       GLN  95  -1.093 -10.223  -0.520
  771    HB2  GLN  95           HB2      GLN  95  -1.519  -9.213   1.774
  772    HB3  GLN  95           HB3      GLN  95  -2.515  -8.621   0.464
  773    HG2  GLN  95           HG2      GLN  95  -3.518 -10.796   2.328
  774    HG3  GLN  95           HG3      GLN  95  -3.605  -9.095   2.773
  775   HE21  GLN  95          HE22      GLN  95  -5.361 -11.583   1.231
  776   HE22  GLN  95          HE21      GLN  95  -6.501 -10.545   0.406
  777    H    LYS  96           H        LYS  96   0.585 -10.671   1.013
  778    HA   LYS  96           HA       LYS  96   0.346 -13.357   2.326
  779    HB2  LYS  96           HB2      LYS  96   2.776 -13.472   2.321
  780    HB3  LYS  96           HB3      LYS  96   2.132 -13.333   0.690
  781    HG2  LYS  96           HG2      LYS  96   2.712 -10.922   0.652
  782    HG3  LYS  96           HG3      LYS  96   3.409 -11.049   2.271
  783    HD2  LYS  96           HD2      LYS  96   4.373 -12.601  -0.168
  784    HD3  LYS  96           HD3      LYS  96   5.054 -11.065   0.372
  785    HE2  LYS  96           HE2      LYS  96   5.678 -12.104   2.567
  786    HE3  LYS  96           HE3      LYS  96   5.037 -13.651   2.012
  787    HZ1  LYS  96           HZ1      LYS  96   7.319 -12.202   0.767
  788    HZ2  LYS  96           HZ2      LYS  96   7.429 -13.542   1.690
  789    HZ3  LYS  96           HZ3      LYS  96   6.711 -13.624   0.222
  790    H    GLN  97           H        GLN  97   0.324 -13.319   4.600
  791    HA   GLN  97           HA       GLN  97   0.906 -10.679   5.834
  792    HB2  GLN  97           HB2      GLN  97  -1.535 -11.326   5.576
  793    HB3  GLN  97           HB3      GLN  97  -1.252 -12.556   6.815
  794    HG2  GLN  97           HG2      GLN  97  -0.586 -10.774   8.418
  795    HG3  GLN  97           HG3      GLN  97  -0.654  -9.573   7.145
  796   HE21  GLN  97          HE22      GLN  97  -2.271  -8.257   8.067
  797   HE22  GLN  97          HE21      GLN  97  -3.920  -8.782   8.313
  798    H    LYS  98           H        LYS  98   2.510 -10.723   7.264
  799    HA   LYS  98           HA       LYS  98   3.250 -13.314   8.578
  800    HB2  LYS  98           HB2      LYS  98   5.017 -12.115   7.359
  801    HB3  LYS  98           HB3      LYS  98   4.766 -10.671   8.377
  802    HG2  LYS  98           HG2      LYS  98   5.745 -11.682  10.208
  803    HG3  LYS  98           HG3      LYS  98   5.481 -13.336   9.627
  804    HD2  LYS  98           HD2      LYS  98   7.337 -11.492   8.131
  805    HD3  LYS  98           HD3      LYS  98   7.906 -12.254   9.609
  806    HE2  LYS  98           HE2      LYS  98   6.643 -13.951   7.413
  807    HE3  LYS  98           HE3      LYS  98   8.288 -13.353   7.225
  808    HZ1  LYS  98           HZ1      LYS  98   8.915 -14.464   9.296
  809    HZ2  LYS  98           HZ2      LYS  98   7.401 -15.086   9.498
  810    HZ3  LYS  98           HZ3      LYS  98   8.324 -15.532   8.227
  811    H    TRP  99           H        TRP  99   3.464 -13.270  10.939
  812    HA   TRP  99           HA       TRP  99   1.971 -11.039  12.240
  813    HB2  TRP  99           HB2      TRP  99   1.549 -14.032  12.394
  814    HB3  TRP  99           HB3      TRP  99   0.919 -12.899  13.586
  815    HD1  TRP  99           HD1      TRP  99   0.382 -13.955   9.948
  816    HE1  TRP  99           HE1      TRP  99  -1.902 -13.042   9.175
  817    HE3  TRP  99           HE3      TRP  99  -0.638 -10.932  13.922
  818    HZ2  TRP  99           HZ2      TRP  99  -3.909 -11.209  10.188
  819    HZ3  TRP  99           HZ3      TRP  99  -2.618  -9.487  13.929
  820    HH2  TRP  99           HH2      TRP  99  -4.291  -9.621  12.053
  821    H    PHE 100           H        PHE 100   2.548 -10.631  14.393
  822    HA   PHE 100           HA       PHE 100   4.971 -12.012  15.453
  823    HB2  PHE 100           HB2      PHE 100   4.427  -9.023  15.217
  824    HB3  PHE 100           HB3      PHE 100   5.742  -9.735  16.139
  825    HD1  PHE 100           HD1      PHE 100   4.372  -9.343  12.646
  826    HD2  PHE 100           HD2      PHE 100   7.828 -10.229  15.102
  827    HE1  PHE 100           HE1      PHE 100   5.849  -9.182  10.678
  828    HE2  PHE 100           HE2      PHE 100   9.275 -10.103  13.108
  829    HZ   PHE 100           HZ       PHE 100   8.299  -9.595  10.892
  830    H    LEU 101           H        LEU 101   4.680 -12.574  17.595
  831    HA   LEU 101           HA       LEU 101   2.410 -11.422  19.163
  832    HB2  LEU 101           HB2      LEU 101   2.919 -13.943  19.146
  833    HB3  LEU 101           HB3      LEU 101   4.431 -13.548  19.968
  834    HG   LEU 101           HG       LEU 101   1.629 -13.579  20.956
  835   HD11  LEU 101          HD11      LEU 101   3.390 -15.496  21.239
  836   HD12  LEU 101          HD12      LEU 101   4.176 -14.430  22.400
  837   HD13  LEU 101          HD13      LEU 101   2.513 -14.978  22.677
  838   HD21  LEU 101          HD21      LEU 101   2.207 -11.358  21.750
  839   HD22  LEU 101          HD22      LEU 101   2.324 -12.482  23.101
  840   HD23  LEU 101          HD23      LEU 101   3.809 -11.941  22.318
  841    H    LEU 102           H        LEU 102   2.996  -9.603  20.367
  842    HA   LEU 102           HA       LEU 102   5.812  -9.526  21.327
  843    HB2  LEU 102           HB2      LEU 102   4.156  -7.023  21.197
  844    HB3  LEU 102           HB3      LEU 102   5.895  -7.193  21.258
  845    HG   LEU 102           HG       LEU 102   4.152  -7.802  18.856
  846   HD11  LEU 102          HD11      LEU 102   5.939  -5.394  19.329
  847   HD12  LEU 102          HD12      LEU 102   4.849  -5.687  17.961
  848   HD13  LEU 102          HD13      LEU 102   4.170  -5.399  19.569
  849   HD21  LEU 102          HD21      LEU 102   7.172  -7.588  19.164
  850   HD22  LEU 102          HD22      LEU 102   6.256  -9.072  18.776
  851   HD23  LEU 102          HD23      LEU 102   6.313  -7.745  17.608
  852    H    GLN 103           H        GLN 103   5.996  -9.290  23.632
  853    HA   GLN 103           HA       GLN 103   3.345  -9.015  25.001
  854    HB2  GLN 103           HB2      GLN 103   4.437 -10.768  25.940
  855    HB3  GLN 103           HB3      GLN 103   5.978  -9.928  26.108
  856    HG2  GLN 103           HG2      GLN 103   5.178  -8.664  27.978
  857    HG3  GLN 103           HG3      GLN 103   3.508  -8.691  27.414
  858   HE21  GLN 103          HE22      GLN 103   2.374 -10.913  27.424
  859   HE22  GLN 103          HE21      GLN 103   2.672 -11.890  28.852
  860    H    LEU 104           H        LEU 104   2.797  -7.135  25.823
  861    HA   LEU 104           HA       LEU 104   4.248  -4.679  25.329
  862    HB2  LEU 104           HB2      LEU 104   1.990  -4.944  24.907
  863    HB3  LEU 104           HB3      LEU 104   1.604  -5.622  26.509
  864    HG   LEU 104           HG       LEU 104   1.680  -3.451  27.479
  865   HD11  LEU 104          HD11      LEU 104   2.712  -2.572  24.770
  866   HD12  LEU 104          HD12      LEU 104   2.024  -1.431  25.966
  867   HD13  LEU 104          HD13      LEU 104   3.465  -2.369  26.364
  868   HD21  LEU 104          HD21      LEU 104   0.181  -3.527  24.791
  869   HD22  LEU 104          HD22      LEU 104  -0.377  -4.246  26.299
  870   HD23  LEU 104          HD23      LEU 104  -0.227  -2.477  26.176
  871    H    VAL 105           H        VAL 105   5.420  -3.523  26.825
  872    HA   VAL 105           HA       VAL 105   6.520  -5.130  28.957
  873    HB   VAL 105           HB       VAL 105   7.179  -2.382  27.894
  874   HG11  VAL 105          HG11      VAL 105   9.388  -2.611  28.996
  875   HG12  VAL 105          HG12      VAL 105   8.070  -2.516  30.169
  876   HG13  VAL 105          HG13      VAL 105   8.821  -4.088  29.809
  877   HG21  VAL 105          HG21      VAL 105   8.924  -3.372  26.619
  878   HG22  VAL 105          HG22      VAL 105   8.797  -4.922  27.479
  879   HG23  VAL 105          HG23      VAL 105   7.542  -4.423  26.344
  880    H    SER 106           H        SER 106   4.912  -1.903  28.913
  881    HA   SER 106           HA       SER 106   4.845  -1.911  31.864
  882    HB2  SER 106           HB2      SER 106   3.834   0.091  29.821
  883    HB3  SER 106           HB3      SER 106   3.866   0.332  31.576
  884    HG   SER 106           HG       SER 106   5.974   0.241  29.714
  885    H    GLY 107           H        GLY 107   2.761  -2.853  29.283
  886    HA2  GLY 107           HA2      GLY 107   0.894  -4.331  29.744
  887    HA3  GLY 107           HA3      GLY 107   0.567  -3.428  31.221
  888    H    ASP 108           H        ASP 108  -1.608  -3.437  30.157
  889    HA   ASP 108           HA       ASP 108  -2.221  -2.237  27.775
  890    HB2  ASP 108           HB2      ASP 108  -4.455  -2.420  28.451
  891    HB3  ASP 108           HB3      ASP 108  -3.595  -3.736  29.247
  892    H    ALA 109           H        ALA 109  -1.421  -0.698  30.719
  893    HA   ALA 109           HA       ALA 109  -2.527   1.875  30.490
  894    HB1  ALA 109           HB1      ALA 109   0.267   1.073  31.422
  895    HB2  ALA 109           HB2      ALA 109  -0.548   2.610  31.785
  896    HB3  ALA 109           HB3      ALA 109  -1.200   1.088  32.432
  897    H    GLU 110           H        GLU 110   0.086   0.433  28.571
  898    HA   GLU 110           HA       GLU 110   0.765   3.048  27.492
  899    HB2  GLU 110           HB2      GLU 110   2.237   0.440  27.666
  900    HB3  GLU 110           HB3      GLU 110   2.736   1.584  26.421
  901    HG2  GLU 110           HG2      GLU 110   2.514   2.251  29.369
  902    HG3  GLU 110           HG3      GLU 110   4.007   1.813  28.533
  903    H    ILE 111           H        ILE 111  -1.632   1.659  26.745
  904    HA   ILE 111           HA       ILE 111  -1.307   1.425  23.783
  905    HB   ILE 111           HB       ILE 111  -3.839   1.009  25.416
  906   HG12  ILE 111          HG12      ILE 111  -2.052  -1.193  24.267
  907   HG13  ILE 111          HG13      ILE 111  -1.988  -0.716  25.949
  908   HG21  ILE 111          HG21      ILE 111  -3.125   0.106  22.569
  909   HG22  ILE 111          HG22      ILE 111  -4.720   0.027  23.358
  910   HG23  ILE 111          HG23      ILE 111  -4.032   1.590  22.940
  911   HD11  ILE 111          HD11      ILE 111  -4.359  -1.294  26.279
  912   HD12  ILE 111          HD12      ILE 111  -4.483  -1.798  24.592
  913   HD13  ILE 111          HD13      ILE 111  -3.413  -2.676  25.689
  914    H    ASN 112           H        ASN 112  -1.342   3.399  22.766
  915    HA   ASN 112           HA       ASN 112  -2.251   5.726  24.357
  916    HB2  ASN 112           HB2      ASN 112  -0.002   5.787  23.440
  917    HB3  ASN 112           HB3      ASN 112  -0.616   5.563  21.799
  918   HD21  ASN 112          HD22      ASN 112   0.336   7.629  21.120
  919   HD22  ASN 112          HD21      ASN 112  -0.481   9.120  21.542
  920    H    MET 113           H        MET 113  -2.632   4.600  20.991
  921    HA   MET 113           HA       MET 113  -4.262   4.630  19.479
  922    HB2  MET 113           HB2      MET 113  -6.332   5.462  21.522
  923    HB3  MET 113           HB3      MET 113  -6.542   4.588  20.013
  924    HG2  MET 113           HG2      MET 113  -4.891   2.846  21.157
  925    HG3  MET 113           HG3      MET 113  -5.458   3.615  22.638
  926    HE1  MET 113           HE1      MET 113  -5.795   0.416  21.214
  927    HE2  MET 113           HE2      MET 113  -7.321   0.300  20.318
  928    HE3  MET 113           HE3      MET 113  -6.021   1.351  19.718
  929    H    GLN 114           H        GLN 114  -3.005   7.408  20.623
  930    HA   GLN 114           HA       GLN 114  -4.397   9.040  18.666
  931    HB2  GLN 114           HB2      GLN 114  -4.706  10.872  20.275
  932    HB3  GLN 114           HB3      GLN 114  -5.843   9.521  20.368
  933    HG2  GLN 114           HG2      GLN 114  -4.809   8.628  22.350
  934    HG3  GLN 114           HG3      GLN 114  -3.518   9.824  22.299
  935   HE21  GLN 114          HE22      GLN 114  -4.125  12.156  22.645
  936   HE22  GLN 114          HE21      GLN 114  -5.540  12.520  23.607
  937    H    THR 115           H        THR 115  -2.532   8.691  17.709
  938    HA   THR 115           HA       THR 115   0.013   9.825  18.548
  939    HB   THR 115           HB       THR 115   0.359   9.225  16.010
  940    HG1  THR 115           HG1      THR 115  -1.145   7.717  15.242
  941   HG21  THR 115          HG21      THR 115   0.669   6.809  16.630
  942   HG22  THR 115          HG22      THR 115   1.209   7.844  17.968
  943   HG23  THR 115          HG23      THR 115  -0.377   7.041  18.058
  944    H    SER 116           H        SER 116  -2.234  10.252  15.901
  945    HA   SER 116           HA       SER 116  -1.812  13.039  15.328
  946    HB2  SER 116           HB2      SER 116  -4.248  11.272  14.825
  947    HB3  SER 116           HB3      SER 116  -3.861  12.780  13.981
  948    HG   SER 116           HG       SER 116  -3.313  10.492  13.169
  949    H    SER 117           H        SER 117  -3.612  14.745  15.622
  950    HA   SER 117           HA       SER 117  -4.251  15.100  18.353
  951    HB2  SER 117           HB2      SER 117  -5.610  16.391  15.954
  952    HB3  SER 117           HB3      SER 117  -5.468  17.049  17.594
  953    HG   SER 117           HG       SER 117  -3.910  17.955  16.156
  954    H    THR 118           H        THR 118  -6.070  13.758  15.606
  955    HA   THR 118           HA       THR 118  -8.437  13.086  17.122
  956    HB   THR 118           HB       THR 118  -8.346  11.622  14.807
  957    HG1  THR 118           HG1      THR 118  -7.875  13.110  13.172
  958   HG21  THR 118          HG21      THR 118 -10.289  12.536  15.776
  959   HG22  THR 118          HG22      THR 118  -9.758  14.207  15.430
  960   HG23  THR 118          HG23      THR 118 -10.174  13.081  14.096
  961    HA   PRO 119           HA       PRO 119  -6.629   9.163  18.358
  962    HB2  PRO 119           HB2      PRO 119  -9.519   8.305  18.300
  963    HB3  PRO 119           HB3      PRO 119  -8.271   7.993  19.550
  964    HG2  PRO 119           HG2      PRO 119 -10.147   9.926  19.949
  965    HG3  PRO 119           HG3      PRO 119  -8.432  10.221  20.387
  966    HD2  PRO 119           HD2      PRO 119  -9.903  11.137  17.887
  967    HD3  PRO 119           HD3      PRO 119  -8.752  12.048  18.919
  968    H    GLU 120           H        GLU 120  -5.924   7.559  17.058
  969    HA   GLU 120           HA       GLU 120  -6.986   7.291  14.311
  970    HB2  GLU 120           HB2      GLU 120  -4.621   5.977  15.734
  971    HB3  GLU 120           HB3      GLU 120  -5.090   5.593  14.087
  972    HG2  GLU 120           HG2      GLU 120  -4.204   8.333  15.093
  973    HG3  GLU 120           HG3      GLU 120  -3.243   7.193  14.151
  974    H    PHE 121           H        PHE 121  -7.199   5.669  17.449
  975    HA   PHE 121           HA       PHE 121  -8.840   3.524  16.279
  976    HB2  PHE 121           HB2      PHE 121  -6.417   3.360  18.010
  977    HB3  PHE 121           HB3      PHE 121  -7.814   2.430  18.516
  978    HD1  PHE 121           HD1      PHE 121  -6.570   3.037  14.965
  979    HD2  PHE 121           HD2      PHE 121  -7.235   0.249  18.174
  980    HE1  PHE 121           HE1      PHE 121  -6.055   1.140  13.447
  981    HE2  PHE 121           HE2      PHE 121  -6.469  -1.593  16.722
  982    HZ   PHE 121           HZ       PHE 121  -5.999  -1.150  14.339
  983    H    ASP 122           H        ASP 122 -10.467   2.845  17.667
  984    HA   ASP 122           HA       ASP 122 -11.043   4.477  20.107
  985    HB2  ASP 122           HB2      ASP 122 -12.422   5.414  18.338
  986    HB3  ASP 122           HB3      ASP 122 -12.982   3.805  17.861
  987    H    GLY 123           H        GLY 123 -11.004   1.478  18.335
  988    HA2  GLY 123           HA2      GLY 123 -12.729   0.056  20.310
  989    HA3  GLY 123           HA3      GLY 123 -12.135  -0.575  18.765
  990    H    TRP 124           H        TRP 124 -11.669  -0.836  22.048
  991    HA   TRP 124           HA       TRP 124  -9.266  -2.416  21.554
  992    HB2  TRP 124           HB2      TRP 124  -8.028  -0.565  22.211
  993    HB3  TRP 124           HB3      TRP 124  -9.276   0.047  23.288
  994    HD1  TRP 124           HD1      TRP 124  -7.074  -3.159  23.216
  995    HE1  TRP 124           HE1      TRP 124  -6.465  -3.776  25.600
  996    HE3  TRP 124           HE3      TRP 124  -9.326   0.755  25.631
  997    HZ2  TRP 124           HZ2      TRP 124  -6.918  -2.681  28.303
  998    HZ3  TRP 124           HZ3      TRP 124  -9.233   0.936  28.099
  999    HH2  TRP 124           HH2      TRP 124  -8.026  -0.778  29.437
 1000    H    ARG 125           H        ARG 125  -9.477  -4.300  22.648
 1001    HA   ARG 125           HA       ARG 125 -10.590  -4.379  25.319
 1002    HB2  ARG 125           HB2      ARG 125 -12.265  -6.128  24.874
 1003    HB3  ARG 125           HB3      ARG 125 -12.654  -4.644  24.014
 1004    HG2  ARG 125           HG2      ARG 125 -11.499  -5.738  21.954
 1005    HG3  ARG 125           HG3      ARG 125 -11.585  -7.249  22.862
 1006    HD2  ARG 125           HD2      ARG 125 -13.999  -5.475  22.253
 1007    HD3  ARG 125           HD3      ARG 125 -13.456  -6.788  21.211
 1008    HE   ARG 125           HE       ARG 125 -13.963  -7.503  24.027
 1009   HH11  ARG 125          HH11      ARG 125 -15.434  -7.272  20.790
 1010   HH12  ARG 125          HH12      ARG 125 -16.619  -8.490  21.097
 1011   HH21  ARG 125          HH21      ARG 125 -15.568  -9.112  24.426
 1012   HH22  ARG 125          HH22      ARG 125 -16.652  -9.591  23.166
 1013    H    TRP 126           H        TRP 126 -10.192  -6.613  26.253
 1014    HA   TRP 126           HA       TRP 126  -8.002  -8.065  24.839
 1015    HB2  TRP 126           HB2      TRP 126  -8.410  -7.675  27.819
 1016    HB3  TRP 126           HB3      TRP 126  -7.312  -8.836  27.111
 1017    HD1  TRP 126           HD1      TRP 126  -7.710  -5.053  27.551
 1018    HE1  TRP 126           HE1      TRP 126  -5.391  -4.007  27.641
 1019    HE3  TRP 126           HE3      TRP 126  -4.919  -9.101  26.103
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.687  -4.755  27.055
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.462  -8.893  25.884
 1022    HH2  TRP 126           HH2      TRP 126  -1.332  -6.716  26.416
 1023    H    VAL 127           H        VAL 127  -8.325 -10.295  24.652
 1024    HA   VAL 127           HA       VAL 127 -10.833 -11.499  25.716
 1025    HB   VAL 127           HB       VAL 127 -11.052 -12.372  23.254
 1026   HG11  VAL 127          HG11      VAL 127 -12.754 -10.988  24.343
 1027   HG12  VAL 127          HG12      VAL 127 -11.831  -9.511  23.989
 1028   HG13  VAL 127          HG13      VAL 127 -12.540 -10.456  22.670
 1029   HG21  VAL 127          HG21      VAL 127  -9.624  -9.775  22.636
 1030   HG22  VAL 127          HG22      VAL 127  -8.995 -11.418  22.348
 1031   HG23  VAL 127          HG23      VAL 127 -10.437 -10.848  21.488
 1032    H    SER 128           H        SER 128 -10.806 -13.851  25.709
 1033    HA   SER 128           HA       SER 128  -8.282 -15.171  25.854
 1034    HB2  SER 128           HB2      SER 128 -11.068 -16.246  25.247
 1035    HB3  SER 128           HB3      SER 128  -9.684 -17.203  25.838
 1036    HG   SER 128           HG       SER 128 -11.158 -16.536  27.529
 1037    H    TYR 129           H        TYR 129  -7.136 -16.374  24.258
 1038    HA   TYR 129           HA       TYR 129  -7.055 -15.219  21.761
 1039    HB2  TYR 129           HB2      TYR 129  -5.808 -17.619  21.259
 1040    HB3  TYR 129           HB3      TYR 129  -5.093 -16.203  21.983
 1041    HD1  TYR 129           HD2      TYR 129  -7.136 -19.177  23.112
 1042    HD2  TYR 129           HD1      TYR 129  -3.746 -16.606  23.874
 1043    HE1  TYR 129           HE2      TYR 129  -6.694 -20.403  25.205
 1044    HE2  TYR 129           HE1      TYR 129  -3.274 -17.868  25.949
 1045    HH   TYR 129           HH       TYR 129  -5.355 -20.539  27.135
 1046    H    TRP 130           H        TRP 130  -9.177 -17.980  22.546
 1047    HA   TRP 130           HA       TRP 130  -9.588 -18.468  19.672
 1048    HB2  TRP 130           HB2      TRP 130 -10.933 -19.749  22.058
 1049    HB3  TRP 130           HB3      TRP 130 -11.014 -20.291  20.382
 1050    HD1  TRP 130           HD1      TRP 130  -9.427 -21.309  23.362
 1051    HE1  TRP 130           HE1      TRP 130  -7.178 -22.487  23.029
 1052    HE3  TRP 130           HE3      TRP 130  -8.514 -20.001  18.468
 1053    HZ2  TRP 130           HZ2      TRP 130  -5.219 -22.775  20.972
 1054    HZ3  TRP 130           HZ3      TRP 130  -6.455 -20.787  17.345
 1055    HH2  TRP 130           HH2      TRP 130  -4.792 -22.157  18.584
 1056    H    TYR 131           H        TYR 131 -11.052 -16.387  22.034
 1057    HA   TYR 131           HA       TYR 131 -13.705 -16.355  20.954
 1058    HB2  TYR 131           HB2      TYR 131 -13.245 -15.586  23.184
 1059    HB3  TYR 131           HB3      TYR 131 -12.174 -14.327  22.602
 1060    HD1  TYR 131           HD1      TYR 131 -13.086 -12.347  21.349
 1061    HD2  TYR 131           HD2      TYR 131 -15.672 -15.290  23.168
 1062    HE1  TYR 131           HE1      TYR 131 -14.969 -10.764  21.216
 1063    HE2  TYR 131           HE2      TYR 131 -17.561 -13.703  23.051
 1064    HH   TYR 131           HH       TYR 131 -18.279 -11.558  22.399
 1065    HA   PRO 132           HA       PRO 132 -12.410 -12.361  18.612
 1066    HB2  PRO 132           HB2      PRO 132  -9.822 -12.152  17.633
 1067    HB3  PRO 132           HB3      PRO 132 -10.393 -11.481  19.196
 1068    HG2  PRO 132           HG2      PRO 132  -8.950 -14.087  18.688
 1069    HG3  PRO 132           HG3      PRO 132  -8.594 -12.824  19.920
 1070    HD2  PRO 132           HD2      PRO 132 -10.010 -14.982  20.552
 1071    HD3  PRO 132           HD3      PRO 132 -10.511 -13.395  21.194
 1072    H    VAL 133           H        VAL 133 -10.984 -15.461  17.772
 1073    HA   VAL 133           HA       VAL 133 -10.923 -15.245  14.942
 1074    HB   VAL 133           HB       VAL 133 -11.372 -17.684  16.727
 1075   HG11  VAL 133          HG11      VAL 133 -11.804 -18.203  14.363
 1076   HG12  VAL 133          HG12      VAL 133 -10.216 -17.533  13.903
 1077   HG13  VAL 133          HG13      VAL 133 -10.336 -18.992  14.922
 1078   HG21  VAL 133          HG21      VAL 133  -9.303 -16.535  17.434
 1079   HG22  VAL 133          HG22      VAL 133  -8.917 -18.033  16.605
 1080   HG23  VAL 133          HG23      VAL 133  -8.738 -16.477  15.750
 1081    H    ARG 134           H        ARG 134 -13.591 -15.928  17.261
 1082    HA   ARG 134           HA       ARG 134 -15.357 -17.053  15.276
 1083    HB2  ARG 134           HB2      ARG 134 -15.953 -15.838  17.991
 1084    HB3  ARG 134           HB3      ARG 134 -17.072 -16.754  16.974
 1085    HG2  ARG 134           HG2      ARG 134 -15.144 -18.591  16.997
 1086    HG3  ARG 134           HG3      ARG 134 -14.607 -17.723  18.452
 1087    HD2  ARG 134           HD2      ARG 134 -16.914 -17.973  19.377
 1088    HD3  ARG 134           HD3      ARG 134 -17.361 -18.860  17.897
 1089    HE   ARG 134           HE       ARG 134 -15.092 -20.123  19.017
 1090   HH11  ARG 134          HH11      ARG 134 -18.524 -19.665  19.841
 1091   HH12  ARG 134          HH12      ARG 134 -18.651 -21.133  20.742
 1092   HH21  ARG 134          HH21      ARG 134 -15.262 -22.082  20.230
 1093   HH22  ARG 134          HH22      ARG 134 -16.758 -22.530  20.966
 1094    H    GLN 135           H        GLN 135 -14.449 -13.687  15.896
 1095    HA   GLN 135           HA       GLN 135 -17.045 -12.682  14.929
 1096    HB2  GLN 135           HB2      GLN 135 -14.459 -11.259  15.632
 1097    HB3  GLN 135           HB3      GLN 135 -15.822 -10.447  14.888
 1098    HG2  GLN 135           HG2      GLN 135 -16.260  -9.971  17.065
 1099    HG3  GLN 135           HG3      GLN 135 -17.244 -11.419  16.870
 1100   HE21  GLN 135          HE22      GLN 135 -16.596 -13.350  18.068
 1101   HE22  GLN 135          HE21      GLN 135 -15.206 -13.360  19.133
 1102    H    VAL 136           H        VAL 136 -13.896 -13.412  13.410
 1103    HA   VAL 136           HA       VAL 136 -14.543 -11.670  11.180
 1104    HB   VAL 136           HB       VAL 136 -12.368 -12.373  10.334
 1105   HG11  VAL 136          HG11      VAL 136 -11.018 -11.198  11.998
 1106   HG12  VAL 136          HG12      VAL 136 -12.591 -10.406  11.807
 1107   HG13  VAL 136          HG13      VAL 136 -12.289 -11.425  13.223
 1108   HG21  VAL 136          HG21      VAL 136 -12.275 -14.652  11.357
 1109   HG22  VAL 136          HG22      VAL 136 -10.795 -13.683  11.529
 1110   HG23  VAL 136          HG23      VAL 136 -11.887 -13.877  12.917
 1111    H    VAL 137           H        VAL 137 -14.580 -12.333   8.936
 1112    HA   VAL 137           HA       VAL 137 -16.367 -14.542   8.507
 1113    HB   VAL 137           HB       VAL 137 -16.565 -13.840   6.333
 1114   HG11  VAL 137          HG11      VAL 137 -17.089 -11.918   7.849
 1115   HG12  VAL 137          HG12      VAL 137 -15.472 -11.247   7.493
 1116   HG13  VAL 137          HG13      VAL 137 -16.657 -11.457   6.196
 1117   HG21  VAL 137          HG21      VAL 137 -14.737 -12.563   5.091
 1118   HG22  VAL 137          HG22      VAL 137 -13.639 -13.021   6.429
 1119   HG23  VAL 137          HG23      VAL 137 -14.452 -14.276   5.454
 1120    H    SER 138           H        SER 138 -15.870 -16.291   6.900
 1121    HA   SER 138           HA       SER 138 -14.137 -18.073   8.018
 1122    HB2  SER 138           HB2      SER 138 -15.234 -17.988   5.190
 1123    HB3  SER 138           HB3      SER 138 -14.729 -19.464   6.062
 1124    HG   SER 138           HG       SER 138 -17.049 -18.986   6.163
 1125    H    PHE 139           H        PHE 139 -13.369 -16.258   4.938
 1126    HA   PHE 139           HA       PHE 139 -10.925 -17.721   4.631
 1127    HB2  PHE 139           HB2      PHE 139 -10.384 -16.277   2.842
 1128    HB3  PHE 139           HB3      PHE 139 -12.085 -16.651   2.764
 1129    HD1  PHE 139           HD1      PHE 139  -9.593 -14.003   3.558
 1130    HD2  PHE 139           HD2      PHE 139 -13.751 -14.874   2.819
 1131    HE1  PHE 139           HE1      PHE 139 -10.062 -11.575   3.301
 1132    HE2  PHE 139           HE2      PHE 139 -14.209 -12.449   2.588
 1133    HZ   PHE 139           HZ       PHE 139 -12.372 -10.799   2.839
 1134    H    LYS 140           H        LYS 140 -11.672 -14.740   6.404
 1135    HA   LYS 140           HA       LYS 140  -8.840 -14.247   7.085
 1136    HB2  LYS 140           HB2      LYS 140 -11.396 -13.073   8.272
 1137    HB3  LYS 140           HB3      LYS 140  -9.739 -12.536   8.609
 1138    HG2  LYS 140           HG2      LYS 140  -9.457 -12.138   6.102
 1139    HG3  LYS 140           HG3      LYS 140 -11.184 -12.434   5.919
 1140    HD2  LYS 140           HD2      LYS 140  -9.899 -10.202   7.535
 1141    HD3  LYS 140           HD3      LYS 140 -10.686 -10.063   5.944
 1142    HE2  LYS 140           HE2      LYS 140 -12.841 -10.784   6.944
 1143    HE3  LYS 140           HE3      LYS 140 -12.065 -10.902   8.535
 1144    HZ1  LYS 140           HZ1      LYS 140 -12.334  -8.395   6.931
 1145    HZ2  LYS 140           HZ2      LYS 140 -13.203  -8.751   8.266
 1146    HZ3  LYS 140           HZ3      LYS 140 -11.585  -8.491   8.391
 1147    H    ARG 141           H        ARG 141 -11.741 -15.646   8.671
 1148    HA   ARG 141           HA       ARG 141 -10.724 -16.336  11.091
 1149    HB2  ARG 141           HB2      ARG 141 -13.042 -16.841   9.799
 1150    HB3  ARG 141           HB3      ARG 141 -12.337 -18.458   9.615
 1151    HG2  ARG 141           HG2      ARG 141 -12.125 -18.630  12.025
 1152    HG3  ARG 141           HG3      ARG 141 -12.501 -16.898  12.160
 1153    HD2  ARG 141           HD2      ARG 141 -14.424 -18.212  12.898
 1154    HD3  ARG 141           HD3      ARG 141 -14.783 -17.239  11.481
 1155    HE   ARG 141           HE       ARG 141 -14.211 -20.189  11.460
 1156   HH11  ARG 141          HH11      ARG 141 -16.111 -17.458  10.188
 1157   HH12  ARG 141          HH12      ARG 141 -16.699 -18.348   8.810
 1158   HH21  ARG 141          HH21      ARG 141 -15.223 -21.412   9.780
 1159   HH22  ARG 141          HH22      ARG 141 -16.334 -20.655   8.700
 1160    H    ASP 142           H        ASP 142 -10.048 -18.178   8.069
 1161    HA   ASP 142           HA       ASP 142  -8.587 -20.222   9.389
 1162    HB2  ASP 142           HB2      ASP 142  -9.261 -20.426   7.040
 1163    HB3  ASP 142           HB3      ASP 142  -8.109 -19.143   6.599
 1164    H    VAL 143           H        VAL 143  -7.469 -17.055   8.118
 1165    HA   VAL 143           HA       VAL 143  -4.710 -17.453   8.859
 1166    HB   VAL 143           HB       VAL 143  -6.410 -14.964   8.378
 1167   HG11  VAL 143          HG11      VAL 143  -3.453 -15.059   9.043
 1168   HG12  VAL 143          HG12      VAL 143  -4.286 -13.660   8.322
 1169   HG13  VAL 143          HG13      VAL 143  -4.719 -14.186   9.948
 1170   HG21  VAL 143          HG21      VAL 143  -5.976 -16.290   6.392
 1171   HG22  VAL 143          HG22      VAL 143  -5.038 -14.794   6.342
 1172   HG23  VAL 143          HG23      VAL 143  -4.239 -16.327   6.752
 1173    H    TYR 144           H        TYR 144  -7.499 -15.903  10.554
 1174    HA   TYR 144           HA       TYR 144  -5.882 -15.049  12.721
 1175    HB2  TYR 144           HB2      TYR 144  -8.874 -15.316  12.354
 1176    HB3  TYR 144           HB3      TYR 144  -8.165 -14.758  13.854
 1177    HD1  TYR 144           HD1      TYR 144  -7.141 -13.870  10.265
 1178    HD2  TYR 144           HD2      TYR 144  -8.709 -12.511  14.047
 1179    HE1  TYR 144           HE1      TYR 144  -7.087 -11.598   9.432
 1180    HE2  TYR 144           HE2      TYR 144  -8.692 -10.178  13.171
 1181    HH   TYR 144           HH       TYR 144  -7.683  -9.402   9.816
 1182    H    ARG 145           H        ARG 145  -7.723 -18.133  12.317
 1183    HA   ARG 145           HA       ARG 145  -7.079 -18.962  15.019
 1184    HB2  ARG 145           HB2      ARG 145  -8.015 -21.008  14.528
 1185    HB3  ARG 145           HB3      ARG 145  -8.870 -19.917  13.448
 1186    HG2  ARG 145           HG2      ARG 145  -6.927 -20.700  11.756
 1187    HG3  ARG 145           HG3      ARG 145  -6.905 -22.110  12.823
 1188    HD2  ARG 145           HD2      ARG 145  -9.374 -22.339  12.394
 1189    HD3  ARG 145           HD3      ARG 145  -9.269 -20.909  11.354
 1190    HE   ARG 145           HE       ARG 145  -7.931 -22.096   9.753
 1191   HH11  ARG 145          HH21      ARG 145  -9.165 -24.341  12.247
 1192   HH12  ARG 145          HH22      ARG 145  -8.938 -25.725  11.240
 1193   HH21  ARG 145          HH11      ARG 145  -7.705 -23.779   8.499
 1194   HH22  ARG 145          HH12      ARG 145  -8.076 -25.419   9.008
 1195    H    ARG 146           H        ARG 146  -5.313 -19.348  11.858
 1196    HA   ARG 146           HA       ARG 146  -3.189 -20.865  13.009
 1197    HB2  ARG 146           HB2      ARG 146  -3.538 -19.169  10.488
 1198    HB3  ARG 146           HB3      ARG 146  -1.909 -19.543  11.026
 1199    HG2  ARG 146           HG2      ARG 146  -2.269 -21.292   9.623
 1200    HG3  ARG 146           HG3      ARG 146  -2.661 -21.993  11.188
 1201    HD2  ARG 146           HD2      ARG 146  -5.114 -21.577  10.622
 1202    HD3  ARG 146           HD3      ARG 146  -4.577 -21.100   9.002
 1203    HE   ARG 146           HE       ARG 146  -4.193 -23.784  10.305
 1204   HH11  ARG 146          HH11      ARG 146  -4.985 -22.063   7.275
 1205   HH12  ARG 146          HH12      ARG 146  -4.453 -23.354   6.267
 1206   HH21  ARG 146          HH21      ARG 146  -3.689 -25.553   8.945
 1207   HH22  ARG 146          HH22      ARG 146  -3.857 -25.420   7.235
 1208    H    VAL 147           H        VAL 147  -3.543 -17.259  12.733
 1209    HA   VAL 147           HA       VAL 147  -1.090 -16.537  13.816
 1210    HB   VAL 147           HB       VAL 147  -3.817 -15.260  14.343
 1211   HG11  VAL 147          HG11      VAL 147  -2.601 -13.163  14.747
 1212   HG12  VAL 147          HG12      VAL 147  -2.110 -14.390  15.918
 1213   HG13  VAL 147          HG13      VAL 147  -1.048 -14.012  14.550
 1214   HG21  VAL 147          HG21      VAL 147  -1.701 -14.609  12.277
 1215   HG22  VAL 147          HG22      VAL 147  -3.257 -15.339  11.918
 1216   HG23  VAL 147          HG23      VAL 147  -3.219 -13.704  12.543
 1217    H    MET 148           H        MET 148  -3.999 -17.650  15.488
 1218    HA   MET 148           HA       MET 148  -2.997 -17.008  18.118
 1219    HB2  MET 148           HB2      MET 148  -5.457 -18.561  17.247
 1220    HB3  MET 148           HB3      MET 148  -5.049 -18.187  18.929
 1221    HG2  MET 148           HG2      MET 148  -5.504 -16.078  16.787
 1222    HG3  MET 148           HG3      MET 148  -6.729 -16.683  17.882
 1223    HE1  MET 148           HE1      MET 148  -3.878 -13.317  18.572
 1224    HE2  MET 148           HE2      MET 148  -2.974 -14.809  18.226
 1225    HE3  MET 148           HE3      MET 148  -4.206 -14.209  17.085
 1226    H    LYS 149           H        LYS 149  -3.534 -20.054  16.239
 1227    HA   LYS 149           HA       LYS 149  -2.509 -21.697  18.325
 1228    HB2  LYS 149           HB2      LYS 149  -2.955 -23.430  17.009
 1229    HB3  LYS 149           HB3      LYS 149  -3.994 -22.206  16.291
 1230    HG2  LYS 149           HG2      LYS 149  -3.214 -23.229  14.436
 1231    HG3  LYS 149           HG3      LYS 149  -2.109 -21.859  14.559
 1232    HD2  LYS 149           HD2      LYS 149  -0.323 -23.220  15.294
 1233    HD3  LYS 149           HD3      LYS 149  -1.417 -24.553  15.740
 1234    HE2  LYS 149           HE2      LYS 149  -1.994 -24.819  13.307
 1235    HE3  LYS 149           HE3      LYS 149  -0.789 -23.584  12.912
 1236    HZ1  LYS 149           HZ1      LYS 149   0.116 -25.822  12.669
 1237    HZ2  LYS 149           HZ2      LYS 149   0.920 -25.069  13.873
 1238    HZ3  LYS 149           HZ3      LYS 149  -0.212 -26.202  14.217
 1239    H    GLU 150           H        GLU 150  -0.833 -20.092  15.627
 1240    HA   GLU 150           HA       GLU 150   1.621 -21.296  15.807
 1241    HB2  GLU 150           HB2      GLU 150   0.731 -19.676  14.074
 1242    HB3  GLU 150           HB3      GLU 150   0.942 -18.387  15.246
 1243    HG2  GLU 150           HG2      GLU 150   2.922 -18.272  14.088
 1244    HG3  GLU 150           HG3      GLU 150   3.393 -19.338  15.399
 1245    H    PHE 151           H        PHE 151   0.316 -18.518  17.642
 1246    HA   PHE 151           HA       PHE 151   2.803 -18.358  19.229
 1247    HB2  PHE 151           HB2      PHE 151   0.368 -16.565  19.256
 1248    HB3  PHE 151           HB3      PHE 151   1.930 -16.241  19.977
 1249    HD1  PHE 151           HD1      PHE 151   3.708 -17.205  17.474
 1250    HD2  PHE 151           HD2      PHE 151   0.317 -14.539  17.956
 1251    HE1  PHE 151           HE1      PHE 151   4.105 -16.283  15.306
 1252    HE2  PHE 151           HE2      PHE 151   0.916 -13.442  15.832
 1253    HZ   PHE 151           HZ       PHE 151   2.781 -14.375  14.446
 1254    H    ALA 152           H        ALA 152  -0.354 -19.729  19.650
 1255    HA   ALA 152           HA       ALA 152  -0.957 -19.301  22.296
 1256    HB1  ALA 152           HB1      ALA 152  -2.090 -21.561  22.166
 1257    HB2  ALA 152           HB2      ALA 152  -2.457 -20.521  20.785
 1258    HB3  ALA 152           HB3      ALA 152  -1.281 -21.836  20.605
 1259    H    SER 153           H        SER 153   1.377 -21.587  20.961
 1260    HA   SER 153           HA       SER 153   1.804 -23.040  23.394
 1261    HB2  SER 153           HB2      SER 153   3.623 -22.811  20.958
 1262    HB3  SER 153           HB3      SER 153   3.609 -24.122  22.158
 1263    HG   SER 153           HG       SER 153   2.435 -24.711  20.273
 1264    H    VAL 154           H        VAL 154   3.186 -20.110  22.002
 1265    HA   VAL 154           HA       VAL 154   5.358 -19.909  23.941
 1266    HB   VAL 154           HB       VAL 154   4.051 -17.698  22.295
 1267   HG11  VAL 154          HG11      VAL 154   5.325 -16.860  24.247
 1268   HG12  VAL 154          HG12      VAL 154   6.744 -17.786  23.704
 1269   HG13  VAL 154          HG13      VAL 154   6.112 -16.459  22.705
 1270   HG21  VAL 154          HG21      VAL 154   6.398 -19.534  21.665
 1271   HG22  VAL 154          HG22      VAL 154   4.913 -19.273  20.709
 1272   HG23  VAL 154          HG23      VAL 154   6.122 -17.997  20.833
 1273    H    VAL 155           H        VAL 155   2.008 -18.654  23.584
 1274    HA   VAL 155           HA       VAL 155   2.140 -16.976  25.818
 1275    HB   VAL 155           HB       VAL 155  -0.342 -18.330  24.699
 1276   HG11  VAL 155          HG11      VAL 155  -1.442 -16.258  25.749
 1277   HG12  VAL 155          HG12      VAL 155  -0.870 -17.471  26.906
 1278   HG13  VAL 155          HG13      VAL 155   0.098 -16.006  26.644
 1279   HG21  VAL 155          HG21      VAL 155   0.866 -16.875  23.036
 1280   HG22  VAL 155          HG22      VAL 155  -0.686 -16.196  23.525
 1281   HG23  VAL 155          HG23      VAL 155   0.828 -15.548  24.220
 1282    H    MET 156           H        MET 156   1.148 -20.483  25.781
 1283    HA   MET 156           HA       MET 156   0.290 -20.644  28.383
 1284    HB2  MET 156           HB2      MET 156   2.132 -22.641  26.937
 1285    HB3  MET 156           HB3      MET 156   1.107 -23.034  28.320
 1286    HG2  MET 156           HG2      MET 156   0.227 -22.331  25.520
 1287    HG3  MET 156           HG3      MET 156   0.028 -23.862  26.336
 1288    HE1  MET 156           HE1      MET 156  -2.262 -22.856  24.768
 1289    HE2  MET 156           HE2      MET 156  -3.461 -21.792  25.530
 1290    HE3  MET 156           HE3      MET 156  -1.933 -21.109  24.940
 1291    H    SER 157           H        SER 157   3.592 -20.960  27.176
 1292    HA   SER 157           HA       SER 157   4.811 -21.332  29.743
 1293    HB2  SER 157           HB2      SER 157   5.661 -20.984  26.867
 1294    HB3  SER 157           HB3      SER 157   6.881 -21.147  28.174
 1295    HG   SER 157           HG       SER 157   6.310 -23.175  27.218
 1296    H    LEU 158           H        LEU 158   4.089 -18.515  27.704
 1297    HA   LEU 158           HA       LEU 158   5.831 -16.628  28.814
 1298    HB2  LEU 158           HB2      LEU 158   4.214 -16.633  26.730
 1299    HB3  LEU 158           HB3      LEU 158   2.963 -16.102  27.865
 1300    HG   LEU 158           HG       LEU 158   5.481 -14.739  26.913
 1301   HD11  LEU 158          HD11      LEU 158   3.513 -14.619  25.478
 1302   HD12  LEU 158          HD12      LEU 158   2.477 -14.132  26.841
 1303   HD13  LEU 158          HD13      LEU 158   3.711 -13.014  26.235
 1304   HD21  LEU 158          HD21      LEU 158   5.056 -12.838  28.297
 1305   HD22  LEU 158          HD22      LEU 158   3.669 -13.689  29.094
 1306   HD23  LEU 158          HD23      LEU 158   5.337 -14.225  29.322
 1307    H    GLN 159           H        GLN 159   2.583 -17.778  29.810
 1308    HA   GLN 159           HA       GLN 159   2.172 -15.962  31.926
 1309    HB2  GLN 159           HB2      GLN 159   1.191 -18.834  32.001
 1310    HB3  GLN 159           HB3      GLN 159   0.466 -17.410  32.746
 1311    HG2  GLN 159           HG2      GLN 159  -0.004 -16.534  30.377
 1312    HG3  GLN 159           HG3      GLN 159   0.524 -18.131  29.816
 1313   HE21  GLN 159          HE22      GLN 159  -1.770 -16.909  32.351
 1314   HE22  GLN 159          HE21      GLN 159  -2.983 -18.139  32.007
 1315    H    GLU 160           H        GLU 160   4.291 -18.703  31.830
 1316    HA   GLU 160           HA       GLU 160   4.569 -18.759  34.747
 1317    HB2  GLU 160           HB2      GLU 160   5.517 -20.719  32.626
 1318    HB3  GLU 160           HB3      GLU 160   5.603 -20.949  34.375
 1319    HG2  GLU 160           HG2      GLU 160   3.071 -20.717  34.438
 1320    HG3  GLU 160           HG3      GLU 160   3.095 -20.757  32.671
 1321    H    ASN 161           H        ASN 161   6.312 -17.597  31.962
 1322    HA   ASN 161           HA       ASN 161   8.929 -17.827  33.411
 1323    HB2  ASN 161           HB2      ASN 161   8.198 -17.870  30.469
 1324    HB3  ASN 161           HB3      ASN 161   9.831 -17.552  31.029
 1325   HD21  ASN 161          HD22      ASN 161   7.292 -20.041  30.933
 1326   HD22  ASN 161          HD21      ASN 161   8.356 -21.392  31.313
 1327    H    THR 162           H        THR 162   6.601 -15.505  32.211
 1328    HA   THR 162           HA       THR 162   6.733 -13.430  31.389
 1329    HB   THR 162           HB       THR 162   7.116 -12.016  33.191
 1330    HG1  THR 162           HG1      THR 162   9.220 -12.827  33.880
 1331   HG21  THR 162          HG21      THR 162   5.301 -13.728  33.373
 1332   HG22  THR 162          HG22      THR 162   6.349 -14.657  34.458
 1333   HG23  THR 162          HG23      THR 162   5.811 -13.027  34.923
 1334    HA   PRO 163           HA       PRO 163  10.895 -14.247  29.852
 1335    HB2  PRO 163           HB2      PRO 163   9.761 -13.737  27.106
 1336    HB3  PRO 163           HB3      PRO 163  10.933 -14.987  27.645
 1337    HG2  PRO 163           HG2      PRO 163   8.302 -15.623  27.291
 1338    HG3  PRO 163           HG3      PRO 163   9.200 -16.250  28.719
 1339    HD2  PRO 163           HD2      PRO 163   7.464 -13.750  28.559
 1340    HD3  PRO 163           HD3      PRO 163   7.348 -15.126  29.717
 1341    H    LYS 164           H        LYS 164  12.542 -12.944  28.605
 1342    HA   LYS 164           HA       LYS 164  12.187 -10.232  29.520
 1343    HB2  LYS 164           HB2      LYS 164  14.655 -11.381  28.169
 1344    HB3  LYS 164           HB3      LYS 164  14.574 -10.027  29.290
 1345    HG2  LYS 164           HG2      LYS 164  14.099 -12.974  29.961
 1346    HG3  LYS 164           HG3      LYS 164  15.538 -12.037  30.341
 1347    HD2  LYS 164           HD2      LYS 164  14.301 -10.612  31.883
 1348    HD3  LYS 164           HD3      LYS 164  12.768 -11.400  31.456
 1349    HE2  LYS 164           HE2      LYS 164  13.591 -13.566  32.275
 1350    HE3  LYS 164           HE3      LYS 164  15.161 -12.846  32.669
 1351    HZ1  LYS 164           HZ1      LYS 164  12.574 -12.112  33.937
 1352    HZ2  LYS 164           HZ2      LYS 164  13.747 -13.012  34.627
 1353    HZ3  LYS 164           HZ3      LYS 164  14.021 -11.434  34.303
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1  -0.253   1.909  -0.551
    2    H2   MET   1           H2       MET   1  -1.432   0.994  -1.224
    3    H3   MET   1           H3       MET   1  -0.489   0.364  -0.043
    4    HA   MET   1           HA       MET   1   0.418   1.190  -2.724
    5    HB2  MET   1           HB2      MET   1   2.613   0.582  -2.240
    6    HB3  MET   1           HB3      MET   1   2.111   1.375  -0.769
    7    HG2  MET   1           HG2      MET   1   3.341  -0.460  -0.054
    8    HG3  MET   1           HG3      MET   1   1.680  -0.951   0.212
    9    HE1  MET   1           HE1      MET   1   5.062  -1.595  -1.606
   10    HE2  MET   1           HE2      MET   1   4.638  -2.774  -2.864
   11    HE3  MET   1           HE3      MET   1   4.128  -1.081  -3.029
   12    H    ILE   2           H        ILE   2   0.972  -0.523  -4.209
   13    HA   ILE   2           HA       ILE   2   0.323  -3.290  -3.527
   14    HB   ILE   2           HB       ILE   2  -0.780  -1.932  -6.019
   15   HG12  ILE   2          HG12      ILE   2  -1.955  -2.768  -3.398
   16   HG13  ILE   2          HG13      ILE   2  -2.381  -1.426  -4.448
   17   HG21  ILE   2          HG21      ILE   2   0.110  -4.217  -6.512
   18   HG22  ILE   2          HG22      ILE   2  -0.896  -4.873  -5.196
   19   HG23  ILE   2          HG23      ILE   2  -1.636  -4.168  -6.642
   20   HD11  ILE   2          HD11      ILE   2  -3.175  -4.339  -4.609
   21   HD12  ILE   2          HD12      ILE   2  -4.215  -2.927  -4.285
   22   HD13  ILE   2          HD13      ILE   2  -3.575  -3.161  -5.917
   23    H    ASP   3           H        ASP   3   1.901  -4.652  -4.630
   24    HA   ASP   3           HA       ASP   3   4.345  -3.324  -5.083
   25    HB2  ASP   3           HB2      ASP   3   4.215  -5.569  -4.116
   26    HB3  ASP   3           HB3      ASP   3   3.597  -6.191  -5.659
   27    H    ASP   4           H        ASP   4   2.708  -5.526  -7.362
   28    HA   ASP   4           HA       ASP   4   2.821  -3.675  -9.536
   29    HB2  ASP   4           HB2      ASP   4   5.194  -4.336  -9.563
   30    HB3  ASP   4           HB3      ASP   4   4.730  -6.034  -9.520
   31    H    ASP   5           H        ASP   5   2.766  -7.144  -8.774
   32    HA   ASP   5           HA       ASP   5   1.139  -7.736 -11.075
   33    HB2  ASP   5           HB2      ASP   5   3.107  -9.081 -10.326
   34    HB3  ASP   5           HB3      ASP   5   2.157  -9.622  -8.937
   35    H    GLY   6           H        GLY   6   0.056  -6.334  -8.544
   36    HA2  GLY   6           HA2      GLY   6  -2.186  -6.119  -7.840
   37    HA3  GLY   6           HA3      GLY   6  -2.554  -7.740  -8.444
   38    H    TYR   7           H        TYR   7   0.224  -8.281  -6.842
   39    HA   TYR   7           HA       TYR   7  -1.072  -8.845  -4.240
   40    HB2  TYR   7           HB2      TYR   7   1.600  -9.733  -5.396
   41    HB3  TYR   7           HB3      TYR   7   1.041 -10.099  -3.767
   42    HD1  TYR   7           HD2      TYR   7  -1.139 -11.385  -3.444
   43    HD2  TYR   7           HD1      TYR   7   0.918 -11.166  -7.225
   44    HE1  TYR   7           HE2      TYR   7  -2.388 -13.370  -4.229
   45    HE2  TYR   7           HE1      TYR   7  -0.301 -13.159  -8.014
   46    HH   TYR   7           HH       TYR   7  -1.908 -14.779  -7.514
   47    H    ARG   8           H        ARG   8   0.108  -8.207  -2.281
   48    HA   ARG   8           HA       ARG   8   1.763  -5.779  -2.504
   49    HB2  ARG   8           HB2      ARG   8   0.134  -4.391  -1.304
   50    HB3  ARG   8           HB3      ARG   8  -0.597  -5.030  -2.798
   51    HG2  ARG   8           HG2      ARG   8  -1.653  -6.845  -1.441
   52    HG3  ARG   8           HG3      ARG   8  -1.148  -5.980   0.023
   53    HD2  ARG   8           HD2      ARG   8  -2.773  -4.727  -2.215
   54    HD3  ARG   8           HD3      ARG   8  -3.513  -5.604  -0.862
   55    HE   ARG   8           HE       ARG   8  -1.870  -3.077  -0.692
   56   HH11  ARG   8          HH22      ARG   8  -4.376  -5.189   0.754
   57   HH12  ARG   8          HH21      ARG   8  -4.807  -4.053   1.977
   58   HH21  ARG   8          HH11      ARG   8  -2.415  -1.628   1.008
   59   HH22  ARG   8          HH12      ARG   8  -3.685  -1.990   2.117
   60    HA   PRO   9           HA       PRO   9   2.882  -7.964   1.258
   61    HB2  PRO   9           HB2      PRO   9   4.917  -5.861   1.734
   62    HB3  PRO   9           HB3      PRO   9   5.155  -7.621   1.508
   63    HG2  PRO   9           HG2      PRO   9   5.861  -5.831  -0.400
   64    HG3  PRO   9           HG3      PRO   9   5.045  -7.362  -0.866
   65    HD2  PRO   9           HD2      PRO   9   3.766  -4.646  -0.355
   66    HD3  PRO   9           HD3      PRO   9   3.647  -5.663  -1.820
   67    H    ASN  10           H        ASN  10   2.310  -7.936   3.416
   68    HA   ASN  10           HA       ASN  10   1.589  -5.357   4.726
   69    HB2  ASN  10           HB2      ASN  10  -0.160  -7.793   4.212
   70    HB3  ASN  10           HB3      ASN  10  -0.425  -6.808   5.645
   71   HD21  ASN  10          HD22      ASN  10  -1.073  -4.545   5.426
   72   HD22  ASN  10          HD21      ASN  10  -1.849  -4.032   3.937
   73    H    VAL  11           H        VAL  11   1.245  -5.712   7.119
   74    HA   VAL  11           HA       VAL  11   2.554  -8.117   8.146
   75    HB   VAL  11           HB       VAL  11   3.927  -6.924   9.776
   76   HG11  VAL  11          HG11      VAL  11   5.648  -6.065   8.388
   77   HG12  VAL  11          HG12      VAL  11   4.977  -7.582   7.759
   78   HG13  VAL  11          HG13      VAL  11   4.518  -6.036   7.018
   79   HG21  VAL  11          HG21      VAL  11   2.637  -4.825  10.040
   80   HG22  VAL  11          HG22      VAL  11   4.329  -4.526   9.627
   81   HG23  VAL  11          HG23      VAL  11   3.087  -4.347   8.377
   82    H    GLY  12           H        GLY  12   2.083  -8.192  10.675
   83    HA2  GLY  12           HA2      GLY  12  -0.243  -6.630  11.467
   84    HA3  GLY  12           HA3      GLY  12  -0.569  -8.356  11.292
   85    H    ILE  13           H        ILE  13  -0.834  -6.993  13.765
   86    HA   ILE  13           HA       ILE  13   1.624  -7.711  15.298
   87    HB   ILE  13           HB       ILE  13  -0.301  -5.371  15.454
   88   HG12  ILE  13          HG12      ILE  13   2.581  -4.788  15.560
   89   HG13  ILE  13          HG13      ILE  13   2.146  -5.655  14.082
   90   HG21  ILE  13          HG21      ILE  13   0.991  -4.583  17.403
   91   HG22  ILE  13          HG22      ILE  13   0.094  -6.058  17.744
   92   HG23  ILE  13          HG23      ILE  13   1.853  -6.151  17.457
   93   HD11  ILE  13          HD11      ILE  13   0.433  -3.970  13.557
   94   HD12  ILE  13          HD12      ILE  13   0.831  -3.092  15.055
   95   HD13  ILE  13          HD13      ILE  13   2.041  -3.231  13.756
   96    H    VAL  14           H        VAL  14   1.347  -8.891  17.106
   97    HA   VAL  14           HA       VAL  14  -1.386  -9.302  18.220
   98    HB   VAL  14           HB       VAL  14   0.868 -11.356  18.096
   99   HG11  VAL  14          HG11      VAL  14  -0.580 -11.653  20.061
  100   HG12  VAL  14          HG12      VAL  14  -2.025 -11.578  19.026
  101   HG13  VAL  14          HG13      VAL  14  -0.880 -12.938  18.895
  102   HG21  VAL  14          HG21      VAL  14  -1.663 -11.248  16.410
  103   HG22  VAL  14          HG22      VAL  14   0.019 -11.105  15.833
  104   HG23  VAL  14          HG23      VAL  14  -0.535 -12.628  16.526
  105    H    ILE  15           H        ILE  15  -1.366  -9.032  20.522
  106    HA   ILE  15           HA       ILE  15   1.290  -8.703  21.757
  107    HB   ILE  15           HB       ILE  15  -1.096  -7.129  22.747
  108   HG12  ILE  15          HG12      ILE  15  -0.521  -6.251  20.473
  109   HG13  ILE  15          HG13      ILE  15  -0.270  -5.110  21.782
  110   HG21  ILE  15          HG21      ILE  15   0.684  -5.846  23.910
  111   HG22  ILE  15          HG22      ILE  15   0.590  -7.538  24.435
  112   HG23  ILE  15          HG23      ILE  15   1.890  -7.016  23.346
  113   HD11  ILE  15          HD11      ILE  15   1.978  -6.755  20.550
  114   HD12  ILE  15          HD12      ILE  15   1.560  -5.096  20.075
  115   HD13  ILE  15          HD13      ILE  15   2.130  -5.420  21.725
  116    H    CYS  16           H        CYS  16   1.495  -9.879  23.744
  117    HA   CYS  16           HA       CYS  16  -0.973 -11.299  24.665
  118    HB2  CYS  16           HB2      CYS  16   0.514 -13.180  25.362
  119    HB3  CYS  16           HB3      CYS  16   0.474 -12.944  23.609
  120    HG   CYS  16           HG       CYS  16   2.942 -13.547  24.356
  121    H    ASN  17           H        ASN  17  -1.143 -11.729  26.891
  122    HA   ASN  17           HA       ASN  17   0.680 -10.173  28.663
  123    HB2  ASN  17           HB2      ASN  17  -1.091  -9.706  30.157
  124    HB3  ASN  17           HB3      ASN  17  -1.658  -9.264  28.557
  125   HD21  ASN  17          HD22      ASN  17  -3.723  -9.368  30.086
  126   HD22  ASN  17          HD21      ASN  17  -4.564 -10.908  30.087
  127    H    ARG  18           H        ARG  18   0.759 -11.351  30.983
  128    HA   ARG  18           HA       ARG  18   1.576 -14.080  30.385
  129    HB2  ARG  18           HB2      ARG  18   1.623 -12.432  32.954
  130    HB3  ARG  18           HB3      ARG  18   2.043 -14.138  32.935
  131    HG2  ARG  18           HG2      ARG  18   4.103 -13.618  32.394
  132    HG3  ARG  18           HG3      ARG  18   3.503 -13.208  30.781
  133    HD2  ARG  18           HD2      ARG  18   3.081 -10.882  31.584
  134    HD3  ARG  18           HD3      ARG  18   3.828 -11.303  33.134
  135    HE   ARG  18           HE       ARG  18   5.243 -11.545  30.492
  136   HH11  ARG  18          HH11      ARG  18   5.560 -10.463  33.873
  137   HH12  ARG  18          HH12      ARG  18   6.777  -9.288  33.491
  138   HH21  ARG  18          HH21      ARG  18   6.991 -10.260  30.079
  139   HH22  ARG  18          HH22      ARG  18   7.736  -9.294  31.335
  140    H    GLN  19           H        GLN  19  -1.473 -13.023  30.725
  141    HA   GLN  19           HA       GLN  19  -2.428 -15.286  32.334
  142    HB2  GLN  19           HB2      GLN  19  -4.194 -13.280  30.926
  143    HB3  GLN  19           HB3      GLN  19  -4.586 -14.306  32.299
  144    HG2  GLN  19           HG2      GLN  19  -2.765 -11.873  32.261
  145    HG3  GLN  19           HG3      GLN  19  -4.368 -11.963  32.952
  146   HE21  GLN  19          HE22      GLN  19  -1.983 -11.129  34.408
  147   HE22  GLN  19          HE21      GLN  19  -1.715 -12.297  35.681
  148    H    GLY  20           H        GLY  20  -1.444 -14.763  29.121
  149    HA2  GLY  20           HA2      GLY  20  -1.685 -16.176  27.303
  150    HA3  GLY  20           HA3      GLY  20  -2.877 -17.143  28.182
  151    H    GLN  21           H        GLN  21  -3.285 -13.595  28.028
  152    HA   GLN  21           HA       GLN  21  -5.552 -14.006  26.160
  153    HB2  GLN  21           HB2      GLN  21  -4.952 -11.579  27.868
  154    HB3  GLN  21           HB3      GLN  21  -6.363 -11.831  26.853
  155    HG2  GLN  21           HG2      GLN  21  -7.136 -13.670  28.291
  156    HG3  GLN  21           HG3      GLN  21  -5.676 -13.534  29.278
  157   HE21  GLN  21          HE22      GLN  21  -8.851 -12.024  28.655
  158   HE22  GLN  21          HE21      GLN  21  -8.725 -10.890  29.971
  159    H    VAL  22           H        VAL  22  -5.651 -12.649  24.322
  160    HA   VAL  22           HA       VAL  22  -3.134 -11.310  23.551
  161    HB   VAL  22           HB       VAL  22  -3.618 -11.920  21.236
  162   HG11  VAL  22          HG11      VAL  22  -3.506 -14.314  23.128
  163   HG12  VAL  22          HG12      VAL  22  -3.070 -14.327  21.396
  164   HG13  VAL  22          HG13      VAL  22  -2.134 -13.354  22.542
  165   HG21  VAL  22          HG21      VAL  22  -5.333 -13.565  20.632
  166   HG22  VAL  22          HG22      VAL  22  -5.949 -13.593  22.283
  167   HG23  VAL  22          HG23      VAL  22  -6.083 -12.120  21.301
  168    H    MET  23           H        MET  23  -3.339  -9.435  22.285
  169    HA   MET  23           HA       MET  23  -5.502  -7.611  22.804
  170    HB2  MET  23           HB2      MET  23  -3.393  -6.677  22.262
  171    HB3  MET  23           HB3      MET  23  -3.158  -7.755  20.881
  172    HG2  MET  23           HG2      MET  23  -3.521  -5.517  20.091
  173    HG3  MET  23           HG3      MET  23  -4.821  -6.569  19.572
  174    HE1  MET  23           HE1      MET  23  -3.687  -3.496  21.493
  175    HE2  MET  23           HE2      MET  23  -5.097  -3.025  22.468
  176    HE3  MET  23           HE3      MET  23  -4.122  -4.441  22.938
  177    H    TRP  24           H        TRP  24  -7.413  -7.266  21.707
  178    HA   TRP  24           HA       TRP  24  -7.786  -8.291  18.979
  179    HB2  TRP  24           HB2      TRP  24  -8.480 -10.049  20.585
  180    HB3  TRP  24           HB3      TRP  24  -9.591  -8.915  21.342
  181    HD1  TRP  24           HD1      TRP  24 -11.861  -9.824  20.836
  182    HE1  TRP  24           HE1      TRP  24 -13.131 -10.798  18.849
  183    HE3  TRP  24           HE3      TRP  24  -8.047  -9.904  17.437
  184    HZ2  TRP  24           HZ2      TRP  24 -12.521 -11.631  16.146
  185    HZ3  TRP  24           HZ3      TRP  24  -8.372 -10.955  15.230
  186    HH2  TRP  24           HH2      TRP  24 -10.635 -11.801  14.571
  187    H    ALA  25           H        ALA  25  -9.115  -6.634  17.831
  188    HA   ALA  25           HA       ALA  25 -10.190  -4.466  19.553
  189    HB1  ALA  25           HB1      ALA  25  -7.806  -3.957  19.063
  190    HB2  ALA  25           HB2      ALA  25  -8.172  -4.015  17.326
  191    HB3  ALA  25           HB3      ALA  25  -8.921  -2.784  18.376
  192    H    ARG  26           H        ARG  26 -11.545  -2.932  18.497
  193    HA   ARG  26           HA       ARG  26 -13.162  -4.156  16.304
  194    HB2  ARG  26           HB2      ARG  26 -14.338  -4.060  18.411
  195    HB3  ARG  26           HB3      ARG  26 -13.885  -2.377  18.678
  196    HG2  ARG  26           HG2      ARG  26 -15.306  -1.641  16.811
  197    HG3  ARG  26           HG3      ARG  26 -15.646  -3.315  16.385
  198    HD2  ARG  26           HD2      ARG  26 -17.555  -2.545  17.550
  199    HD3  ARG  26           HD3      ARG  26 -16.714  -3.618  18.657
  200    HE   ARG  26           HE       ARG  26 -16.763  -0.605  18.720
  201   HH11  ARG  26          HH11      ARG  26 -16.432  -3.623  20.599
  202   HH12  ARG  26          HH12      ARG  26 -16.647  -2.817  22.113
  203   HH21  ARG  26          HH21      ARG  26 -16.929   0.395  20.590
  204   HH22  ARG  26          HH22      ARG  26 -16.880  -0.422  22.139
  205    H    ARG  27           H        ARG  27 -12.690  -3.106  14.341
  206    HA   ARG  27           HA       ARG  27 -11.157  -0.667  14.349
  207    HB2  ARG  27           HB2      ARG  27 -10.908  -2.427  12.679
  208    HB3  ARG  27           HB3      ARG  27 -12.579  -2.281  12.214
  209    HG2  ARG  27           HG2      ARG  27 -11.452  -1.224  10.463
  210    HG3  ARG  27           HG3      ARG  27 -12.002   0.137  11.421
  211    HD2  ARG  27           HD2      ARG  27  -9.728   0.544  10.756
  212    HD3  ARG  27           HD3      ARG  27  -9.708   0.216  12.498
  213    HE   ARG  27           HE       ARG  27  -9.287  -2.168  10.866
  214   HH11  ARG  27          HH12      ARG  27  -7.629   0.767  11.957
  215   HH12  ARG  27          HH11      ARG  27  -6.077  -0.025  12.125
  216   HH21  ARG  27          HH21      ARG  27  -7.171  -3.202  11.129
  217   HH22  ARG  27          HH22      ARG  27  -5.849  -2.223  11.752
  218    H    PHE  28           H        PHE  28 -11.809   1.436  13.682
  219    HA   PHE  28           HA       PHE  28 -14.001   2.519  14.852
  220    HB2  PHE  28           HB2      PHE  28 -12.056   3.713  13.908
  221    HB3  PHE  28           HB3      PHE  28 -12.669   3.464  12.287
  222    HD1  PHE  28           HD1      PHE  28 -13.416   5.106  15.578
  223    HD2  PHE  28           HD2      PHE  28 -14.274   4.996  11.347
  224    HE1  PHE  28           HE1      PHE  28 -14.661   7.239  15.773
  225    HE2  PHE  28           HE2      PHE  28 -15.524   7.129  11.554
  226    HZ   PHE  28           HZ       PHE  28 -15.722   8.256  13.762
  227    H    GLY  29           H        GLY  29 -16.150   2.258  14.610
  228    HA2  GLY  29           HA2      GLY  29 -18.215   2.206  13.704
  229    HA3  GLY  29           HA3      GLY  29 -17.505   2.768  12.192
  230    H    GLN  30           H        GLN  30 -16.079  -0.281  12.996
  231    HA   GLN  30           HA       GLN  30 -17.543  -1.391  10.717
  232    HB2  GLN  30           HB2      GLN  30 -15.384  -2.699  12.417
  233    HB3  GLN  30           HB3      GLN  30 -16.006  -3.260  10.866
  234    HG2  GLN  30           HG2      GLN  30 -14.341  -0.794  11.390
  235    HG3  GLN  30           HG3      GLN  30 -13.899  -2.232  10.488
  236   HE21  GLN  30          HE22      GLN  30 -15.177   0.953  10.185
  237   HE22  GLN  30          HE21      GLN  30 -15.711   0.827   8.517
  238    H    HIS  31           H        HIS  31 -17.631  -1.820  14.208
  239    HA   HIS  31           HA       HIS  31 -18.634  -3.293  15.590
  240    HB2  HIS  31           HB2      HIS  31 -20.835  -3.436  13.515
  241    HB3  HIS  31           HB3      HIS  31 -20.965  -3.749  15.243
  242    HD1  HIS  31           HD1      HIS  31 -21.145  -0.900  12.781
  243    HD2  HIS  31           HD2      HIS  31 -20.520  -1.497  16.905
  244    HE1  HIS  31           HE1      HIS  31 -21.503   1.359  13.892
  245    H    SER  32           H        SER  32 -16.653  -4.381  13.912
  246    HA   SER  32           HA       SER  32 -17.277  -7.237  14.242
  247    HB2  SER  32           HB2      SER  32 -15.938  -7.742  12.219
  248    HB3  SER  32           HB3      SER  32 -17.406  -6.830  11.839
  249    HG   SER  32           HG       SER  32 -15.769  -5.874  10.708
  250    H    TRP  33           H        TRP  33 -14.987  -8.407  14.405
  251    HA   TRP  33           HA       TRP  33 -13.077  -6.577  15.793
  252    HB2  TRP  33           HB2      TRP  33 -13.780  -9.419  16.540
  253    HB3  TRP  33           HB3      TRP  33 -12.534  -8.385  17.264
  254    HD1  TRP  33           HD1      TRP  33 -16.367  -8.688  17.085
  255    HE1  TRP  33           HE1      TRP  33 -17.404  -7.431  19.042
  256    HE3  TRP  33           HE3      TRP  33 -12.107  -6.668  19.034
  257    HZ2  TRP  33           HZ2      TRP  33 -16.470  -5.790  21.261
  258    HZ3  TRP  33           HZ3      TRP  33 -12.214  -5.155  21.004
  259    HH2  TRP  33           HH2      TRP  33 -14.375  -4.712  22.121
  260    H    GLN  34           H        GLN  34 -10.912  -6.917  15.472
  261    HA   GLN  34           HA       GLN  34  -9.933  -9.041  13.761
  262    HB2  GLN  34           HB2      GLN  34  -8.957  -7.367  12.104
  263    HB3  GLN  34           HB3      GLN  34 -10.647  -7.753  11.937
  264    HG2  GLN  34           HG2      GLN  34  -9.686  -5.246  13.371
  265    HG3  GLN  34           HG3      GLN  34  -9.922  -5.321  11.626
  266   HE21  GLN  34          HE22      GLN  34 -12.270  -6.216  10.935
  267   HE22  GLN  34          HE21      GLN  34 -13.593  -5.583  11.896
  268    H    PHE  35           H        PHE  35  -7.517  -8.787  13.415
  269    HA   PHE  35           HA       PHE  35  -6.243  -7.814  15.887
  270    HB2  PHE  35           HB2      PHE  35  -5.130  -9.146  13.390
  271    HB3  PHE  35           HB3      PHE  35  -4.169  -8.709  14.806
  272    HD1  PHE  35           HD1      PHE  35  -5.546  -9.614  17.126
  273    HD2  PHE  35           HD2      PHE  35  -5.211 -11.535  13.248
  274    HE1  PHE  35           HE1      PHE  35  -6.036 -11.796  18.165
  275    HE2  PHE  35           HE2      PHE  35  -5.637 -13.704  14.335
  276    HZ   PHE  35           HZ       PHE  35  -6.143 -13.846  16.757
  277    HA   PRO  36           HA       PRO  36  -4.879  -3.959  13.963
  278    HB2  PRO  36           HB2      PRO  36  -2.492  -3.478  15.285
  279    HB3  PRO  36           HB3      PRO  36  -4.118  -3.203  15.994
  280    HG2  PRO  36           HG2      PRO  36  -2.312  -5.603  16.358
  281    HG3  PRO  36           HG3      PRO  36  -3.224  -4.702  17.601
  282    HD2  PRO  36           HD2      PRO  36  -4.106  -7.042  16.508
  283    HD3  PRO  36           HD3      PRO  36  -5.245  -5.739  16.975
  284    H    GLN  37           H        GLN  37  -3.589  -3.356  12.207
  285    HA   GLN  37           HA       GLN  37  -1.747  -5.421  11.116
  286    HB2  GLN  37           HB2      GLN  37  -4.369  -4.470   9.930
  287    HB3  GLN  37           HB3      GLN  37  -3.107  -5.217   8.942
  288    HG2  GLN  37           HG2      GLN  37  -3.155  -7.253  10.253
  289    HG3  GLN  37           HG3      GLN  37  -4.287  -6.557  11.408
  290   HE21  GLN  37          HE22      GLN  37  -6.477  -6.629  11.039
  291   HE22  GLN  37          HE21      GLN  37  -7.200  -7.162   9.524
  292    H    GLY  38           H        GLY  38  -0.771  -4.716   8.984
  293    HA2  GLY  38           HA2      GLY  38  -0.545  -1.791   8.670
  294    HA3  GLY  38           HA3      GLY  38   0.906  -2.654   9.217
  295    H    GLY  39           H        GLY  39   0.868  -1.213   6.816
  296    HA2  GLY  39           HA2      GLY  39   1.068  -3.317   4.715
  297    HA3  GLY  39           HA3      GLY  39   0.686  -1.623   4.406
  298    H    ILE  40           H        ILE  40   3.129  -3.535   3.875
  299    HA   ILE  40           HA       ILE  40   5.352  -2.069   5.127
  300    HB   ILE  40           HB       ILE  40   5.416  -4.090   2.858
  301   HG12  ILE  40          HG12      ILE  40   5.580  -4.605   5.856
  302   HG13  ILE  40          HG13      ILE  40   4.246  -5.096   4.817
  303   HG21  ILE  40          HG21      ILE  40   7.517  -2.748   3.301
  304   HG22  ILE  40          HG22      ILE  40   7.579  -3.502   4.917
  305   HG23  ILE  40          HG23      ILE  40   7.713  -4.490   3.453
  306   HD11  ILE  40          HD11      ILE  40   5.430  -7.043   5.109
  307   HD12  ILE  40          HD12      ILE  40   5.939  -6.489   3.510
  308   HD13  ILE  40          HD13      ILE  40   7.017  -6.264   4.901
  309    H    ASN  41           H        ASN  41   6.055  -0.172   4.320
  310    HA   ASN  41           HA       ASN  41   5.018   0.916   1.824
  311    HB2  ASN  41           HB2      ASN  41   7.124   1.869   3.820
  312    HB3  ASN  41           HB3      ASN  41   6.779   2.732   2.328
  313   HD21  ASN  41          HD22      ASN  41   5.334   1.576   5.378
  314   HD22  ASN  41          HD21      ASN  41   3.937   2.653   5.334
  315    HA   PRO  42           HA       PRO  42   8.131  -0.732  -0.911
  316    HB2  PRO  42           HB2      PRO  42   8.885   1.430  -2.484
  317    HB3  PRO  42           HB3      PRO  42   7.391   0.473  -2.710
  318    HG2  PRO  42           HG2      PRO  42   7.710   3.093  -1.215
  319    HG3  PRO  42           HG3      PRO  42   6.459   2.643  -2.418
  320    HD2  PRO  42           HD2      PRO  42   5.957   2.508   0.229
  321    HD3  PRO  42           HD3      PRO  42   5.357   1.222  -0.858
  322    H    GLY  43           H        GLY  43  10.123  -1.258  -0.196
  323    HA2  GLY  43           HA2      GLY  43  12.356  -0.975   0.324
  324    HA3  GLY  43           HA3      GLY  43  12.123   0.764   0.511
  325    H    GLU  44           H        GLU  44   9.656  -0.539   2.439
  326    HA   GLU  44           HA       GLU  44  11.187  -0.280   4.869
  327    HB2  GLU  44           HB2      GLU  44   8.398  -0.291   4.145
  328    HB3  GLU  44           HB3      GLU  44   8.655  -1.582   5.334
  329    HG2  GLU  44           HG2      GLU  44   9.661  -0.055   6.870
  330    HG3  GLU  44           HG3      GLU  44   9.589   1.259   5.672
  331    H    SER  45           H        SER  45  11.287  -1.978   6.494
  332    HA   SER  45           HA       SER  45  11.545  -4.740   5.391
  333    HB2  SER  45           HB2      SER  45  12.617  -3.613   8.012
  334    HB3  SER  45           HB3      SER  45  12.923  -5.221   7.324
  335    HG   SER  45           HG       SER  45  14.661  -3.753   6.911
  336    H    ALA  46           H        ALA  46  10.404  -6.421   6.693
  337    HA   ALA  46           HA       ALA  46   7.764  -5.678   7.268
  338    HB1  ALA  46           HB1      ALA  46   9.326  -8.095   8.302
  339    HB2  ALA  46           HB2      ALA  46   7.551  -7.966   8.179
  340    HB3  ALA  46           HB3      ALA  46   8.538  -7.976   6.704
  341    H    GLU  47           H        GLU  47  10.495  -6.116   9.490
  342    HA   GLU  47           HA       GLU  47   9.036  -5.760  11.926
  343    HB2  GLU  47           HB2      GLU  47  11.129  -6.904  11.759
  344    HB3  GLU  47           HB3      GLU  47  11.954  -5.496  11.113
  345    HG2  GLU  47           HG2      GLU  47  10.700  -5.015  13.772
  346    HG3  GLU  47           HG3      GLU  47  11.890  -6.310  13.772
  347    H    GLN  48           H        GLN  48  10.618  -3.459   9.690
  348    HA   GLN  48           HA       GLN  48  10.270  -1.159  11.382
  349    HB2  GLN  48           HB2      GLN  48  10.719  -1.438   8.398
  350    HB3  GLN  48           HB3      GLN  48  10.628   0.118   9.228
  351    HG2  GLN  48           HG2      GLN  48  12.557  -2.072  10.053
  352    HG3  GLN  48           HG3      GLN  48  12.969  -0.836   8.857
  353   HE21  GLN  48          HE22      GLN  48  12.673  -1.603  12.207
  354   HE22  GLN  48          HE21      GLN  48  13.083  -0.014  12.858
  355    H    ALA  49           H        ALA  49   8.278  -2.760   8.824
  356    HA   ALA  49           HA       ALA  49   6.269  -0.725   8.705
  357    HB1  ALA  49           HB1      ALA  49   6.682  -2.499   6.990
  358    HB2  ALA  49           HB2      ALA  49   6.047  -3.727   8.138
  359    HB3  ALA  49           HB3      ALA  49   4.982  -2.441   7.542
  360    H    MET  50           H        MET  50   6.730  -3.696  10.669
  361    HA   MET  50           HA       MET  50   4.260  -3.585  12.072
  362    HB2  MET  50           HB2      MET  50   5.632  -5.564  12.064
  363    HB3  MET  50           HB3      MET  50   6.984  -4.742  12.830
  364    HG2  MET  50           HG2      MET  50   4.267  -5.062  14.110
  365    HG3  MET  50           HG3      MET  50   5.553  -6.238  14.279
  366    HE1  MET  50           HE1      MET  50   8.178  -4.681  16.509
  367    HE2  MET  50           HE2      MET  50   7.765  -5.925  15.310
  368    HE3  MET  50           HE3      MET  50   8.252  -4.297  14.779
  369    H    TYR  51           H        TYR  51   7.507  -2.165  13.012
  370    HA   TYR  51           HA       TYR  51   6.373  -0.995  15.331
  371    HB2  TYR  51           HB2      TYR  51   8.869  -0.289  13.761
  372    HB3  TYR  51           HB3      TYR  51   8.403   0.535  15.243
  373    HD1  TYR  51           HD2      TYR  51   7.595  -1.323  17.196
  374    HD2  TYR  51           HD1      TYR  51  10.633  -1.798  14.163
  375    HE1  TYR  51           HE2      TYR  51   8.882  -2.788  18.711
  376    HE2  TYR  51           HE1      TYR  51  11.929  -3.240  15.680
  377    HH   TYR  51           HH       TYR  51  12.051  -4.226  17.810
  378    H    ARG  52           H        ARG  52   6.590   0.424  11.971
  379    HA   ARG  52           HA       ARG  52   5.716   3.035  12.785
  380    HB2  ARG  52           HB2      ARG  52   6.715   2.589  10.603
  381    HB3  ARG  52           HB3      ARG  52   5.472   1.394  10.227
  382    HG2  ARG  52           HG2      ARG  52   3.745   3.265  10.290
  383    HG3  ARG  52           HG3      ARG  52   5.085   4.418  10.426
  384    HD2  ARG  52           HD2      ARG  52   4.840   2.285   8.268
  385    HD3  ARG  52           HD3      ARG  52   4.184   3.918   8.048
  386    HE   ARG  52           HE       ARG  52   6.938   2.974   7.959
  387   HH11  ARG  52          HH11      ARG  52   4.970   5.944   8.275
  388   HH12  ARG  52          HH12      ARG  52   6.238   6.995   7.764
  389   HH21  ARG  52          HH21      ARG  52   8.608   4.375   7.332
  390   HH22  ARG  52          HH22      ARG  52   8.362   6.081   7.213
  391    H    GLU  53           H        GLU  53   3.949   0.115  11.605
  392    HA   GLU  53           HA       GLU  53   1.465   1.516  11.733
  393    HB2  GLU  53           HB2      GLU  53   2.096  -1.407  11.294
  394    HB3  GLU  53           HB3      GLU  53   0.505  -0.685  11.075
  395    HG2  GLU  53           HG2      GLU  53   2.874   0.540   9.618
  396    HG3  GLU  53           HG3      GLU  53   2.183  -0.948   9.022
  397    H    LEU  54           H        LEU  54   3.201  -0.540  14.049
  398    HA   LEU  54           HA       LEU  54   1.149  -0.991  15.933
  399    HB2  LEU  54           HB2      LEU  54   3.426  -1.931  16.056
  400    HB3  LEU  54           HB3      LEU  54   4.096  -0.307  16.292
  401    HG   LEU  54           HG       LEU  54   2.610  -0.279  18.462
  402   HD11  LEU  54          HD11      LEU  54   1.357  -2.348  17.812
  403   HD12  LEU  54          HD12      LEU  54   2.862  -3.277  17.917
  404   HD13  LEU  54          HD13      LEU  54   2.175  -2.523  19.375
  405   HD21  LEU  54          HD21      LEU  54   5.046  -2.101  18.220
  406   HD22  LEU  54          HD22      LEU  54   5.069  -0.336  18.480
  407   HD23  LEU  54          HD23      LEU  54   4.409  -1.397  19.730
  408    H    PHE  55           H        PHE  55   3.105   1.991  15.312
  409    HA   PHE  55           HA       PHE  55   1.916   3.411  17.532
  410    HB2  PHE  55           HB2      PHE  55   4.142   3.923  16.491
  411    HB3  PHE  55           HB3      PHE  55   3.301   4.517  15.062
  412    HD1  PHE  55           HD2      PHE  55   3.569   5.009  18.778
  413    HD2  PHE  55           HD1      PHE  55   2.589   6.794  14.971
  414    HE1  PHE  55           HE2      PHE  55   3.400   7.235  19.864
  415    HE2  PHE  55           HE1      PHE  55   2.428   9.015  16.057
  416    HZ   PHE  55           HZ       PHE  55   2.845   9.248  18.503
  417    H    GLU  56           H        GLU  56   1.132   3.131  14.016
  418    HA   GLU  56           HA       GLU  56  -0.858   5.123  14.095
  419    HB2  GLU  56           HB2      GLU  56  -0.402   2.813  12.209
  420    HB3  GLU  56           HB3      GLU  56  -1.659   4.032  11.961
  421    HG2  GLU  56           HG2      GLU  56   1.266   4.776  12.357
  422    HG3  GLU  56           HG3      GLU  56   0.607   4.419  10.767
  423    H    GLU  57           H        GLU  57  -0.956   1.623  14.740
  424    HA   GLU  57           HA       GLU  57  -3.866   1.488  14.715
  425    HB2  GLU  57           HB2      GLU  57  -1.641  -0.515  15.289
  426    HB3  GLU  57           HB3      GLU  57  -3.331  -0.948  15.272
  427    HG2  GLU  57           HG2      GLU  57  -1.910   0.207  12.836
  428    HG3  GLU  57           HG3      GLU  57  -1.976  -1.508  13.235
  429    H    VAL  58           H        VAL  58  -1.248   0.935  17.077
  430    HA   VAL  58           HA       VAL  58  -3.191   0.541  19.255
  431    HB   VAL  58           HB       VAL  58  -0.167   0.139  19.262
  432   HG11  VAL  58          HG11      VAL  58  -1.283  -0.001  21.426
  433   HG12  VAL  58          HG12      VAL  58  -2.366  -1.283  20.780
  434   HG13  VAL  58          HG13      VAL  58  -0.609  -1.561  20.920
  435   HG21  VAL  58          HG21      VAL  58  -0.715  -2.287  18.660
  436   HG22  VAL  58          HG22      VAL  58  -2.292  -1.694  18.103
  437   HG23  VAL  58          HG23      VAL  58  -0.788  -1.086  17.348
  438    H    GLY  59           H        GLY  59  -0.649   2.683  18.166
  439    HA2  GLY  59           HA2      GLY  59  -0.151   4.883  18.882
  440    HA3  GLY  59           HA3      GLY  59  -1.206   4.687  20.281
  441    H    LEU  60           H        LEU  60   0.647   1.932  20.059
  442    HA   LEU  60           HA       LEU  60   2.423   2.636  22.243
  443    HB2  LEU  60           HB2      LEU  60   0.961   0.627  22.048
  444    HB3  LEU  60           HB3      LEU  60   1.857   0.125  20.611
  445    HG   LEU  60           HG       LEU  60   3.876  -0.286  21.993
  446   HD11  LEU  60          HD11      LEU  60   2.071   0.568  24.279
  447   HD12  LEU  60          HD12      LEU  60   3.623  -0.288  24.443
  448   HD13  LEU  60          HD13      LEU  60   3.587   1.353  23.783
  449   HD21  LEU  60          HD21      LEU  60   2.106  -2.009  21.578
  450   HD22  LEU  60          HD22      LEU  60   2.767  -2.205  23.207
  451   HD23  LEU  60          HD23      LEU  60   1.181  -1.433  22.976
  452    H    SER  61           H        SER  61   4.751   2.238  22.078
  453    HA   SER  61           HA       SER  61   5.886   2.310  19.329
  454    HB2  SER  61           HB2      SER  61   7.423   4.126  20.173
  455    HB3  SER  61           HB3      SER  61   5.730   4.601  20.010
  456    HG   SER  61           HG       SER  61   6.565   5.312  22.013
  457    H    ARG  62           H        ARG  62   8.323   2.032  19.496
  458    HA   ARG  62           HA       ARG  62   8.841  -0.588  20.160
  459    HB2  ARG  62           HB2      ARG  62  11.028   1.534  20.064
  460    HB3  ARG  62           HB3      ARG  62  11.139  -0.188  19.705
  461    HG2  ARG  62           HG2      ARG  62   9.253   0.496  17.895
  462    HG3  ARG  62           HG3      ARG  62  10.054   2.067  18.049
  463    HD2  ARG  62           HD2      ARG  62  11.315  -0.592  17.321
  464    HD3  ARG  62           HD3      ARG  62  11.036   0.734  16.193
  465    HE   ARG  62           HE       ARG  62  13.222   0.321  18.031
  466   HH11  ARG  62          HH11      ARG  62  11.519   2.902  16.257
  467   HH12  ARG  62          HH12      ARG  62  12.836   4.014  16.336
  468   HH21  ARG  62          HH21      ARG  62  14.961   1.819  18.155
  469   HH22  ARG  62          HH22      ARG  62  14.838   3.374  17.417
  470    H    LYS  63           H        LYS  63   9.304   2.263  22.194
  471    HA   LYS  63           HA       LYS  63  11.158   1.158  24.005
  472    HB2  LYS  63           HB2      LYS  63   9.042   3.254  24.695
  473    HB3  LYS  63           HB3      LYS  63  10.656   3.070  25.403
  474    HG2  LYS  63           HG2      LYS  63   9.986   4.092  22.632
  475    HG3  LYS  63           HG3      LYS  63  10.595   5.034  23.986
  476    HD2  LYS  63           HD2      LYS  63  12.079   2.680  22.805
  477    HD3  LYS  63           HD3      LYS  63  12.288   4.337  22.205
  478    HE2  LYS  63           HE2      LYS  63  12.976   5.064  24.507
  479    HE3  LYS  63           HE3      LYS  63  12.859   3.393  25.069
  480    HZ1  LYS  63           HZ1      LYS  63  15.132   3.988  24.501
  481    HZ2  LYS  63           HZ2      LYS  63  14.630   2.820  23.484
  482    HZ3  LYS  63           HZ3      LYS  63  14.728   4.375  22.973
  483    H    ASP  64           H        ASP  64   7.690   0.753  23.819
  484    HA   ASP  64           HA       ASP  64   7.795  -0.610  26.472
  485    HB2  ASP  64           HB2      ASP  64   6.474   1.548  26.287
  486    HB3  ASP  64           HB3      ASP  64   5.289   0.619  25.393
  487    H    VAL  65           H        VAL  65   8.327  -1.713  23.727
  488    HA   VAL  65           HA       VAL  65   6.735  -4.169  24.183
  489    HB   VAL  65           HB       VAL  65   6.543  -4.480  21.716
  490   HG11  VAL  65          HG11      VAL  65   5.097  -2.050  22.794
  491   HG12  VAL  65          HG12      VAL  65   4.561  -3.104  21.460
  492   HG13  VAL  65          HG13      VAL  65   4.652  -3.730  23.122
  493   HG21  VAL  65          HG21      VAL  65   6.710  -2.565  20.191
  494   HG22  VAL  65          HG22      VAL  65   7.228  -1.527  21.517
  495   HG23  VAL  65          HG23      VAL  65   8.274  -2.843  20.977
  496    H    ARG  66           H        ARG  66   7.646  -6.078  23.063
  497    HA   ARG  66           HA       ARG  66  10.420  -5.880  22.160
  498    HB2  ARG  66           HB2      ARG  66  11.189  -7.755  23.492
  499    HB3  ARG  66           HB3      ARG  66  10.759  -6.366  24.485
  500    HG2  ARG  66           HG2      ARG  66   8.642  -8.499  24.204
  501    HG3  ARG  66           HG3      ARG  66  10.103  -8.952  25.052
  502    HD2  ARG  66           HD2      ARG  66   8.492  -6.481  25.789
  503    HD3  ARG  66           HD3      ARG  66   8.255  -8.087  26.500
  504    HE   ARG  66           HE       ARG  66  11.007  -7.035  26.573
  505   HH11  ARG  66          HH21      ARG  66   7.998  -7.333  28.497
  506   HH12  ARG  66          HH22      ARG  66   8.866  -7.395  30.009
  507   HH21  ARG  66          HH11      ARG  66  12.058  -6.975  28.621
  508   HH22  ARG  66          HH12      ARG  66  11.092  -7.055  30.078
  509    H    ILE  67           H        ILE  67  10.700  -7.387  20.395
  510    HA   ILE  67           HA       ILE  67   8.235  -8.738  19.532
  511    HB   ILE  67           HB       ILE  67  11.014  -8.706  18.315
  512   HG12  ILE  67          HG12      ILE  67   8.625  -7.249  17.167
  513   HG13  ILE  67          HG13      ILE  67   9.740  -6.465  18.295
  514   HG21  ILE  67          HG21      ILE  67   8.362  -9.727  17.172
  515   HG22  ILE  67          HG22      ILE  67   9.903  -9.672  16.288
  516   HG23  ILE  67          HG23      ILE  67   9.740 -10.734  17.669
  517   HD11  ILE  67          HD11      ILE  67  11.628  -6.985  16.751
  518   HD12  ILE  67          HD12      ILE  67  10.456  -7.621  15.569
  519   HD13  ILE  67          HD13      ILE  67  10.401  -5.917  16.049
  520    H    LEU  68           H        LEU  68   7.723 -10.548  20.422
  521    HA   LEU  68           HA       LEU  68   9.772 -12.295  21.692
  522    HB2  LEU  68           HB2      LEU  68   6.726 -12.447  21.532
  523    HB3  LEU  68           HB3      LEU  68   7.779 -13.591  22.370
  524    HG   LEU  68           HG       LEU  68   7.389 -10.659  23.124
  525   HD11  LEU  68          HD11      LEU  68   6.502 -11.962  25.200
  526   HD12  LEU  68          HD12      LEU  68   5.481 -11.826  23.739
  527   HD13  LEU  68          HD13      LEU  68   6.354 -13.340  24.116
  528   HD21  LEU  68          HD21      LEU  68   9.682 -11.293  23.669
  529   HD22  LEU  68          HD22      LEU  68   8.718 -11.239  25.141
  530   HD23  LEU  68          HD23      LEU  68   9.125 -12.812  24.414
  531    H    ALA  69           H        ALA  69   7.565 -12.143  18.866
  532    HA   ALA  69           HA       ALA  69   8.857 -14.469  17.650
  533    HB1  ALA  69           HB1      ALA  69   7.125 -15.405  19.282
  534    HB2  ALA  69           HB2      ALA  69   5.892 -14.635  18.270
  535    HB3  ALA  69           HB3      ALA  69   6.955 -15.890  17.592
  536    H    SER  70           H        SER  70   7.866 -14.918  15.576
  537    HA   SER  70           HA       SER  70   6.112 -13.091  14.358
  538    HB2  SER  70           HB2      SER  70   7.687 -12.200  12.593
  539    HB3  SER  70           HB3      SER  70   7.882 -11.544  14.224
  540    HG   SER  70           HG       SER  70   9.923 -12.081  13.282
  541    H    THR  71           H        THR  71   5.608 -13.748  12.008
  542    HA   THR  71           HA       THR  71   5.462 -16.599  12.137
  543    HB   THR  71           HB       THR  71   4.436 -16.245   9.765
  544    HG1  THR  71           HG1      THR  71   4.978 -14.219   9.279
  545   HG21  THR  71          HG21      THR  71   2.909 -16.839  11.384
  546   HG22  THR  71          HG22      THR  71   3.189 -15.387  12.354
  547   HG23  THR  71          HG23      THR  71   2.315 -15.274  10.810
  548    H    ARG  72           H        ARG  72   6.342 -18.207  11.075
  549    HA   ARG  72           HA       ARG  72   9.070 -17.778  10.077
  550    HB2  ARG  72           HB2      ARG  72   7.363 -20.281  10.412
  551    HB3  ARG  72           HB3      ARG  72   9.103 -20.271  10.138
  552    HG2  ARG  72           HG2      ARG  72   9.608 -19.610  12.319
  553    HG3  ARG  72           HG3      ARG  72   8.090 -18.756  12.560
  554    HD2  ARG  72           HD2      ARG  72   6.901 -20.994  12.502
  555    HD3  ARG  72           HD3      ARG  72   8.482 -21.769  12.606
  556    HE   ARG  72           HE       ARG  72   7.021 -20.191  14.634
  557   HH11  ARG  72          HH21      ARG  72  10.130 -21.759  13.865
  558   HH12  ARG  72          HH22      ARG  72  10.648 -21.852  15.508
  559   HH21  ARG  72          HH11      ARG  72   7.708 -20.351  16.829
  560   HH22  ARG  72          HH12      ARG  72   9.246 -21.030  17.218
  561    H    ASN  73           H        ASN  73   5.882 -18.424   8.812
  562    HA   ASN  73           HA       ASN  73   6.851 -18.523   6.044
  563    HB2  ASN  73           HB2      ASN  73   5.172 -20.053   5.459
  564    HB3  ASN  73           HB3      ASN  73   5.866 -20.719   6.942
  565   HD21  ASN  73          HD22      ASN  73   4.537 -20.153   9.100
  566   HD22  ASN  73          HD21      ASN  73   2.822 -20.064   8.892
  567    H    TRP  74           H        TRP  74   5.409 -17.315   4.553
  568    HA   TRP  74           HA       TRP  74   4.127 -15.048   5.955
  569    HB2  TRP  74           HB2      TRP  74   4.693 -15.618   3.018
  570    HB3  TRP  74           HB3      TRP  74   3.726 -14.263   3.572
  571    HD1  TRP  74           HD1      TRP  74   7.353 -15.558   3.769
  572    HE1  TRP  74           HE1      TRP  74   8.931 -13.572   4.120
  573    HE3  TRP  74           HE3      TRP  74   3.887 -11.846   4.283
  574    HZ2  TRP  74           HZ2      TRP  74   8.717 -10.780   4.737
  575    HZ3  TRP  74           HZ3      TRP  74   4.599  -9.503   4.738
  576    HH2  TRP  74           HH2      TRP  74   6.998  -8.998   5.129
  577    H    LEU  75           H        LEU  75   1.983 -14.700   6.151
  578    HA   LEU  75           HA       LEU  75   0.245 -16.997   5.408
  579    HB2  LEU  75           HB2      LEU  75  -0.520 -14.572   7.064
  580    HB3  LEU  75           HB3      LEU  75  -1.359 -16.114   6.912
  581    HG   LEU  75           HG       LEU  75   1.192 -15.496   8.433
  582   HD11  LEU  75          HD11      LEU  75  -1.460 -16.758   9.283
  583   HD12  LEU  75          HD12      LEU  75  -0.082 -16.369  10.342
  584   HD13  LEU  75          HD13      LEU  75  -0.972 -15.072   9.535
  585   HD21  LEU  75          HD21      LEU  75   1.706 -17.593   7.371
  586   HD22  LEU  75          HD22      LEU  75   1.317 -17.894   9.062
  587   HD23  LEU  75          HD23      LEU  75   0.109 -18.268   7.799
  588    H    ARG  76           H        ARG  76  -1.297 -16.820   3.734
  589    HA   ARG  76           HA       ARG  76  -1.858 -14.087   2.661
  590    HB2  ARG  76           HB2      ARG  76  -1.541 -16.784   1.249
  591    HB3  ARG  76           HB3      ARG  76  -2.147 -15.325   0.465
  592    HG2  ARG  76           HG2      ARG  76  -0.054 -14.177   0.786
  593    HG3  ARG  76           HG3      ARG  76   0.638 -15.536   1.704
  594    HD2  ARG  76           HD2      ARG  76  -0.522 -15.870  -1.082
  595    HD3  ARG  76           HD3      ARG  76   1.179 -15.371  -0.821
  596    HE   ARG  76           HE       ARG  76   0.659 -17.703   0.721
  597   HH11  ARG  76          HH21      ARG  76   1.130 -16.761  -2.679
  598   HH12  ARG  76          HH22      ARG  76   1.711 -18.312  -3.170
  599   HH21  ARG  76          HH11      ARG  76   1.412 -19.772   0.061
  600   HH22  ARG  76          HH12      ARG  76   1.877 -20.054  -1.574
  601    H    TYR  77           H        TYR  77  -3.901 -13.836   1.677
  602    HA   TYR  77           HA       TYR  77  -5.849 -15.977   1.759
  603    HB2  TYR  77           HB2      TYR  77  -7.644 -14.715   2.692
  604    HB3  TYR  77           HB3      TYR  77  -6.397 -15.047   3.880
  605    HD1  TYR  77           HD2      TYR  77  -4.956 -13.204   4.753
  606    HD2  TYR  77           HD1      TYR  77  -8.206 -12.445   2.016
  607    HE1  TYR  77           HE2      TYR  77  -4.971 -10.867   5.445
  608    HE2  TYR  77           HE1      TYR  77  -8.203 -10.080   2.676
  609    HH   TYR  77           HH       TYR  77  -6.003  -8.750   5.214
  610    H    LYS  78           H        LYS  78  -6.807 -15.933  -0.229
  611    HA   LYS  78           HA       LYS  78  -6.345 -13.565  -1.974
  612    HB2  LYS  78           HB2      LYS  78  -7.256 -16.407  -2.423
  613    HB3  LYS  78           HB3      LYS  78  -7.901 -15.158  -3.474
  614    HG2  LYS  78           HG2      LYS  78  -5.992 -16.145  -4.507
  615    HG3  LYS  78           HG3      LYS  78  -5.697 -14.446  -4.164
  616    HD2  LYS  78           HD2      LYS  78  -4.118 -14.916  -2.453
  617    HD3  LYS  78           HD3      LYS  78  -4.641 -16.591  -2.261
  618    HE2  LYS  78           HE2      LYS  78  -3.341 -15.498  -4.803
  619    HE3  LYS  78           HE3      LYS  78  -2.426 -16.208  -3.470
  620    HZ1  LYS  78           HZ1      LYS  78  -2.844 -17.839  -5.177
  621    HZ2  LYS  78           HZ2      LYS  78  -3.632 -18.298  -3.826
  622    HZ3  LYS  78           HZ3      LYS  78  -4.457 -17.656  -5.092
  623    H    LEU  79           H        LEU  79  -7.952 -12.169  -2.458
  624    HA   LEU  79           HA       LEU  79 -10.043 -11.809  -0.536
  625    HB2  LEU  79           HB2      LEU  79  -9.702 -10.577  -3.309
  626    HB3  LEU  79           HB3      LEU  79 -10.764  -9.984  -2.035
  627    HG   LEU  79           HG       LEU  79  -7.735  -9.888  -2.158
  628   HD11  LEU  79          HD11      LEU  79  -9.905  -7.757  -1.990
  629   HD12  LEU  79          HD12      LEU  79  -8.150  -7.466  -2.087
  630   HD13  LEU  79          HD13      LEU  79  -9.006  -8.228  -3.443
  631   HD21  LEU  79          HD21      LEU  79  -7.829  -8.767   0.062
  632   HD22  LEU  79          HD22      LEU  79  -9.533  -9.265   0.205
  633   HD23  LEU  79          HD23      LEU  79  -8.228 -10.488   0.098
  634    HA   PRO  80           HA       PRO  80 -13.304 -13.911  -2.900
  635    HB2  PRO  80           HB2      PRO  80 -15.522 -12.775  -1.656
  636    HB3  PRO  80           HB3      PRO  80 -14.541 -14.063  -0.876
  637    HG2  PRO  80           HG2      PRO  80 -14.329 -11.081  -0.539
  638    HG3  PRO  80           HG3      PRO  80 -14.446 -12.324   0.749
  639    HD2  PRO  80           HD2      PRO  80 -12.040 -11.320  -0.007
  640    HD3  PRO  80           HD3      PRO  80 -12.212 -13.062   0.346
  641    H    LYS  81           H        LYS  81 -14.577 -13.012  -4.831
  642    HA   LYS  81           HA       LYS  81 -13.235 -10.655  -5.637
  643    HB2  LYS  81           HB2      LYS  81 -15.497 -11.824  -7.169
  644    HB3  LYS  81           HB3      LYS  81 -14.094 -10.829  -7.710
  645    HG2  LYS  81           HG2      LYS  81 -12.610 -12.762  -6.974
  646    HG3  LYS  81           HG3      LYS  81 -14.084 -13.725  -6.818
  647    HD2  LYS  81           HD2      LYS  81 -12.787 -12.626  -9.313
  648    HD3  LYS  81           HD3      LYS  81 -13.296 -14.274  -8.946
  649    HE2  LYS  81           HE2      LYS  81 -15.713 -13.426  -9.074
  650    HE3  LYS  81           HE3      LYS  81 -15.067 -11.874  -9.656
  651    HZ1  LYS  81           HZ1      LYS  81 -14.720 -14.500 -11.012
  652    HZ2  LYS  81           HZ2      LYS  81 -15.708 -13.297 -11.497
  653    HZ3  LYS  81           HZ3      LYS  81 -14.091 -13.081 -11.544
  654    H    ARG  82           H        ARG  82 -16.202 -10.879  -3.900
  655    HA   ARG  82           HA       ARG  82 -17.318  -8.416  -4.686
  656    HB2  ARG  82           HB2      ARG  82 -18.436  -8.343  -2.535
  657    HB3  ARG  82           HB3      ARG  82 -18.526  -9.941  -3.282
  658    HG2  ARG  82           HG2      ARG  82 -16.545 -10.568  -1.714
  659    HG3  ARG  82           HG3      ARG  82 -16.896  -9.055  -0.870
  660    HD2  ARG  82           HD2      ARG  82 -18.885 -11.301  -1.374
  661    HD3  ARG  82           HD3      ARG  82 -17.986 -11.072   0.137
  662    HE   ARG  82           HE       ARG  82 -19.247  -8.639  -0.292
  663   HH11  ARG  82          HH21      ARG  82 -20.343 -11.991   0.188
  664   HH12  ARG  82          HH22      ARG  82 -21.864 -11.542   0.879
  665   HH21  ARG  82          HH11      ARG  82 -21.274  -8.044   0.625
  666   HH22  ARG  82          HH12      ARG  82 -22.388  -9.253   1.150
  667    H    LEU  83           H        LEU  83 -14.490  -9.034  -2.694
  668    HA   LEU  83           HA       LEU  83 -14.326  -6.228  -1.858
  669    HB2  LEU  83           HB2      LEU  83 -12.454  -8.540  -1.284
  670    HB3  LEU  83           HB3      LEU  83 -12.410  -6.951  -0.531
  671    HG   LEU  83           HG       LEU  83 -14.636  -9.003  -0.266
  672   HD11  LEU  83          HD11      LEU  83 -12.712  -8.015   1.858
  673   HD12  LEU  83          HD12      LEU  83 -13.939  -9.303   2.003
  674   HD13  LEU  83          HD13      LEU  83 -12.530  -9.531   0.959
  675   HD21  LEU  83          HD21      LEU  83 -15.610  -7.539   1.472
  676   HD22  LEU  83          HD22      LEU  83 -14.478  -6.252   0.983
  677   HD23  LEU  83          HD23      LEU  83 -15.710  -6.871  -0.155
  678    H    VAL  84           H        VAL  84 -13.085  -8.300  -4.347
  679    HA   VAL  84           HA       VAL  84 -10.643  -6.901  -4.931
  680    HB   VAL  84           HB       VAL  84 -12.494  -8.593  -6.690
  681   HG11  VAL  84          HG11      VAL  84 -11.128  -7.354  -8.193
  682   HG12  VAL  84          HG12      VAL  84  -9.695  -7.555  -7.166
  683   HG13  VAL  84          HG13      VAL  84 -10.361  -8.941  -8.037
  684   HG21  VAL  84          HG21      VAL  84 -11.086 -10.453  -6.321
  685   HG22  VAL  84          HG22      VAL  84  -9.866  -9.476  -5.457
  686   HG23  VAL  84          HG23      VAL  84 -11.435  -9.815  -4.708
  687    H    ARG  85           H        ARG  85 -10.344  -5.015  -6.073
  688    HA   ARG  85           HA       ARG  85 -12.671  -3.824  -7.462
  689    HB2  ARG  85           HB2      ARG  85 -10.521  -2.778  -5.746
  690    HB3  ARG  85           HB3      ARG  85 -10.585  -1.908  -7.287
  691    HG2  ARG  85           HG2      ARG  85 -13.004  -2.457  -5.578
  692    HG3  ARG  85           HG3      ARG  85 -12.036  -0.958  -5.509
  693    HD2  ARG  85           HD2      ARG  85 -12.452  -0.783  -8.064
  694    HD3  ARG  85           HD3      ARG  85 -13.720  -1.980  -7.856
  695    HE   ARG  85           HE       ARG  85 -13.647   0.827  -6.997
  696   HH11  ARG  85          HH21      ARG  85 -15.429  -2.241  -6.553
  697   HH12  ARG  85          HH22      ARG  85 -16.872  -1.469  -6.013
  698   HH21  ARG  85          HH11      ARG  85 -15.571   1.827  -6.280
  699   HH22  ARG  85          HH12      ARG  85 -16.947   0.888  -5.836
  700    H    TRP  86           H        TRP  86 -12.655  -4.956  -9.273
  701    HA   TRP  86           HA       TRP  86 -10.379  -5.365 -10.941
  702    HB2  TRP  86           HB2      TRP  86 -13.370  -5.368 -11.437
  703    HB3  TRP  86           HB3      TRP  86 -12.193  -5.859 -12.664
  704    HD1  TRP  86           HD1      TRP  86 -14.263  -7.342 -10.029
  705    HE1  TRP  86           HE1      TRP  86 -13.488  -9.635  -9.325
  706    HE3  TRP  86           HE3      TRP  86  -9.725  -7.415 -12.415
  707    HZ2  TRP  86           HZ2      TRP  86 -11.073 -11.238  -9.526
  708    HZ3  TRP  86           HZ3      TRP  86  -8.216  -9.371 -12.154
  709    HH2  TRP  86           HH2      TRP  86  -8.865 -11.273 -10.700
  710    H    ASP  87           H        ASP  87 -12.502  -2.614 -10.482
  711    HA   ASP  87           HA       ASP  87 -12.273  -1.497 -13.102
  712    HB2  ASP  87           HB2      ASP  87 -14.154  -1.068 -11.592
  713    HB3  ASP  87           HB3      ASP  87 -13.086  -0.261 -10.448
  714    H    THR  88           H        THR  88 -10.133  -1.306 -10.330
  715    HA   THR  88           HA       THR  88  -8.701   0.962 -11.570
  716    HB   THR  88           HB       THR  88  -9.828   1.333  -9.300
  717    HG1  THR  88           HG1      THR  88  -8.215   2.748  -8.803
  718   HG21  THR  88          HG21      THR  88  -8.680   0.644  -7.316
  719   HG22  THR  88          HG22      THR  88  -8.933  -0.821  -8.273
  720   HG23  THR  88          HG23      THR  88  -7.331  -0.057  -8.257
  721    H    LYS  89           H        LYS  89  -6.316   0.885 -11.236
  722    HA   LYS  89           HA       LYS  89  -5.348  -1.882 -11.559
  723    HB2  LYS  89           HB2      LYS  89  -4.517   0.405 -13.356
  724    HB3  LYS  89           HB3      LYS  89  -4.109  -1.292 -13.534
  725    HG2  LYS  89           HG2      LYS  89  -6.866  -0.053 -13.886
  726    HG3  LYS  89           HG3      LYS  89  -5.763  -0.524 -15.174
  727    HD2  LYS  89           HD2      LYS  89  -5.987  -2.895 -14.587
  728    HD3  LYS  89           HD3      LYS  89  -7.022  -2.486 -13.207
  729    HE2  LYS  89           HE2      LYS  89  -8.592  -1.320 -14.848
  730    HE3  LYS  89           HE3      LYS  89  -7.619  -2.002 -16.153
  731    HZ1  LYS  89           HZ1      LYS  89  -8.188  -4.238 -15.239
  732    HZ2  LYS  89           HZ2      LYS  89  -9.200  -3.522 -14.141
  733    HZ3  LYS  89           HZ3      LYS  89  -9.494  -3.399 -15.742
  734    HA   PRO  90           HA       PRO  90  -3.636  -3.043 -11.528
  735    HB2  PRO  90           HB2      PRO  90  -2.052  -4.358  -9.810
  736    HB3  PRO  90           HB3      PRO  90  -1.438  -3.406 -11.206
  737    HG2  PRO  90           HG2      PRO  90  -1.634  -2.520  -8.299
  738    HG3  PRO  90           HG3      PRO  90  -0.210  -2.401  -9.377
  739    HD2  PRO  90           HD2      PRO  90  -1.963  -0.322  -8.984
  740    HD3  PRO  90           HD3      PRO  90  -1.170  -0.594 -10.567
  741    H    VAL  91           H        VAL  91  -4.959  -4.738 -10.701
  742    HA   VAL  91           HA       VAL  91  -6.728  -3.933  -8.547
  743    HB   VAL  91           HB       VAL  91  -7.778  -4.811 -10.453
  744   HG11  VAL  91          HG11      VAL  91  -5.987  -5.907 -11.676
  745   HG12  VAL  91          HG12      VAL  91  -5.888  -7.196 -10.446
  746   HG13  VAL  91          HG13      VAL  91  -7.322  -7.029 -11.476
  747   HG21  VAL  91          HG21      VAL  91  -8.605  -5.777  -8.270
  748   HG22  VAL  91          HG22      VAL  91  -9.006  -6.736  -9.703
  749   HG23  VAL  91          HG23      VAL  91  -7.692  -7.250  -8.641
  750    H    CYS  92           H        CYS  92  -6.889  -4.687  -6.544
  751    HA   CYS  92           HA       CYS  92  -4.757  -6.304  -5.413
  752    HB2  CYS  92           HB2      CYS  92  -6.238  -6.027  -3.336
  753    HB3  CYS  92           HB3      CYS  92  -5.592  -4.548  -4.049
  754    HG   CYS  92           HG       CYS  92  -7.996  -4.067  -3.169
  755    H    ILE  93           H        ILE  93  -4.783  -8.538  -5.420
  756    HA   ILE  93           HA       ILE  93  -7.473  -9.815  -5.149
  757    HB   ILE  93           HB       ILE  93  -7.008 -11.591  -6.502
  758   HG12  ILE  93          HG12      ILE  93  -4.743 -12.205  -6.026
  759   HG13  ILE  93          HG13      ILE  93  -4.976 -12.052  -7.754
  760   HG21  ILE  93          HG21      ILE  93  -6.756 -10.626  -8.713
  761   HG22  ILE  93          HG22      ILE  93  -7.712  -9.561  -7.670
  762   HG23  ILE  93          HG23      ILE  93  -6.021  -9.160  -8.044
  763   HD11  ILE  93          HD11      ILE  93  -3.851  -9.769  -7.641
  764   HD12  ILE  93          HD12      ILE  93  -3.482 -10.137  -5.931
  765   HD13  ILE  93          HD13      ILE  93  -2.827 -11.146  -7.217
  766    H    GLY  94           H        GLY  94  -4.353  -9.465  -3.708
  767    HA2  GLY  94           HA2      GLY  94  -5.116 -10.895  -1.409
  768    HA3  GLY  94           HA3      GLY  94  -4.080 -11.935  -2.407
  769    H    GLN  95           H        GLN  95  -3.016 -11.332  -0.113
  770    HA   GLN  95           HA       GLN  95  -0.795  -9.520  -0.665
  771    HB2  GLN  95           HB2      GLN  95  -1.035  -8.230   1.363
  772    HB3  GLN  95           HB3      GLN  95  -2.433  -8.001   0.319
  773    HG2  GLN  95           HG2      GLN  95  -2.385  -9.680   2.839
  774    HG3  GLN  95           HG3      GLN  95  -3.029  -8.052   2.685
  775   HE21  GLN  95          HE22      GLN  95  -3.649 -11.406   2.199
  776   HE22  GLN  95          HE21      GLN  95  -5.246 -11.275   1.473
  777    H    LYS  96           H        LYS  96   1.036 -10.020   0.574
  778    HA   LYS  96           HA       LYS  96   0.901 -12.594   2.094
  779    HB2  LYS  96           HB2      LYS  96   3.336 -12.626   1.956
  780    HB3  LYS  96           HB3      LYS  96   2.613 -12.532   0.352
  781    HG2  LYS  96           HG2      LYS  96   3.108 -10.089   0.282
  782    HG3  LYS  96           HG3      LYS  96   3.886 -10.195   1.866
  783    HD2  LYS  96           HD2      LYS  96   4.795 -11.721  -0.610
  784    HD3  LYS  96           HD3      LYS  96   5.430 -10.152  -0.110
  785    HE2  LYS  96           HE2      LYS  96   6.211 -11.132   2.054
  786    HE3  LYS  96           HE3      LYS  96   5.604 -12.714   1.547
  787    HZ1  LYS  96           HZ1      LYS  96   7.169 -12.646  -0.328
  788    HZ2  LYS  96           HZ2      LYS  96   7.745 -11.188   0.158
  789    HZ3  LYS  96           HZ3      LYS  96   7.968 -12.513   1.091
  790    H    GLN  97           H        GLN  97   1.006 -12.520   4.327
  791    HA   GLN  97           HA       GLN  97   1.553  -9.851   5.518
  792    HB2  GLN  97           HB2      GLN  97  -0.854 -10.493   5.213
  793    HB3  GLN  97           HB3      GLN  97  -0.619 -11.746   6.434
  794    HG2  GLN  97           HG2      GLN  97  -0.121 -10.064   8.136
  795    HG3  GLN  97           HG3      GLN  97   0.103  -8.821   6.915
  796   HE21  GLN  97          HE22      GLN  97  -1.459  -7.511   8.180
  797   HE22  GLN  97          HE21      GLN  97  -3.184  -7.819   7.908
  798    H    LYS  98           H        LYS  98   3.143  -9.842   6.954
  799    HA   LYS  98           HA       LYS  98   3.951 -12.401   8.275
  800    HB2  LYS  98           HB2      LYS  98   5.646 -11.266   6.960
  801    HB3  LYS  98           HB3      LYS  98   5.406  -9.747   7.875
  802    HG2  LYS  98           HG2      LYS  98   6.421 -10.596   9.763
  803    HG3  LYS  98           HG3      LYS  98   6.223 -12.297   9.289
  804    HD2  LYS  98           HD2      LYS  98   7.991 -10.378   7.744
  805    HD3  LYS  98           HD3      LYS  98   8.601 -11.198   9.173
  806    HE2  LYS  98           HE2      LYS  98   7.329 -12.824   6.926
  807    HE3  LYS  98           HE3      LYS  98   8.949 -12.174   6.718
  808    HZ1  LYS  98           HZ1      LYS  98   9.087 -14.387   7.613
  809    HZ2  LYS  98           HZ2      LYS  98   9.673 -13.351   8.719
  810    HZ3  LYS  98           HZ3      LYS  98   8.190 -14.038   8.929
  811    H    TRP  99           H        TRP  99   3.593 -12.616  10.467
  812    HA   TRP  99           HA       TRP  99   2.311 -10.286  11.817
  813    HB2  TRP  99           HB2      TRP  99   1.941 -13.266  12.178
  814    HB3  TRP  99           HB3      TRP  99   1.214 -12.025  13.196
  815    HD1  TRP  99           HD1      TRP  99   1.119 -13.296   9.551
  816    HE1  TRP  99           HE1      TRP  99  -1.148 -12.679   8.524
  817    HE3  TRP  99           HE3      TRP  99  -0.701 -10.379  13.333
  818    HZ2  TRP  99           HZ2      TRP  99  -3.471 -11.131   9.268
  819    HZ3  TRP  99           HZ3      TRP  99  -2.862  -9.225  13.087
  820    HH2  TRP  99           HH2      TRP  99  -4.304  -9.638  11.088
  821    H    PHE 100           H        PHE 100   2.842  -9.874  14.022
  822    HA   PHE 100           HA       PHE 100   5.439 -11.023  14.961
  823    HB2  PHE 100           HB2      PHE 100   4.467  -8.129  14.845
  824    HB3  PHE 100           HB3      PHE 100   5.867  -8.663  15.768
  825    HD1  PHE 100           HD2      PHE 100   4.480  -8.320  12.301
  826    HD2  PHE 100           HD1      PHE 100   7.974  -9.041  14.739
  827    HE1  PHE 100           HE2      PHE 100   5.942  -8.073  10.309
  828    HE2  PHE 100           HE1      PHE 100   9.426  -8.784  12.742
  829    HZ   PHE 100           HZ       PHE 100   8.411  -8.322  10.531
  830    H    LEU 101           H        LEU 101   5.299 -11.731  17.064
  831    HA   LEU 101           HA       LEU 101   2.955 -10.940  18.700
  832    HB2  LEU 101           HB2      LEU 101   3.896 -13.406  18.460
  833    HB3  LEU 101           HB3      LEU 101   5.132 -12.864  19.570
  834    HG   LEU 101           HG       LEU 101   2.308 -13.562  19.975
  835   HD11  LEU 101          HD11      LEU 101   4.491 -13.545  22.101
  836   HD12  LEU 101          HD12      LEU 101   3.090 -14.632  21.929
  837   HD13  LEU 101          HD13      LEU 101   4.474 -14.795  20.856
  838   HD21  LEU 101          HD21      LEU 101   2.115 -11.162  20.637
  839   HD22  LEU 101          HD22      LEU 101   1.858 -12.297  21.925
  840   HD23  LEU 101          HD23      LEU 101   3.410 -11.429  21.837
  841    H    LEU 102           H        LEU 102   3.335  -9.222  20.112
  842    HA   LEU 102           HA       LEU 102   6.136  -8.925  21.071
  843    HB2  LEU 102           HB2      LEU 102   4.194  -6.632  21.192
  844    HB3  LEU 102           HB3      LEU 102   5.938  -6.595  21.215
  845    HG   LEU 102           HG       LEU 102   4.223  -7.135  18.771
  846   HD11  LEU 102          HD11      LEU 102   4.079  -4.804  19.738
  847   HD12  LEU 102          HD12      LEU 102   5.833  -4.653  19.455
  848   HD13  LEU 102          HD13      LEU 102   4.727  -4.892  18.091
  849   HD21  LEU 102          HD21      LEU 102   6.420  -8.198  18.518
  850   HD22  LEU 102          HD22      LEU 102   6.328  -6.752  17.504
  851   HD23  LEU 102          HD23      LEU 102   7.231  -6.702  19.045
  852    H    GLN 103           H        GLN 103   6.344  -8.552  23.361
  853    HA   GLN 103           HA       GLN 103   3.750  -8.871  24.849
  854    HB2  GLN 103           HB2      GLN 103   5.057 -10.467  25.579
  855    HB3  GLN 103           HB3      GLN 103   6.551  -9.510  25.648
  856    HG2  GLN 103           HG2      GLN 103   5.957  -8.656  27.767
  857    HG3  GLN 103           HG3      GLN 103   4.254  -8.511  27.348
  858   HE21  GLN 103          HE22      GLN 103   2.823 -10.386  27.453
  859   HE22  GLN 103          HE21      GLN 103   3.273 -11.721  28.508
  860    H    LEU 104           H        LEU 104   2.878  -7.028  25.564
  861    HA   LEU 104           HA       LEU 104   4.047  -4.434  25.389
  862    HB2  LEU 104           HB2      LEU 104   1.535  -5.709  26.184
  863    HB3  LEU 104           HB3      LEU 104   1.997  -4.585  27.444
  864    HG   LEU 104           HG       LEU 104   1.860  -3.881  24.495
  865   HD11  LEU 104          HD11      LEU 104  -0.270  -2.828  24.911
  866   HD12  LEU 104          HD12      LEU 104  -0.378  -4.531  25.367
  867   HD13  LEU 104          HD13      LEU 104  -0.224  -3.300  26.630
  868   HD21  LEU 104          HD21      LEU 104   2.368  -2.274  27.030
  869   HD22  LEU 104          HD22      LEU 104   3.293  -2.338  25.524
  870   HD23  LEU 104          HD23      LEU 104   1.726  -1.517  25.560
  871    H    VAL 105           H        VAL 105   5.196  -3.200  26.942
  872    HA   VAL 105           HA       VAL 105   6.533  -4.884  28.918
  873    HB   VAL 105           HB       VAL 105   7.096  -2.129  27.839
  874   HG11  VAL 105          HG11      VAL 105   9.344  -2.326  28.867
  875   HG12  VAL 105          HG12      VAL 105   8.062  -2.227  30.078
  876   HG13  VAL 105          HG13      VAL 105   8.818  -3.795  29.723
  877   HG21  VAL 105          HG21      VAL 105   8.798  -3.094  26.495
  878   HG22  VAL 105          HG22      VAL 105   8.754  -4.631  27.396
  879   HG23  VAL 105          HG23      VAL 105   7.437  -4.193  26.303
  880    H    SER 106           H        SER 106   4.688  -1.798  28.949
  881    HA   SER 106           HA       SER 106   4.634  -1.827  31.907
  882    HB2  SER 106           HB2      SER 106   3.358   0.012  29.851
  883    HB3  SER 106           HB3      SER 106   3.268   0.229  31.606
  884    HG   SER 106           HG       SER 106   5.519   0.373  29.897
  885    H    GLY 107           H        GLY 107   2.717  -2.950  29.240
  886    HA2  GLY 107           HA2      GLY 107   1.046  -4.689  29.599
  887    HA3  GLY 107           HA3      GLY 107   0.606  -3.912  31.122
  888    H    ASP 108           H        ASP 108  -1.536  -4.090  30.087
  889    HA   ASP 108           HA       ASP 108  -2.368  -2.931  27.748
  890    HB2  ASP 108           HB2      ASP 108  -3.716  -4.505  28.710
  891    HB3  ASP 108           HB3      ASP 108  -3.630  -3.794  30.320
  892    H    ALA 109           H        ALA 109  -1.648  -1.317  30.734
  893    HA   ALA 109           HA       ALA 109  -3.145   1.051  30.533
  894    HB1  ALA 109           HB1      ALA 109  -0.265   0.676  31.492
  895    HB2  ALA 109           HB2      ALA 109  -1.313   2.059  31.862
  896    HB3  ALA 109           HB3      ALA 109  -1.732   0.450  32.482
  897    H    GLU 110           H        GLU 110  -0.339   0.059  28.608
  898    HA   GLU 110           HA       GLU 110   0.005   2.789  27.689
  899    HB2  GLU 110           HB2      GLU 110   1.776   0.365  27.675
  900    HB3  GLU 110           HB3      GLU 110   2.134   1.668  26.539
  901    HG2  GLU 110           HG2      GLU 110   1.823   2.063  29.527
  902    HG3  GLU 110           HG3      GLU 110   3.365   1.859  28.684
  903    H    ILE 111           H        ILE 111  -2.195   1.124  26.809
  904    HA   ILE 111           HA       ILE 111  -1.810   1.235  23.842
  905    HB   ILE 111           HB       ILE 111  -4.227   0.125  25.318
  906   HG12  ILE 111          HG12      ILE 111  -2.175  -1.572  23.853
  907   HG13  ILE 111          HG13      ILE 111  -1.963  -1.226  25.568
  908   HG21  ILE 111          HG21      ILE 111  -4.737   0.929  23.100
  909   HG22  ILE 111          HG22      ILE 111  -3.350   0.046  22.412
  910   HG23  ILE 111          HG23      ILE 111  -4.755  -0.822  23.080
  911   HD11  ILE 111          HD11      ILE 111  -4.014  -2.279  26.175
  912   HD12  ILE 111          HD12      ILE 111  -4.507  -2.501  24.507
  913   HD13  ILE 111          HD13      ILE 111  -3.113  -3.393  25.136
  914    H    ASN 112           H        ASN 112  -2.778   2.882  22.678
  915    HA   ASN 112           HA       ASN 112  -4.457   4.851  24.216
  916    HB2  ASN 112           HB2      ASN 112  -2.188   5.715  23.885
  917    HB3  ASN 112           HB3      ASN 112  -2.310   5.446  22.147
  918   HD21  ASN 112          HD22      ASN 112  -2.067   7.720  21.608
  919   HD22  ASN 112          HD21      ASN 112  -3.312   8.876  21.987
  920    H    MET 113           H        MET 113  -3.661   3.777  20.880
  921    HA   MET 113           HA       MET 113  -4.825   3.444  19.026
  922    HB2  MET 113           HB2      MET 113  -7.464   3.400  20.459
  923    HB3  MET 113           HB3      MET 113  -6.925   2.524  19.030
  924    HG2  MET 113           HG2      MET 113  -5.151   1.506  20.744
  925    HG3  MET 113           HG3      MET 113  -6.350   2.018  21.932
  926    HE1  MET 113           HE1      MET 113  -6.176  -1.765  19.606
  927    HE2  MET 113           HE2      MET 113  -5.347  -0.263  19.103
  928    HE3  MET 113           HE3      MET 113  -5.042  -0.953  20.723
  929    H    GLN 114           H        GLN 114  -4.502   6.333  20.121
  930    HA   GLN 114           HA       GLN 114  -6.495   7.667  18.414
  931    HB2  GLN 114           HB2      GLN 114  -5.929   8.302  21.310
  932    HB3  GLN 114           HB3      GLN 114  -6.937   9.269  20.218
  933    HG2  GLN 114           HG2      GLN 114  -8.477   7.329  19.938
  934    HG3  GLN 114           HG3      GLN 114  -7.526   6.422  21.106
  935   HE21  GLN 114          HE22      GLN 114  -9.224   9.651  20.834
  936   HE22  GLN 114          HE21      GLN 114  -9.844   9.619  22.467
  937    H    THR 115           H        THR 115  -3.727   7.121  18.174
  938    HA   THR 115           HA       THR 115  -2.073   9.448  18.393
  939    HB   THR 115           HB       THR 115  -1.192   8.075  16.239
  940    HG1  THR 115           HG1      THR 115  -1.564   5.824  16.680
  941   HG21  THR 115          HG21      THR 115  -0.986   7.136  19.157
  942   HG22  THR 115          HG22      THR 115   0.228   6.816  17.874
  943   HG23  THR 115          HG23      THR 115  -0.021   8.462  18.461
  944    H    SER 116           H        SER 116  -3.981   8.009  15.821
  945    HA   SER 116           HA       SER 116  -4.146  10.358  14.128
  946    HB2  SER 116           HB2      SER 116  -5.993   7.938  14.284
  947    HB3  SER 116           HB3      SER 116  -5.926   9.129  12.969
  948    HG   SER 116           HG       SER 116  -4.683   7.229  12.502
  949    H    SER 117           H        SER 117  -6.102  11.690  13.778
  950    HA   SER 117           HA       SER 117  -7.120  12.717  16.218
  951    HB2  SER 117           HB2      SER 117  -8.219  13.168  13.414
  952    HB3  SER 117           HB3      SER 117  -8.347  14.252  14.810
  953    HG   SER 117           HG       SER 117  -6.669  14.889  13.357
  954    H    THR 118           H        THR 118  -8.383  10.366  13.891
  955    HA   THR 118           HA       THR 118 -10.894   9.985  15.347
  956    HB   THR 118           HB       THR 118 -10.607   7.999  13.502
  957    HG1  THR 118           HG1      THR 118 -10.018  10.460  12.168
  958   HG21  THR 118          HG21      THR 118 -12.444   9.131  12.335
  959   HG22  THR 118          HG22      THR 118 -12.652   9.070  14.095
  960   HG23  THR 118          HG23      THR 118 -12.140  10.593  13.316
  961    HA   PRO 119           HA       PRO 119  -8.817   6.731  17.709
  962    HB2  PRO 119           HB2      PRO 119 -11.667   5.730  17.908
  963    HB3  PRO 119           HB3      PRO 119 -10.433   5.880  19.199
  964    HG2  PRO 119           HG2      PRO 119 -12.427   7.713  18.978
  965    HG3  PRO 119           HG3      PRO 119 -10.746   8.240  19.321
  966    HD2  PRO 119           HD2      PRO 119 -12.207   8.274  16.665
  967    HD3  PRO 119           HD3      PRO 119 -11.151   9.528  17.396
  968    H    GLU 120           H        GLU 120  -7.830   5.097  16.553
  969    HA   GLU 120           HA       GLU 120  -8.776   4.335  13.983
  970    HB2  GLU 120           HB2      GLU 120  -6.394   4.533  14.670
  971    HB3  GLU 120           HB3      GLU 120  -6.595   3.179  15.792
  972    HG2  GLU 120           HG2      GLU 120  -5.527   2.513  13.721
  973    HG3  GLU 120           HG3      GLU 120  -7.071   1.688  13.967
  974    H    PHE 121           H        PHE 121  -9.043   2.909  17.198
  975    HA   PHE 121           HA       PHE 121 -10.898   0.875  16.099
  976    HB2  PHE 121           HB2      PHE 121  -9.108   0.557  18.521
  977    HB3  PHE 121           HB3      PHE 121 -10.343  -0.573  18.004
  978    HD1  PHE 121           HD1      PHE 121 -10.013  -1.972  15.944
  979    HD2  PHE 121           HD2      PHE 121  -6.973   0.746  17.346
  980    HE1  PHE 121           HE1      PHE 121  -8.356  -3.055  14.434
  981    HE2  PHE 121           HE2      PHE 121  -5.340  -0.353  15.857
  982    HZ   PHE 121           HZ       PHE 121  -6.028  -2.222  14.392
  983    H    ASP 122           H        ASP 122 -12.849   0.794  17.080
  984    HA   ASP 122           HA       ASP 122 -13.672   3.098  18.733
  985    HB2  ASP 122           HB2      ASP 122 -15.077   2.453  16.851
  986    HB3  ASP 122           HB3      ASP 122 -15.171   0.792  17.444
  987    H    GLY 123           H        GLY 123 -12.662  -0.226  19.142
  988    HA2  GLY 123           HA2      GLY 123 -12.930  -0.003  22.023
  989    HA3  GLY 123           HA3      GLY 123 -13.950  -1.261  21.295
  990    H    TRP 124           H        TRP 124 -11.884  -1.871  23.097
  991    HA   TRP 124           HA       TRP 124 -10.399  -3.722  21.410
  992    HB2  TRP 124           HB2      TRP 124  -8.290  -3.234  22.034
  993    HB3  TRP 124           HB3      TRP 124  -8.935  -1.607  22.051
  994    HD1  TRP 124           HD1      TRP 124  -6.965  -3.910  24.054
  995    HE1  TRP 124           HE1      TRP 124  -6.806  -3.210  26.537
  996    HE3  TRP 124           HE3      TRP 124 -10.609  -0.284  24.199
  997    HZ2  TRP 124           HZ2      TRP 124  -8.422  -1.826  28.404
  998    HZ3  TRP 124           HZ3      TRP 124 -11.281   0.704  26.375
  999    HH2  TRP 124           HH2      TRP 124 -10.227  -0.073  28.490
 1000    H    ARG 125           H        ARG 125  -9.678  -5.599  22.714
 1001    HA   ARG 125           HA       ARG 125 -10.568  -5.775  25.470
 1002    HB2  ARG 125           HB2      ARG 125 -12.056  -7.692  25.191
 1003    HB3  ARG 125           HB3      ARG 125 -12.675  -6.290  24.332
 1004    HG2  ARG 125           HG2      ARG 125 -11.661  -7.273  22.198
 1005    HG3  ARG 125           HG3      ARG 125 -11.349  -8.746  23.105
 1006    HD2  ARG 125           HD2      ARG 125 -14.100  -7.455  22.820
 1007    HD3  ARG 125           HD3      ARG 125 -13.480  -8.710  21.740
 1008    HE   ARG 125           HE       ARG 125 -13.449  -9.390  24.603
 1009   HH11  ARG 125          HH11      ARG 125 -15.516  -9.374  21.700
 1010   HH12  ARG 125          HH12      ARG 125 -16.379 -10.812  22.158
 1011   HH21  ARG 125          HH21      ARG 125 -14.737 -11.185  25.273
 1012   HH22  ARG 125          HH22      ARG 125 -16.003 -11.767  24.259
 1013    H    TRP 126           H        TRP 126  -9.920  -7.911  26.387
 1014    HA   TRP 126           HA       TRP 126  -7.538  -9.053  24.998
 1015    HB2  TRP 126           HB2      TRP 126  -8.066  -8.375  27.910
 1016    HB3  TRP 126           HB3      TRP 126  -6.855  -9.565  27.429
 1017    HD1  TRP 126           HD1      TRP 126  -7.489  -5.821  27.532
 1018    HE1  TRP 126           HE1      TRP 126  -5.350  -4.580  27.166
 1019    HE3  TRP 126           HE3      TRP 126  -4.564  -9.750  26.010
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.602  -5.201  26.475
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.166  -9.382  25.544
 1022    HH2  TRP 126           HH2      TRP 126  -1.159  -7.101  25.867
 1023    H    VAL 127           H        VAL 127  -7.758 -11.192  24.516
 1024    HA   VAL 127           HA       VAL 127  -9.932 -12.799  25.798
 1025    HB   VAL 127           HB       VAL 127 -10.359 -13.602  23.380
 1026   HG11  VAL 127          HG11      VAL 127 -11.201 -10.797  24.221
 1027   HG12  VAL 127          HG12      VAL 127 -11.996 -11.761  22.962
 1028   HG13  VAL 127          HG13      VAL 127 -12.008 -12.324  24.640
 1029   HG21  VAL 127          HG21      VAL 127  -9.118 -10.938  22.641
 1030   HG22  VAL 127          HG22      VAL 127  -8.447 -12.541  22.270
 1031   HG23  VAL 127          HG23      VAL 127  -9.992 -12.044  21.561
 1032    H    SER 128           H        SER 128  -9.612 -15.112  25.656
 1033    HA   SER 128           HA       SER 128  -6.940 -16.092  25.584
 1034    HB2  SER 128           HB2      SER 128  -9.579 -17.525  25.080
 1035    HB3  SER 128           HB3      SER 128  -8.050 -18.278  25.601
 1036    HG   SER 128           HG       SER 128  -9.493 -17.889  27.380
 1037    H    TYR 129           H        TYR 129  -5.832 -17.227  23.889
 1038    HA   TYR 129           HA       TYR 129  -5.845 -15.987  21.463
 1039    HB2  TYR 129           HB2      TYR 129  -4.868 -18.719  21.106
 1040    HB3  TYR 129           HB3      TYR 129  -4.013 -17.198  21.043
 1041    HD1  TYR 129           HD1      TYR 129  -5.391 -19.760  23.407
 1042    HD2  TYR 129           HD2      TYR 129  -2.356 -16.728  22.770
 1043    HE1  TYR 129           HE1      TYR 129  -4.340 -20.368  25.552
 1044    HE2  TYR 129           HE2      TYR 129  -1.334 -17.345  24.910
 1045    HH   TYR 129           HH       TYR 129  -2.591 -19.910  27.069
 1046    H    TRP 130           H        TRP 130  -7.778 -18.918  22.189
 1047    HA   TRP 130           HA       TRP 130  -8.292 -19.324  19.346
 1048    HB2  TRP 130           HB2      TRP 130  -9.468 -20.813  21.701
 1049    HB3  TRP 130           HB3      TRP 130  -9.359 -21.351  20.022
 1050    HD1  TRP 130           HD1      TRP 130  -7.760 -22.027  23.135
 1051    HE1  TRP 130           HE1      TRP 130  -5.318 -22.771  22.937
 1052    HE3  TRP 130           HE3      TRP 130  -6.873 -20.693  18.248
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.208 -22.633  21.005
 1054    HZ3  TRP 130           HZ3      TRP 130  -4.621 -21.022  17.266
 1055    HH2  TRP 130           HH2      TRP 130  -2.778 -21.956  18.638
 1056    H    TYR 131           H        TYR 131  -9.975 -17.614  21.897
 1057    HA   TYR 131           HA       TYR 131 -12.625 -17.794  20.895
 1058    HB2  TYR 131           HB2      TYR 131 -12.208 -16.993  23.092
 1059    HB3  TYR 131           HB3      TYR 131 -11.216 -15.662  22.511
 1060    HD1  TYR 131           HD1      TYR 131 -12.246 -13.677  21.402
 1061    HD2  TYR 131           HD2      TYR 131 -14.672 -16.881  22.989
 1062    HE1  TYR 131           HE1      TYR 131 -14.247 -12.238  21.243
 1063    HE2  TYR 131           HE2      TYR 131 -16.670 -15.437  22.857
 1064    HH   TYR 131           HH       TYR 131 -17.532 -13.339  22.242
 1065    HA   PRO 132           HA       PRO 132 -11.911 -13.784  18.378
 1066    HB2  PRO 132           HB2      PRO 132  -9.416 -13.227  17.339
 1067    HB3  PRO 132           HB3      PRO 132 -10.011 -12.640  18.929
 1068    HG2  PRO 132           HG2      PRO 132  -8.275 -15.056  18.414
 1069    HG3  PRO 132           HG3      PRO 132  -8.000 -13.714  19.575
 1070    HD2  PRO 132           HD2      PRO 132  -9.145 -15.976  20.382
 1071    HD3  PRO 132           HD3      PRO 132  -9.802 -14.428  20.962
 1072    H    VAL 133           H        VAL 133 -10.045 -16.735  17.631
 1073    HA   VAL 133           HA       VAL 133 -10.367 -16.649  14.798
 1074    HB   VAL 133           HB       VAL 133 -10.159 -19.106  16.597
 1075   HG11  VAL 133          HG11      VAL 133  -9.069 -20.171  14.715
 1076   HG12  VAL 133          HG12      VAL 133 -10.651 -19.596  14.204
 1077   HG13  VAL 133          HG13      VAL 133  -9.198 -18.685  13.729
 1078   HG21  VAL 133          HG21      VAL 133  -8.316 -17.580  17.210
 1079   HG22  VAL 133          HG22      VAL 133  -7.698 -18.945  16.290
 1080   HG23  VAL 133          HG23      VAL 133  -7.902 -17.364  15.495
 1081    H    ARG 134           H        ARG 134 -12.601 -17.605  17.427
 1082    HA   ARG 134           HA       ARG 134 -14.491 -18.995  15.719
 1083    HB2  ARG 134           HB2      ARG 134 -15.220 -17.469  18.250
 1084    HB3  ARG 134           HB3      ARG 134 -16.005 -18.878  17.550
 1085    HG2  ARG 134           HG2      ARG 134 -13.306 -18.896  18.912
 1086    HG3  ARG 134           HG3      ARG 134 -14.820 -19.336  19.673
 1087    HD2  ARG 134           HD2      ARG 134 -13.748 -20.690  17.184
 1088    HD3  ARG 134           HD3      ARG 134 -13.383 -21.245  18.838
 1089    HE   ARG 134           HE       ARG 134 -16.177 -21.038  18.661
 1090   HH11  ARG 134          HH11      ARG 134 -13.628 -23.019  17.167
 1091   HH12  ARG 134          HH12      ARG 134 -14.662 -24.367  16.862
 1092   HH21  ARG 134          HH21      ARG 134 -17.556 -22.832  18.243
 1093   HH22  ARG 134          HH22      ARG 134 -16.945 -24.259  17.490
 1094    H    GLN 135           H        GLN 135 -13.816 -15.590  16.374
 1095    HA   GLN 135           HA       GLN 135 -16.517 -14.755  15.808
 1096    HB2  GLN 135           HB2      GLN 135 -14.017 -13.206  16.424
 1097    HB3  GLN 135           HB3      GLN 135 -15.594 -12.454  16.184
 1098    HG2  GLN 135           HG2      GLN 135 -14.970 -14.631  18.214
 1099    HG3  GLN 135           HG3      GLN 135 -15.046 -12.911  18.605
 1100   HE21  GLN 135          HE22      GLN 135 -16.660 -15.376  19.523
 1101   HE22  GLN 135          HE21      GLN 135 -18.327 -14.911  19.263
 1102    H    VAL 136           H        VAL 136 -13.606 -15.138  13.872
 1103    HA   VAL 136           HA       VAL 136 -14.555 -13.220  11.848
 1104    HB   VAL 136           HB       VAL 136 -12.325 -14.116  10.757
 1105   HG11  VAL 136          HG11      VAL 136 -12.376 -12.057  12.987
 1106   HG12  VAL 136          HG12      VAL 136 -11.196 -12.163  11.646
 1107   HG13  VAL 136          HG13      VAL 136 -12.881 -11.762  11.322
 1108   HG21  VAL 136          HG21      VAL 136 -10.568 -14.637  12.207
 1109   HG22  VAL 136          HG22      VAL 136 -11.488 -14.187  13.655
 1110   HG23  VAL 136          HG23      VAL 136 -11.874 -15.683  12.780
 1111    H    VAL 137           H        VAL 137 -14.593 -13.693   9.594
 1112    HA   VAL 137           HA       VAL 137 -16.146 -16.014   8.909
 1113    HB   VAL 137           HB       VAL 137 -16.318 -15.077   6.765
 1114   HG11  VAL 137          HG11      VAL 137 -15.897 -12.585   8.466
 1115   HG12  VAL 137          HG12      VAL 137 -16.937 -12.794   7.051
 1116   HG13  VAL 137          HG13      VAL 137 -17.330 -13.640   8.554
 1117   HG21  VAL 137          HG21      VAL 137 -13.641 -13.726   7.282
 1118   HG22  VAL 137          HG22      VAL 137 -14.133 -14.845   5.981
 1119   HG23  VAL 137          HG23      VAL 137 -14.743 -13.189   5.982
 1120    H    SER 138           H        SER 138 -15.383 -17.245   6.782
 1121    HA   SER 138           HA       SER 138 -13.537 -19.113   7.580
 1122    HB2  SER 138           HB2      SER 138 -14.384 -18.431   4.746
 1123    HB3  SER 138           HB3      SER 138 -13.835 -20.019   5.340
 1124    HG   SER 138           HG       SER 138 -16.137 -19.890   5.270
 1125    H    PHE 139           H        PHE 139 -12.915 -16.635   4.962
 1126    HA   PHE 139           HA       PHE 139 -10.280 -17.619   4.590
 1127    HB2  PHE 139           HB2      PHE 139  -9.955 -15.862   3.037
 1128    HB3  PHE 139           HB3      PHE 139 -11.585 -16.465   2.858
 1129    HD1  PHE 139           HD2      PHE 139  -9.497 -13.607   3.969
 1130    HD2  PHE 139           HD1      PHE 139 -13.528 -14.989   3.272
 1131    HE1  PHE 139           HE2      PHE 139 -10.312 -11.274   4.032
 1132    HE2  PHE 139           HE1      PHE 139 -14.338 -12.651   3.351
 1133    HZ   PHE 139           HZ       PHE 139 -12.735 -10.786   3.733
 1134    H    LYS 140           H        LYS 140 -11.496 -15.031   6.698
 1135    HA   LYS 140           HA       LYS 140  -8.800 -14.144   7.456
 1136    HB2  LYS 140           HB2      LYS 140 -11.542 -13.671   8.702
 1137    HB3  LYS 140           HB3      LYS 140 -10.026 -13.013   9.366
 1138    HG2  LYS 140           HG2      LYS 140  -9.561 -11.888   7.208
 1139    HG3  LYS 140           HG3      LYS 140 -11.106 -12.460   6.568
 1140    HD2  LYS 140           HD2      LYS 140 -10.823 -10.687   9.037
 1141    HD3  LYS 140           HD3      LYS 140 -11.122 -10.102   7.376
 1142    HE2  LYS 140           HE2      LYS 140 -13.197 -11.554   7.343
 1143    HE3  LYS 140           HE3      LYS 140 -12.923 -11.865   9.074
 1144    HZ1  LYS 140           HZ1      LYS 140 -13.139  -9.421   9.429
 1145    HZ2  LYS 140           HZ2      LYS 140 -13.375  -9.175   7.824
 1146    HZ3  LYS 140           HZ3      LYS 140 -14.487  -9.984   8.693
 1147    H    ARG 141           H        ARG 141 -11.297 -16.282   9.016
 1148    HA   ARG 141           HA       ARG 141  -9.608 -16.753  11.255
 1149    HB2  ARG 141           HB2      ARG 141 -11.089 -18.346  12.040
 1150    HB3  ARG 141           HB3      ARG 141 -12.045 -17.137  11.190
 1151    HG2  ARG 141           HG2      ARG 141 -12.233 -18.678   9.258
 1152    HG3  ARG 141           HG3      ARG 141 -11.399 -19.936  10.186
 1153    HD2  ARG 141           HD2      ARG 141 -13.136 -19.983  11.844
 1154    HD3  ARG 141           HD3      ARG 141 -13.828 -18.479  11.260
 1155    HE   ARG 141           HE       ARG 141 -13.873 -21.037   9.717
 1156   HH11  ARG 141          HH11      ARG 141 -15.578 -18.081  10.817
 1157   HH12  ARG 141          HH12      ARG 141 -17.092 -18.566  10.130
 1158   HH21  ARG 141          HH21      ARG 141 -15.852 -21.569   8.700
 1159   HH22  ARG 141          HH22      ARG 141 -17.221 -20.529   8.824
 1160    H    ASP 142           H        ASP 142  -9.626 -18.392   8.128
 1161    HA   ASP 142           HA       ASP 142  -7.925 -20.555   8.761
 1162    HB2  ASP 142           HB2      ASP 142  -9.136 -20.230   6.620
 1163    HB3  ASP 142           HB3      ASP 142  -8.096 -18.848   6.246
 1164    H    VAL 143           H        VAL 143  -7.124 -17.144   8.077
 1165    HA   VAL 143           HA       VAL 143  -4.225 -17.573   8.489
 1166    HB   VAL 143           HB       VAL 143  -6.034 -15.147   8.048
 1167   HG11  VAL 143          HG11      VAL 143  -3.013 -15.059   8.354
 1168   HG12  VAL 143          HG12      VAL 143  -4.048 -13.731   7.802
 1169   HG13  VAL 143          HG13      VAL 143  -4.182 -14.306   9.460
 1170   HG21  VAL 143          HG21      VAL 143  -3.907 -16.491   6.325
 1171   HG22  VAL 143          HG22      VAL 143  -5.670 -16.536   6.076
 1172   HG23  VAL 143          HG23      VAL 143  -4.795 -15.021   5.903
 1173    H    TYR 144           H        TYR 144  -6.926 -16.069  10.381
 1174    HA   TYR 144           HA       TYR 144  -5.232 -15.201  12.432
 1175    HB2  TYR 144           HB2      TYR 144  -8.203 -15.775  12.410
 1176    HB3  TYR 144           HB3      TYR 144  -7.383 -15.152  13.813
 1177    HD1  TYR 144           HD2      TYR 144  -5.983 -13.773  10.690
 1178    HD2  TYR 144           HD1      TYR 144  -9.120 -13.331  13.624
 1179    HE1  TYR 144           HE2      TYR 144  -6.203 -11.425  10.084
 1180    HE2  TYR 144           HE1      TYR 144  -9.363 -10.955  12.967
 1181    HH   TYR 144           HH       TYR 144  -7.315  -9.399  10.495
 1182    H    ARG 145           H        ARG 145  -6.747 -18.444  12.087
 1183    HA   ARG 145           HA       ARG 145  -5.833 -19.379  14.657
 1184    HB2  ARG 145           HB2      ARG 145  -6.253 -21.583  13.885
 1185    HB3  ARG 145           HB3      ARG 145  -7.486 -20.531  13.190
 1186    HG2  ARG 145           HG2      ARG 145  -5.965 -20.428  11.104
 1187    HG3  ARG 145           HG3      ARG 145  -5.144 -21.845  11.780
 1188    HD2  ARG 145           HD2      ARG 145  -8.105 -21.588  11.162
 1189    HD3  ARG 145           HD3      ARG 145  -6.888 -22.377  10.125
 1190    HE   ARG 145           HE       ARG 145  -6.688 -23.606  12.643
 1191   HH11  ARG 145          HH11      ARG 145  -9.131 -23.410  10.051
 1192   HH12  ARG 145          HH12      ARG 145  -9.857 -24.926  10.444
 1193   HH21  ARG 145          HH21      ARG 145  -7.670 -25.613  13.159
 1194   HH22  ARG 145          HH22      ARG 145  -9.012 -26.196  12.244
 1195    H    ARG 146           H        ARG 146  -4.079 -19.251  11.481
 1196    HA   ARG 146           HA       ARG 146  -1.680 -20.399  12.575
 1197    HB2  ARG 146           HB2      ARG 146  -2.288 -18.711  10.097
 1198    HB3  ARG 146           HB3      ARG 146  -0.623 -18.925  10.649
 1199    HG2  ARG 146           HG2      ARG 146  -0.786 -20.659   9.166
 1200    HG3  ARG 146           HG3      ARG 146  -1.160 -21.478  10.694
 1201    HD2  ARG 146           HD2      ARG 146  -3.604 -21.201  10.174
 1202    HD3  ARG 146           HD3      ARG 146  -3.138 -20.429   8.639
 1203    HE   ARG 146           HE       ARG 146  -1.943 -23.042   8.912
 1204   HH11  ARG 146          HH11      ARG 146  -4.941 -21.351   8.128
 1205   HH12  ARG 146          HH12      ARG 146  -5.612 -22.586   7.139
 1206   HH21  ARG 146          HH21      ARG 146  -2.798 -24.785   7.596
 1207   HH22  ARG 146          HH22      ARG 146  -4.355 -24.627   6.863
 1208    H    VAL 147           H        VAL 147  -2.765 -16.971  12.296
 1209    HA   VAL 147           HA       VAL 147  -0.502 -15.770  13.377
 1210    HB   VAL 147           HB       VAL 147  -3.419 -14.942  13.682
 1211   HG11  VAL 147          HG11      VAL 147  -2.110 -13.590  15.205
 1212   HG12  VAL 147          HG12      VAL 147  -0.922 -13.232  13.928
 1213   HG13  VAL 147          HG13      VAL 147  -2.592 -12.620  13.826
 1214   HG21  VAL 147          HG21      VAL 147  -3.000 -13.526  11.710
 1215   HG22  VAL 147          HG22      VAL 147  -1.329 -14.143  11.633
 1216   HG23  VAL 147          HG23      VAL 147  -2.685 -15.208  11.294
 1217    H    MET 148           H        MET 148  -2.871 -17.696  15.094
 1218    HA   MET 148           HA       MET 148  -1.919 -16.770  17.705
 1219    HB2  MET 148           HB2      MET 148  -4.164 -18.683  17.034
 1220    HB3  MET 148           HB3      MET 148  -3.706 -18.145  18.663
 1221    HG2  MET 148           HG2      MET 148  -4.616 -16.238  16.476
 1222    HG3  MET 148           HG3      MET 148  -5.695 -17.022  17.607
 1223    HE1  MET 148           HE1      MET 148  -3.640 -14.149  16.753
 1224    HE2  MET 148           HE2      MET 148  -3.331 -13.250  18.245
 1225    HE3  MET 148           HE3      MET 148  -2.285 -14.621  17.805
 1226    H    LYS 149           H        LYS 149  -2.290 -19.906  15.898
 1227    HA   LYS 149           HA       LYS 149  -0.817 -21.401  17.765
 1228    HB2  LYS 149           HB2      LYS 149  -2.012 -22.755  16.575
 1229    HB3  LYS 149           HB3      LYS 149  -1.864 -21.864  15.058
 1230    HG2  LYS 149           HG2      LYS 149   0.405 -23.544  16.149
 1231    HG3  LYS 149           HG3      LYS 149  -0.891 -24.228  15.172
 1232    HD2  LYS 149           HD2      LYS 149  -0.383 -22.972  13.258
 1233    HD3  LYS 149           HD3      LYS 149   0.540 -21.769  14.163
 1234    HE2  LYS 149           HE2      LYS 149   2.232 -23.518  14.728
 1235    HE3  LYS 149           HE3      LYS 149   1.321 -24.673  13.748
 1236    HZ1  LYS 149           HZ1      LYS 149   3.170 -23.777  12.488
 1237    HZ2  LYS 149           HZ2      LYS 149   1.794 -23.264  11.787
 1238    HZ3  LYS 149           HZ3      LYS 149   2.715 -22.231  12.699
 1239    H    GLU 150           H        GLU 150   0.490 -19.420  15.109
 1240    HA   GLU 150           HA       GLU 150   2.996 -20.539  15.099
 1241    HB2  GLU 150           HB2      GLU 150   1.827 -18.891  13.498
 1242    HB3  GLU 150           HB3      GLU 150   2.237 -17.622  14.630
 1243    HG2  GLU 150           HG2      GLU 150   3.991 -17.529  13.199
 1244    HG3  GLU 150           HG3      GLU 150   4.697 -18.629  14.362
 1245    H    PHE 151           H        PHE 151   1.547 -18.181  17.286
 1246    HA   PHE 151           HA       PHE 151   4.145 -17.763  18.698
 1247    HB2  PHE 151           HB2      PHE 151   1.630 -16.081  18.852
 1248    HB3  PHE 151           HB3      PHE 151   3.253 -15.692  19.385
 1249    HD1  PHE 151           HD1      PHE 151   4.883 -16.463  16.865
 1250    HD2  PHE 151           HD2      PHE 151   1.223 -14.205  17.426
 1251    HE1  PHE 151           HE1      PHE 151   5.090 -15.536  14.659
 1252    HE2  PHE 151           HE2      PHE 151   1.599 -13.099  15.272
 1253    HZ   PHE 151           HZ       PHE 151   3.534 -13.780  13.848
 1254    H    ALA 152           H        ALA 152   1.071 -19.305  19.092
 1255    HA   ALA 152           HA       ALA 152   0.356 -18.870  21.705
 1256    HB1  ALA 152           HB1      ALA 152   0.209 -21.450  20.049
 1257    HB2  ALA 152           HB2      ALA 152  -0.715 -21.147  21.534
 1258    HB3  ALA 152           HB3      ALA 152  -1.008 -20.160  20.091
 1259    H    SER 153           H        SER 153   2.779 -21.127  20.482
 1260    HA   SER 153           HA       SER 153   3.225 -22.538  22.910
 1261    HB2  SER 153           HB2      SER 153   5.159 -22.138  20.595
 1262    HB3  SER 153           HB3      SER 153   5.114 -23.498  21.740
 1263    HG   SER 153           HG       SER 153   4.090 -24.058  19.767
 1264    H    VAL 154           H        VAL 154   4.513 -19.484  21.645
 1265    HA   VAL 154           HA       VAL 154   6.691 -19.293  23.574
 1266    HB   VAL 154           HB       VAL 154   5.256 -17.088  22.033
 1267   HG11  VAL 154          HG11      VAL 154   7.991 -17.063  23.383
 1268   HG12  VAL 154          HG12      VAL 154   7.257 -15.753  22.433
 1269   HG13  VAL 154          HG13      VAL 154   6.543 -16.221  23.981
 1270   HG21  VAL 154          HG21      VAL 154   7.738 -18.719  21.329
 1271   HG22  VAL 154          HG22      VAL 154   6.218 -18.622  20.410
 1272   HG23  VAL 154          HG23      VAL 154   7.277 -17.220  20.513
 1273    H    VAL 155           H        VAL 155   3.272 -18.181  23.380
 1274    HA   VAL 155           HA       VAL 155   3.429 -16.568  25.669
 1275    HB   VAL 155           HB       VAL 155   0.953 -18.074  24.767
 1276   HG11  VAL 155          HG11      VAL 155   0.548 -17.083  26.901
 1277   HG12  VAL 155          HG12      VAL 155   1.561 -15.669  26.560
 1278   HG13  VAL 155          HG13      VAL 155  -0.029 -15.817  25.791
 1279   HG21  VAL 155          HG21      VAL 155   1.825 -16.796  22.837
 1280   HG22  VAL 155          HG22      VAL 155   0.305 -16.144  23.441
 1281   HG23  VAL 155          HG23      VAL 155   1.848 -15.325  23.837
 1282    H    MET 156           H        MET 156   2.717 -20.117  25.421
 1283    HA   MET 156           HA       MET 156   1.731 -20.482  27.942
 1284    HB2  MET 156           HB2      MET 156   3.744 -22.299  26.469
 1285    HB3  MET 156           HB3      MET 156   2.652 -22.837  27.756
 1286    HG2  MET 156           HG2      MET 156   1.863 -21.887  24.990
 1287    HG3  MET 156           HG3      MET 156   1.777 -23.527  25.595
 1288    HE1  MET 156           HE1      MET 156  -1.875 -21.703  24.929
 1289    HE2  MET 156           HE2      MET 156  -0.413 -20.797  24.486
 1290    HE3  MET 156           HE3      MET 156  -0.549 -22.522  24.072
 1291    H    SER 157           H        SER 157   5.109 -20.612  26.914
 1292    HA   SER 157           HA       SER 157   6.165 -21.040  29.552
 1293    HB2  SER 157           HB2      SER 157   7.234 -20.580  26.762
 1294    HB3  SER 157           HB3      SER 157   8.334 -20.823  28.156
 1295    HG   SER 157           HG       SER 157   7.862 -22.794  27.059
 1296    H    LEU 158           H        LEU 158   5.519 -18.233  27.532
 1297    HA   LEU 158           HA       LEU 158   7.111 -16.310  28.883
 1298    HB2  LEU 158           HB2      LEU 158   5.892 -16.084  26.642
 1299    HB3  LEU 158           HB3      LEU 158   4.376 -16.021  27.550
 1300    HG   LEU 158           HG       LEU 158   5.303 -13.951  28.725
 1301   HD11  LEU 158          HD11      LEU 158   7.661 -14.268  28.019
 1302   HD12  LEU 158          HD12      LEU 158   7.180 -14.090  26.325
 1303   HD13  LEU 158          HD13      LEU 158   7.017 -12.716  27.457
 1304   HD21  LEU 158          HD21      LEU 158   4.618 -12.640  26.605
 1305   HD22  LEU 158          HD22      LEU 158   4.541 -14.200  25.795
 1306   HD23  LEU 158          HD23      LEU 158   3.486 -13.899  27.212
 1307    H    GLN 159           H        GLN 159   3.785 -17.519  29.439
 1308    HA   GLN 159           HA       GLN 159   3.118 -15.878  31.656
 1309    HB2  GLN 159           HB2      GLN 159   2.356 -18.822  31.440
 1310    HB3  GLN 159           HB3      GLN 159   1.550 -17.563  32.356
 1311    HG2  GLN 159           HG2      GLN 159   0.963 -16.460  30.103
 1312    HG3  GLN 159           HG3      GLN 159   1.542 -17.955  29.362
 1313   HE21  GLN 159          HE22      GLN 159  -0.688 -17.085  32.072
 1314   HE22  GLN 159          HE21      GLN 159  -1.853 -18.355  31.698
 1315    H    GLU 160           H        GLU 160   4.854 -18.992  31.570
 1316    HA   GLU 160           HA       GLU 160   4.976 -19.310  34.367
 1317    HB2  GLU 160           HB2      GLU 160   6.591 -20.596  32.124
 1318    HB3  GLU 160           HB3      GLU 160   6.662 -21.106  33.817
 1319    HG2  GLU 160           HG2      GLU 160   4.177 -21.470  33.773
 1320    HG3  GLU 160           HG3      GLU 160   4.204 -21.152  32.041
 1321    H    ASN 161           H        ASN 161   7.125 -17.642  32.116
 1322    HA   ASN 161           HA       ASN 161   9.324 -17.579  34.100
 1323    HB2  ASN 161           HB2      ASN 161   9.093 -16.709  31.189
 1324    HB3  ASN 161           HB3      ASN 161  10.424 -16.214  32.230
 1325   HD21  ASN 161          HD22      ASN 161   8.767 -19.170  30.983
 1326   HD22  ASN 161          HD21      ASN 161  10.183 -20.195  31.133
 1327    H    THR 162           H        THR 162   6.751 -15.591  32.690
 1328    HA   THR 162           HA       THR 162   6.344 -13.387  32.662
 1329    HB   THR 162           HB       THR 162   5.161 -14.155  34.559
 1330    HG1  THR 162           HG1      THR 162   4.896 -12.188  35.635
 1331   HG21  THR 162          HG21      THR 162   6.782 -15.113  36.028
 1332   HG22  THR 162          HG22      THR 162   7.548 -13.537  36.319
 1333   HG23  THR 162          HG23      THR 162   5.897 -13.857  36.898
 1334    HA   PRO 163           HA       PRO 163  10.831 -12.832  32.900
 1335    HB2  PRO 163           HB2      PRO 163  11.622 -12.633  30.315
 1336    HB3  PRO 163           HB3      PRO 163  11.099 -14.151  31.078
 1337    HG2  PRO 163           HG2      PRO 163   9.410 -12.264  29.400
 1338    HG3  PRO 163           HG3      PRO 163   9.592 -14.047  29.241
 1339    HD2  PRO 163           HD2      PRO 163   7.543 -12.815  30.650
 1340    HD3  PRO 163           HD3      PRO 163   8.172 -14.442  31.030
 1341    H    LYS 164           H        LYS 164   9.605 -10.745  33.813
 1342    HA   LYS 164           HA       LYS 164   9.624  -8.522  34.182
 1343    HB2  LYS 164           HB2      LYS 164  12.423  -8.619  33.021
 1344    HB3  LYS 164           HB3      LYS 164  11.830  -7.621  34.347
 1345    HG2  LYS 164           HG2      LYS 164  12.279 -10.640  34.368
 1346    HG3  LYS 164           HG3      LYS 164  13.295  -9.423  35.124
 1347    HD2  LYS 164           HD2      LYS 164  11.536  -8.823  36.710
 1348    HD3  LYS 164           HD3      LYS 164  10.393  -9.947  35.938
 1349    HE2  LYS 164           HE2      LYS 164  11.868 -11.853  36.455
 1350    HE3  LYS 164           HE3      LYS 164  13.047 -10.762  37.192
 1351    HZ1  LYS 164           HZ1      LYS 164  11.655 -11.812  38.858
 1352    HZ2  LYS 164           HZ2      LYS 164  11.392 -10.202  38.879
 1353    HZ3  LYS 164           HZ3      LYS 164  10.290 -11.208  38.204
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1  -0.462  -0.590   0.185
    2    H2   MET   1           H2       MET   1  -0.065   0.991  -0.057
    3    H3   MET   1           H3       MET   1  -1.194   0.271  -0.996
    4    HA   MET   1           HA       MET   1   0.801   0.494  -2.250
    5    HB2  MET   1           HB2      MET   1   2.916  -0.323  -1.607
    6    HB3  MET   1           HB3      MET   1   2.309   0.466  -0.174
    7    HG2  MET   1           HG2      MET   1   3.328  -1.455   0.616
    8    HG3  MET   1           HG3      MET   1   1.619  -1.839   0.687
    9    HE1  MET   1           HE1      MET   1   5.137  -2.746  -0.720
   10    HE2  MET   1           HE2      MET   1   4.765  -3.801  -2.105
   11    HE3  MET   1           HE3      MET   1   4.439  -2.061  -2.214
   12    H    ILE   2           H        ILE   2   1.590  -1.195  -3.767
   13    HA   ILE   2           HA       ILE   2   0.546  -3.936  -3.459
   14    HB   ILE   2           HB       ILE   2   0.097  -2.133  -5.842
   15   HG12  ILE   2          HG12      ILE   2  -1.599  -3.025  -3.740
   16   HG13  ILE   2          HG13      ILE   2  -1.998  -2.052  -5.160
   17   HG21  ILE   2          HG21      ILE   2   1.094  -4.162  -6.754
   18   HG22  ILE   2          HG22      ILE   2  -0.074  -5.163  -5.841
   19   HG23  ILE   2          HG23      ILE   2  -0.617  -4.085  -7.151
   20   HD11  ILE   2          HD11      ILE   2  -2.252  -5.054  -4.839
   21   HD12  ILE   2          HD12      ILE   2  -3.553  -3.850  -4.864
   22   HD13  ILE   2          HD13      ILE   2  -2.672  -4.148  -6.343
   23    H    ASP   3           H        ASP   3   2.137  -5.397  -4.232
   24    HA   ASP   3           HA       ASP   3   4.811  -4.506  -4.408
   25    HB2  ASP   3           HB2      ASP   3   4.251  -6.772  -3.693
   26    HB3  ASP   3           HB3      ASP   3   3.585  -7.118  -5.300
   27    H    ASP   4           H        ASP   4   2.998  -6.197  -6.964
   28    HA   ASP   4           HA       ASP   4   3.362  -4.125  -8.890
   29    HB2  ASP   4           HB2      ASP   4   5.620  -5.050  -9.047
   30    HB3  ASP   4           HB3      ASP   4   4.961  -6.678  -9.183
   31    H    ASP   5           H        ASP   5   2.891  -7.638  -8.572
   32    HA   ASP   5           HA       ASP   5   1.156  -7.697 -10.875
   33    HB2  ASP   5           HB2      ASP   5   3.013  -9.314 -10.487
   34    HB3  ASP   5           HB3      ASP   5   2.070 -10.020  -9.170
   35    H    GLY   6           H        GLY   6   0.276  -6.570  -8.206
   36    HA2  GLY   6           HA2      GLY   6  -1.943  -6.176  -7.550
   37    HA3  GLY   6           HA3      GLY   6  -2.453  -7.697  -8.279
   38    H    TYR   7           H        TYR   7   0.270  -8.391  -6.421
   39    HA   TYR   7           HA       TYR   7  -1.366  -9.116  -4.056
   40    HB2  TYR   7           HB2      TYR   7   1.501  -9.918  -4.635
   41    HB3  TYR   7           HB3      TYR   7   0.449 -10.523  -3.360
   42    HD1  TYR   7           HD1      TYR   7  -1.519 -11.978  -3.930
   43    HD2  TYR   7           HD2      TYR   7   1.419 -10.837  -6.874
   44    HE1  TYR   7           HE1      TYR   7  -2.336 -13.768  -5.429
   45    HE2  TYR   7           HE2      TYR   7   0.614 -12.623  -8.379
   46    HH   TYR   7           HH       TYR   7  -2.088 -14.845  -7.522
   47    H    ARG   8           H        ARG   8  -0.593  -8.399  -1.908
   48    HA   ARG   8           HA       ARG   8   1.488  -6.273  -1.986
   49    HB2  ARG   8           HB2      ARG   8   0.207  -4.745  -0.641
   50    HB3  ARG   8           HB3      ARG   8  -0.547  -5.030  -2.207
   51    HG2  ARG   8           HG2      ARG   8  -1.608  -6.590   0.132
   52    HG3  ARG   8           HG3      ARG   8  -1.946  -4.872   0.020
   53    HD2  ARG   8           HD2      ARG   8  -2.847  -5.158  -2.268
   54    HD3  ARG   8           HD3      ARG   8  -2.540  -6.884  -2.188
   55    HE   ARG   8           HE       ARG   8  -4.297  -7.240  -0.745
   56   HH11  ARG   8          HH21      ARG   8  -3.933  -3.688  -1.083
   57   HH12  ARG   8          HH22      ARG   8  -5.375  -3.351  -0.198
   58   HH21  ARG   8          HH11      ARG   8  -6.075  -6.772   0.502
   59   HH22  ARG   8          HH12      ARG   8  -6.655  -5.138   0.703
   60    HA   PRO   9           HA       PRO   9   2.627  -8.879   1.478
   61    HB2  PRO   9           HB2      PRO   9   4.818  -6.849   1.817
   62    HB3  PRO   9           HB3      PRO   9   4.945  -8.636   1.772
   63    HG2  PRO   9           HG2      PRO   9   5.690  -7.166  -0.348
   64    HG3  PRO   9           HG3      PRO   9   4.668  -8.622  -0.623
   65    HD2  PRO   9           HD2      PRO   9   3.782  -5.728  -0.359
   66    HD3  PRO   9           HD3      PRO   9   3.406  -6.896  -1.660
   67    H    ASN  10           H        ASN  10   2.202  -8.845   3.726
   68    HA   ASN  10           HA       ASN  10   1.598  -6.219   5.002
   69    HB2  ASN  10           HB2      ASN  10  -0.442  -7.054   3.884
   70    HB3  ASN  10           HB3      ASN  10  -0.218  -8.629   4.616
   71   HD21  ASN  10          HD22      ASN  10  -1.545  -5.404   5.092
   72   HD22  ASN  10          HD21      ASN  10  -2.224  -5.752   6.664
   73    H    VAL  11           H        VAL  11   1.435  -6.416   7.378
   74    HA   VAL  11           HA       VAL  11   2.366  -8.972   8.456
   75    HB   VAL  11           HB       VAL  11   4.022  -7.974   9.945
   76   HG11  VAL  11          HG11      VAL  11   4.795  -8.927   7.916
   77   HG12  VAL  11          HG12      VAL  11   4.595  -7.386   7.097
   78   HG13  VAL  11          HG13      VAL  11   5.786  -7.529   8.402
   79   HG21  VAL  11          HG21      VAL  11   3.191  -5.680  10.162
   80   HG22  VAL  11          HG22      VAL  11   4.868  -5.734   9.615
   81   HG23  VAL  11          HG23      VAL  11   3.580  -5.364   8.446
   82    H    GLY  12           H        GLY  12   1.752  -9.278  10.636
   83    HA2  GLY  12           HA2      GLY  12  -0.458  -7.483  11.539
   84    HA3  GLY  12           HA3      GLY  12  -0.661  -9.213  11.396
   85    H    ILE  13           H        ILE  13  -0.926  -7.647  13.794
   86    HA   ILE  13           HA       ILE  13   1.453  -8.418  15.430
   87    HB   ILE  13           HB       ILE  13  -0.349  -5.984  15.298
   88   HG12  ILE  13          HG12      ILE  13   2.532  -5.498  15.640
   89   HG13  ILE  13          HG13      ILE  13   2.228  -6.513  14.228
   90   HG21  ILE  13          HG21      ILE  13   0.727  -5.096  17.309
   91   HG22  ILE  13          HG22      ILE  13  -0.232  -6.510  17.666
   92   HG23  ILE  13          HG23      ILE  13   1.534  -6.682  17.563
   93   HD11  ILE  13          HD11      ILE  13   0.620  -4.863  13.347
   94   HD12  ILE  13          HD12      ILE  13   0.919  -3.821  14.759
   95   HD13  ILE  13          HD13      ILE  13   2.230  -4.153  13.603
   96    H    VAL  14           H        VAL  14   1.100  -9.420  17.307
   97    HA   VAL  14           HA       VAL  14  -1.640  -9.489  18.461
   98    HB   VAL  14           HB       VAL  14   0.347 -11.790  18.666
   99   HG11  VAL  14          HG11      VAL  14  -1.401 -11.636  20.431
  100   HG12  VAL  14          HG12      VAL  14  -2.664 -11.608  19.179
  101   HG13  VAL  14          HG13      VAL  14  -1.650 -13.051  19.414
  102   HG21  VAL  14          HG21      VAL  14  -1.022 -13.047  17.043
  103   HG22  VAL  14          HG22      VAL  14  -1.925 -11.557  16.657
  104   HG23  VAL  14          HG23      VAL  14  -0.183 -11.684  16.296
  105    H    ILE  15           H        ILE  15  -1.574  -8.961  20.693
  106    HA   ILE  15           HA       ILE  15   1.101  -8.880  21.937
  107    HB   ILE  15           HB       ILE  15  -1.039  -6.901  22.786
  108   HG12  ILE  15          HG12      ILE  15  -0.359  -6.300  20.444
  109   HG13  ILE  15          HG13      ILE  15   0.023  -5.097  21.667
  110   HG21  ILE  15          HG21      ILE  15   0.890  -5.809  23.867
  111   HG22  ILE  15          HG22      ILE  15   0.569  -7.439  24.491
  112   HG23  ILE  15          HG23      ILE  15   1.927  -7.158  23.379
  113   HD11  ILE  15          HD11      ILE  15   1.851  -5.469  19.989
  114   HD12  ILE  15          HD12      ILE  15   2.366  -5.697  21.676
  115   HD13  ILE  15          HD13      ILE  15   2.050  -7.114  20.641
  116    H    CYS  16           H        CYS  16   1.129 -10.138  23.792
  117    HA   CYS  16           HA       CYS  16  -1.552 -10.921  24.871
  118    HB2  CYS  16           HB2      CYS  16   0.907 -12.705  24.731
  119    HB3  CYS  16           HB3      CYS  16  -0.644 -13.118  25.492
  120    HG   CYS  16           HG       CYS  16  -0.255 -14.245  23.017
  121    H    ASN  17           H        ASN  17  -1.825 -10.881  27.033
  122    HA   ASN  17           HA       ASN  17   0.376  -9.743  28.683
  123    HB2  ASN  17           HB2      ASN  17  -1.270  -8.949  30.191
  124    HB3  ASN  17           HB3      ASN  17  -1.799  -8.512  28.576
  125   HD21  ASN  17          HD22      ASN  17  -3.811  -8.227  30.145
  126   HD22  ASN  17          HD21      ASN  17  -4.866  -9.617  30.222
  127    H    ARG  18           H        ARG  18   0.145 -10.801  31.124
  128    HA   ARG  18           HA       ARG  18   0.806 -13.619  30.597
  129    HB2  ARG  18           HB2      ARG  18   0.768 -12.117  33.264
  130    HB3  ARG  18           HB3      ARG  18   1.386 -13.747  32.968
  131    HG2  ARG  18           HG2      ARG  18   3.317 -12.630  32.852
  132    HG3  ARG  18           HG3      ARG  18   2.862 -12.612  31.145
  133    HD2  ARG  18           HD2      ARG  18   2.237 -10.273  31.303
  134    HD3  ARG  18           HD3      ARG  18   2.334 -10.325  33.085
  135    HE   ARG  18           HE       ARG  18   4.848 -11.010  31.789
  136   HH11  ARG  18          HH11      ARG  18   2.867  -8.163  32.637
  137   HH12  ARG  18          HH12      ARG  18   4.232  -7.133  32.858
  138   HH21  ARG  18          HH21      ARG  18   6.650  -9.681  32.308
  139   HH22  ARG  18          HH22      ARG  18   6.414  -7.990  32.588
  140    H    GLN  19           H        GLN  19  -2.095 -12.144  31.045
  141    HA   GLN  19           HA       GLN  19  -3.403 -14.345  32.470
  142    HB2  GLN  19           HB2      GLN  19  -4.827 -12.083  31.070
  143    HB3  GLN  19           HB3      GLN  19  -5.410 -13.093  32.382
  144    HG2  GLN  19           HG2      GLN  19  -3.301 -10.912  32.516
  145    HG3  GLN  19           HG3      GLN  19  -4.936 -10.828  33.134
  146   HE21  GLN  19          HE22      GLN  19  -2.662 -10.293  34.791
  147   HE22  GLN  19          HE21      GLN  19  -2.565 -11.540  36.010
  148    H    GLY  20           H        GLY  20  -2.207 -13.907  29.328
  149    HA2  GLY  20           HA2      GLY  20  -2.539 -15.130  27.426
  150    HA3  GLY  20           HA3      GLY  20  -3.759 -16.114  28.253
  151    H    GLN  21           H        GLN  21  -4.090 -12.566  28.283
  152    HA   GLN  21           HA       GLN  21  -6.397 -12.830  26.425
  153    HB2  GLN  21           HB2      GLN  21  -5.574 -10.462  28.137
  154    HB3  GLN  21           HB3      GLN  21  -6.998 -10.581  27.112
  155    HG2  GLN  21           HG2      GLN  21  -6.486 -12.329  29.559
  156    HG3  GLN  21           HG3      GLN  21  -7.486 -10.887  29.537
  157   HE21  GLN  21          HE22      GLN  21  -7.403 -14.326  28.823
  158   HE22  GLN  21          HE21      GLN  21  -9.017 -14.424  28.141
  159    H    VAL  22           H        VAL  22  -6.331 -11.760  24.468
  160    HA   VAL  22           HA       VAL  22  -3.702 -10.753  23.623
  161    HB   VAL  22           HB       VAL  22  -4.085 -11.509  21.471
  162   HG11  VAL  22          HG11      VAL  22  -3.526 -13.188  23.367
  163   HG12  VAL  22          HG12      VAL  22  -5.164 -13.789  23.167
  164   HG13  VAL  22          HG13      VAL  22  -4.020 -13.843  21.787
  165   HG21  VAL  22          HG21      VAL  22  -6.927 -12.365  22.195
  166   HG22  VAL  22          HG22      VAL  22  -6.473 -11.028  21.108
  167   HG23  VAL  22          HG23      VAL  22  -6.067 -12.694  20.675
  168    H    MET  23           H        MET  23  -3.538  -8.818  22.616
  169    HA   MET  23           HA       MET  23  -5.475  -6.730  22.927
  170    HB2  MET  23           HB2      MET  23  -3.267  -6.019  22.728
  171    HB3  MET  23           HB3      MET  23  -2.888  -7.188  21.464
  172    HG2  MET  23           HG2      MET  23  -2.760  -4.954  20.588
  173    HG3  MET  23           HG3      MET  23  -3.972  -5.914  19.768
  174    HE1  MET  23           HE1      MET  23  -4.115  -3.749  23.169
  175    HE2  MET  23           HE2      MET  23  -3.154  -2.866  21.955
  176    HE3  MET  23           HE3      MET  23  -4.748  -2.252  22.443
  177    H    TRP  24           H        TRP  24  -7.205  -6.169  21.673
  178    HA   TRP  24           HA       TRP  24  -7.264  -6.948  18.827
  179    HB2  TRP  24           HB2      TRP  24  -8.486  -8.602  20.340
  180    HB3  TRP  24           HB3      TRP  24  -9.575  -7.314  20.779
  181    HD1  TRP  24           HD1      TRP  24  -8.600  -7.752  17.077
  182    HE1  TRP  24           HE1      TRP  24 -10.528  -8.853  15.808
  183    HE3  TRP  24           HE3      TRP  24 -11.649  -8.824  21.024
  184    HZ2  TRP  24           HZ2      TRP  24 -12.993 -10.205  16.448
  185    HZ3  TRP  24           HZ3      TRP  24 -13.745 -10.087  20.687
  186    HH2  TRP  24           HH2      TRP  24 -14.423 -10.798  18.417
  187    H    ALA  25           H        ALA  25  -7.650  -4.903  17.738
  188    HA   ALA  25           HA       ALA  25  -9.342  -2.910  19.005
  189    HB1  ALA  25           HB1      ALA  25  -7.283  -2.488  20.243
  190    HB2  ALA  25           HB2      ALA  25  -6.326  -2.434  18.761
  191    HB3  ALA  25           HB3      ALA  25  -7.552  -1.174  19.112
  192    H    ARG  26           H        ARG  26  -9.810  -1.105  17.539
  193    HA   ARG  26           HA       ARG  26  -9.201  -1.589  14.701
  194    HB2  ARG  26           HB2      ARG  26 -11.899  -2.067  16.047
  195    HB3  ARG  26           HB3      ARG  26 -11.874  -1.539  14.380
  196    HG2  ARG  26           HG2      ARG  26 -10.640  -4.108  15.430
  197    HG3  ARG  26           HG3      ARG  26 -12.128  -3.871  14.539
  198    HD2  ARG  26           HD2      ARG  26 -10.701  -4.546  12.808
  199    HD3  ARG  26           HD3      ARG  26 -10.599  -2.797  12.676
  200    HE   ARG  26           HE       ARG  26  -8.645  -4.185  14.441
  201   HH11  ARG  26          HH21      ARG  26  -8.945  -2.942  11.100
  202   HH12  ARG  26          HH22      ARG  26  -7.326  -2.340  11.077
  203   HH21  ARG  26          HH11      ARG  26  -6.676  -3.221  14.457
  204   HH22  ARG  26          HH12      ARG  26  -5.901  -2.615  13.017
  205    H    ARG  27           H        ARG  27 -10.393  -0.152  13.216
  206    HA   ARG  27           HA       ARG  27  -9.332   2.370  13.772
  207    HB2  ARG  27           HB2      ARG  27  -9.230   1.295  11.650
  208    HB3  ARG  27           HB3      ARG  27 -10.977   1.253  11.503
  209    HG2  ARG  27           HG2      ARG  27 -11.068   3.658  11.142
  210    HG3  ARG  27           HG3      ARG  27  -9.422   3.889  11.727
  211    HD2  ARG  27           HD2      ARG  27  -9.995   2.235   9.253
  212    HD3  ARG  27           HD3      ARG  27  -9.820   4.000   9.186
  213    HE   ARG  27           HE       ARG  27  -7.601   3.260  10.611
  214   HH11  ARG  27          HH11      ARG  27  -8.757   2.358   7.346
  215   HH12  ARG  27          HH12      ARG  27  -7.150   2.148   6.739
  216   HH21  ARG  27          HH21      ARG  27  -5.671   3.007   9.890
  217   HH22  ARG  27          HH22      ARG  27  -5.274   2.519   8.247
  218    H    PHE  28           H        PHE  28 -10.132   4.361  13.808
  219    HA   PHE  28           HA       PHE  28 -12.236   4.998  15.477
  220    HB2  PHE  28           HB2      PHE  28 -10.283   6.364  14.931
  221    HB3  PHE  28           HB3      PHE  28 -10.843   6.590  13.291
  222    HD1  PHE  28           HD1      PHE  28 -12.084   7.116  16.841
  223    HD2  PHE  28           HD2      PHE  28 -11.755   8.684  12.829
  224    HE1  PHE  28           HE1      PHE  28 -13.112   9.247  17.580
  225    HE2  PHE  28           HE2      PHE  28 -12.734  10.824  13.590
  226    HZ   PHE  28           HZ       PHE  28 -13.439  11.107  15.961
  227    H    GLY  29           H        GLY  29 -14.407   5.014  15.227
  228    HA2  GLY  29           HA2      GLY  29 -16.472   5.221  14.313
  229    HA3  GLY  29           HA3      GLY  29 -15.737   5.827  12.824
  230    H    GLN  30           H        GLN  30 -14.481   2.685  13.696
  231    HA   GLN  30           HA       GLN  30 -16.287   1.444  11.662
  232    HB2  GLN  30           HB2      GLN  30 -13.537   0.416  12.367
  233    HB3  GLN  30           HB3      GLN  30 -14.547   0.019  10.984
  234    HG2  GLN  30           HG2      GLN  30 -13.019   2.564  11.526
  235    HG3  GLN  30           HG3      GLN  30 -12.732   1.383  10.249
  236   HE21  GLN  30          HE22      GLN  30 -13.832   4.471  10.668
  237   HE22  GLN  30          HE21      GLN  30 -14.948   4.564   9.315
  238    H    HIS  31           H        HIS  31 -16.794  -0.783  11.944
  239    HA   HIS  31           HA       HIS  31 -16.843  -1.686  14.786
  240    HB2  HIS  31           HB2      HIS  31 -19.222  -1.696  12.905
  241    HB3  HIS  31           HB3      HIS  31 -19.208  -2.112  14.616
  242    HD1  HIS  31           HD1      HIS  31 -20.216   0.674  12.518
  243    HD2  HIS  31           HD2      HIS  31 -18.176   0.238  16.183
  244    HE1  HIS  31           HE1      HIS  31 -20.374   2.924  13.703
  245    H    SER  32           H        SER  32 -15.358  -2.619  12.154
  246    HA   SER  32           HA       SER  32 -16.406  -5.435  12.181
  247    HB2  SER  32           HB2      SER  32 -14.737  -4.085  10.036
  248    HB3  SER  32           HB3      SER  32 -15.394  -5.737  10.023
  249    HG   SER  32           HG       SER  32 -16.708  -4.228   8.826
  250    H    TRP  33           H        TRP  33 -15.032  -6.979  13.090
  251    HA   TRP  33           HA       TRP  33 -12.676  -5.802  14.349
  252    HB2  TRP  33           HB2      TRP  33 -14.328  -8.223  14.970
  253    HB3  TRP  33           HB3      TRP  33 -12.799  -7.845  15.748
  254    HD1  TRP  33           HD1      TRP  33 -16.380  -6.569  15.548
  255    HE1  TRP  33           HE1      TRP  33 -16.808  -4.909  17.439
  256    HE3  TRP  33           HE3      TRP  33 -11.597  -6.121  17.351
  257    HZ2  TRP  33           HZ2      TRP  33 -15.285  -3.547  19.481
  258    HZ3  TRP  33           HZ3      TRP  33 -11.133  -4.671  19.301
  259    HH2  TRP  33           HH2      TRP  33 -12.979  -3.403  20.393
  260    H    GLN  34           H        GLN  34 -10.627  -6.473  14.293
  261    HA   GLN  34           HA       GLN  34  -9.687  -8.770  12.819
  262    HB2  GLN  34           HB2      GLN  34  -9.275  -5.928  11.741
  263    HB3  GLN  34           HB3      GLN  34  -8.113  -7.210  11.463
  264    HG2  GLN  34           HG2      GLN  34 -10.135  -8.580  10.527
  265    HG3  GLN  34           HG3      GLN  34 -10.939  -7.008  10.417
  266   HE21  GLN  34          HE22      GLN  34 -10.413  -5.694   8.586
  267   HE22  GLN  34          HE21      GLN  34  -9.106  -6.068   7.492
  268    H    PHE  35           H        PHE  35  -7.318  -8.967  13.200
  269    HA   PHE  35           HA       PHE  35  -6.431  -7.804  15.737
  270    HB2  PHE  35           HB2      PHE  35  -5.093  -9.547  13.662
  271    HB3  PHE  35           HB3      PHE  35  -4.298  -9.016  15.148
  272    HD1  PHE  35           HD2      PHE  35  -5.934  -9.491  17.343
  273    HD2  PHE  35           HD1      PHE  35  -5.556 -11.865  13.724
  274    HE1  PHE  35           HE2      PHE  35  -6.660 -11.494  18.580
  275    HE2  PHE  35           HE1      PHE  35  -6.319 -13.847  14.987
  276    HZ   PHE  35           HZ       PHE  35  -6.910 -13.675  17.387
  277    HA   PRO  36           HA       PRO  36  -4.511  -4.210  13.975
  278    HB2  PRO  36           HB2      PRO  36  -2.144  -4.705  15.764
  279    HB3  PRO  36           HB3      PRO  36  -3.086  -3.203  15.539
  280    HG2  PRO  36           HG2      PRO  36  -3.482  -4.739  17.728
  281    HG3  PRO  36           HG3      PRO  36  -4.896  -4.059  16.860
  282    HD2  PRO  36           HD2      PRO  36  -3.727  -6.855  16.629
  283    HD3  PRO  36           HD3      PRO  36  -5.428  -6.352  16.849
  284    H    GLN  37           H        GLN  37  -3.067  -3.620  12.277
  285    HA   GLN  37           HA       GLN  37  -0.951  -5.459  11.435
  286    HB2  GLN  37           HB2      GLN  37  -2.153  -6.260   9.412
  287    HB3  GLN  37           HB3      GLN  37  -2.991  -6.755  10.875
  288    HG2  GLN  37           HG2      GLN  37  -4.535  -4.719  10.568
  289    HG3  GLN  37           HG3      GLN  37  -3.751  -4.460   9.008
  290   HE21  GLN  37          HE22      GLN  37  -5.694  -6.798  10.939
  291   HE22  GLN  37          HE21      GLN  37  -6.471  -7.513   9.520
  292    H    GLY  38           H        GLY  38  -0.249  -4.901   9.064
  293    HA2  GLY  38           HA2      GLY  38  -1.217  -2.531   7.830
  294    HA3  GLY  38           HA3      GLY  38   0.260  -2.155   8.704
  295    H    GLY  39           H        GLY  39   0.391  -1.783   6.021
  296    HA2  GLY  39           HA2      GLY  39   1.238  -4.151   4.558
  297    HA3  GLY  39           HA3      GLY  39   1.132  -2.490   3.973
  298    H    ILE  40           H        ILE  40   3.295  -4.468   3.886
  299    HA   ILE  40           HA       ILE  40   5.549  -3.226   5.347
  300    HB   ILE  40           HB       ILE  40   5.596  -5.225   3.058
  301   HG12  ILE  40          HG12      ILE  40   5.616  -5.825   6.048
  302   HG13  ILE  40          HG13      ILE  40   4.262  -6.134   4.969
  303   HG21  ILE  40          HG21      ILE  40   7.706  -4.785   5.202
  304   HG22  ILE  40          HG22      ILE  40   7.829  -5.814   3.769
  305   HG23  ILE  40          HG23      ILE  40   7.772  -4.068   3.576
  306   HD11  ILE  40          HD11      ILE  40   5.167  -8.207   5.040
  307   HD12  ILE  40          HD12      ILE  40   5.960  -7.569   3.604
  308   HD13  ILE  40          HD13      ILE  40   6.849  -7.625   5.148
  309    H    ASN  41           H        ASN  41   6.607  -1.436   4.542
  310    HA   ASN  41           HA       ASN  41   5.688  -0.221   2.051
  311    HB2  ASN  41           HB2      ASN  41   7.953   0.472   3.981
  312    HB3  ASN  41           HB3      ASN  41   7.642   1.371   2.508
  313   HD21  ASN  41          HD22      ASN  41   6.201   0.398   5.626
  314   HD22  ASN  41          HD21      ASN  41   4.945   1.645   5.638
  315    HA   PRO  42           HA       PRO  42   8.518  -2.319  -0.672
  316    HB2  PRO  42           HB2      PRO  42   9.410  -0.317  -2.378
  317    HB3  PRO  42           HB3      PRO  42   7.819  -1.130  -2.500
  318    HG2  PRO  42           HG2      PRO  42   8.462   1.516  -1.172
  319    HG3  PRO  42           HG3      PRO  42   7.121   1.132  -2.296
  320    HD2  PRO  42           HD2      PRO  42   6.739   1.189   0.386
  321    HD3  PRO  42           HD3      PRO  42   5.942  -0.063  -0.612
  322    H    GLY  43           H        GLY  43  10.518  -2.968  -0.003
  323    HA2  GLY  43           HA2      GLY  43  12.794  -2.802   0.419
  324    HA3  GLY  43           HA3      GLY  43  12.664  -1.051   0.606
  325    H    GLU  44           H        GLU  44  10.193  -2.070   2.612
  326    HA   GLU  44           HA       GLU  44  11.801  -2.018   5.011
  327    HB2  GLU  44           HB2      GLU  44   8.997  -1.760   4.339
  328    HB3  GLU  44           HB3      GLU  44   9.169  -3.077   5.508
  329    HG2  GLU  44           HG2      GLU  44  10.312  -1.649   7.056
  330    HG3  GLU  44           HG3      GLU  44  10.322  -0.321   5.867
  331    H    SER  45           H        SER  45  11.770  -3.780   6.609
  332    HA   SER  45           HA       SER  45  11.591  -6.506   5.436
  333    HB2  SER  45           HB2      SER  45  12.950  -7.099   7.521
  334    HB3  SER  45           HB3      SER  45  13.780  -6.214   6.224
  335    HG   SER  45           HG       SER  45  14.296  -5.262   8.181
  336    H    ALA  46           H        ALA  46  10.444  -8.067   6.844
  337    HA   ALA  46           HA       ALA  46   7.899  -7.058   7.380
  338    HB1  ALA  46           HB1      ALA  46   9.182  -9.632   8.414
  339    HB2  ALA  46           HB2      ALA  46   7.433  -9.329   8.246
  340    HB3  ALA  46           HB3      ALA  46   8.454  -9.404   6.798
  341    H    GLU  47           H        GLU  47  10.540  -7.716   9.667
  342    HA   GLU  47           HA       GLU  47   9.002  -7.310  12.055
  343    HB2  GLU  47           HB2      GLU  47  11.032  -8.635  11.840
  344    HB3  GLU  47           HB3      GLU  47  11.980  -7.188  11.436
  345    HG2  GLU  47           HG2      GLU  47  11.393  -6.251  13.691
  346    HG3  GLU  47           HG3      GLU  47  10.579  -7.773  14.066
  347    H    GLN  48           H        GLN  48  10.826  -5.109   9.861
  348    HA   GLN  48           HA       GLN  48  10.638  -2.887  11.694
  349    HB2  GLN  48           HB2      GLN  48  11.244  -2.930   8.741
  350    HB3  GLN  48           HB3      GLN  48  11.326  -1.486   9.769
  351    HG2  GLN  48           HG2      GLN  48  12.851  -4.065  10.212
  352    HG3  GLN  48           HG3      GLN  48  13.548  -2.613   9.485
  353   HE21  GLN  48          HE22      GLN  48  14.549  -4.052  11.713
  354   HE22  GLN  48          HE21      GLN  48  14.507  -3.010  13.123
  355    H    ALA  49           H        ALA  49   8.664  -4.171   8.979
  356    HA   ALA  49           HA       ALA  49   6.804  -1.998   8.871
  357    HB1  ALA  49           HB1      ALA  49   6.450  -4.969   8.217
  358    HB2  ALA  49           HB2      ALA  49   5.381  -3.647   7.717
  359    HB3  ALA  49           HB3      ALA  49   7.059  -3.697   7.111
  360    H    MET  50           H        MET  50   7.043  -5.007  10.833
  361    HA   MET  50           HA       MET  50   4.539  -4.736  12.144
  362    HB2  MET  50           HB2      MET  50   5.656  -6.806  12.244
  363    HB3  MET  50           HB3      MET  50   7.139  -6.124  12.891
  364    HG2  MET  50           HG2      MET  50   4.515  -6.055  14.399
  365    HG3  MET  50           HG3      MET  50   5.642  -7.396  14.491
  366    HE1  MET  50           HE1      MET  50   8.621  -5.867  14.681
  367    HE2  MET  50           HE2      MET  50   8.679  -6.108  16.434
  368    HE3  MET  50           HE3      MET  50   7.996  -7.376  15.394
  369    H    TYR  51           H        TYR  51   7.848  -3.565  13.186
  370    HA   TYR  51           HA       TYR  51   6.767  -2.399  15.510
  371    HB2  TYR  51           HB2      TYR  51   9.278  -1.695  13.919
  372    HB3  TYR  51           HB3      TYR  51   8.856  -0.926  15.441
  373    HD1  TYR  51           HD2      TYR  51   8.177  -2.667  17.411
  374    HD2  TYR  51           HD1      TYR  51  10.892  -3.409  14.140
  375    HE1  TYR  51           HE2      TYR  51   9.510  -4.173  18.850
  376    HE2  TYR  51           HE1      TYR  51  12.212  -4.928  15.569
  377    HH   TYR  51           HH       TYR  51  12.495  -5.815  17.735
  378    H    ARG  52           H        ARG  52   7.223  -0.897  12.159
  379    HA   ARG  52           HA       ARG  52   6.521   1.737  13.016
  380    HB2  ARG  52           HB2      ARG  52   7.720   1.213  10.929
  381    HB3  ARG  52           HB3      ARG  52   6.336   0.275  10.353
  382    HG2  ARG  52           HG2      ARG  52   4.962   2.450  10.462
  383    HG3  ARG  52           HG3      ARG  52   6.492   3.301  10.735
  384    HD2  ARG  52           HD2      ARG  52   5.957   1.369   8.455
  385    HD3  ARG  52           HD3      ARG  52   5.676   3.116   8.292
  386    HE   ARG  52           HE       ARG  52   8.161   1.605   8.279
  387   HH11  ARG  52          HH11      ARG  52   6.856   4.905   8.690
  388   HH12  ARG  52          HH12      ARG  52   8.351   5.691   8.333
  389   HH21  ARG  52          HH21      ARG  52  10.139   2.649   7.841
  390   HH22  ARG  52          HH22      ARG  52  10.269   4.374   7.827
  391    H    GLU  53           H        GLU  53   4.576  -0.965  11.549
  392    HA   GLU  53           HA       GLU  53   2.261   0.684  11.494
  393    HB2  GLU  53           HB2      GLU  53   2.527  -2.302  11.139
  394    HB3  GLU  53           HB3      GLU  53   1.041  -1.380  10.882
  395    HG2  GLU  53           HG2      GLU  53   3.665  -0.751   9.476
  396    HG3  GLU  53           HG3      GLU  53   2.414  -1.762   8.773
  397    H    LEU  54           H        LEU  54   3.604  -1.554  13.929
  398    HA   LEU  54           HA       LEU  54   1.399  -1.644  15.705
  399    HB2  LEU  54           HB2      LEU  54   3.484  -2.948  16.035
  400    HB3  LEU  54           HB3      LEU  54   4.396  -1.447  16.235
  401    HG   LEU  54           HG       LEU  54   2.896  -0.977  18.282
  402   HD11  LEU  54          HD11      LEU  54   1.821  -2.923  19.296
  403   HD12  LEU  54          HD12      LEU  54   1.204  -2.772  17.649
  404   HD13  LEU  54          HD13      LEU  54   2.465  -3.976  18.009
  405   HD21  LEU  54          HD21      LEU  54   4.826  -3.333  18.300
  406   HD22  LEU  54          HD22      LEU  54   5.258  -1.614  18.455
  407   HD23  LEU  54          HD23      LEU  54   4.296  -2.394  19.718
  408    H    PHE  55           H        PHE  55   4.032   0.853  15.325
  409    HA   PHE  55           HA       PHE  55   2.988   2.510  17.389
  410    HB2  PHE  55           HB2      PHE  55   5.275   2.739  16.434
  411    HB3  PHE  55           HB3      PHE  55   4.576   3.374  14.946
  412    HD1  PHE  55           HD1      PHE  55   5.135   4.036  18.555
  413    HD2  PHE  55           HD2      PHE  55   3.643   5.648  14.840
  414    HE1  PHE  55           HE1      PHE  55   5.041   6.298  19.572
  415    HE2  PHE  55           HE2      PHE  55   3.554   7.908  15.864
  416    HZ   PHE  55           HZ       PHE  55   4.245   8.236  18.233
  417    H    GLU  56           H        GLU  56   2.217   2.359  13.847
  418    HA   GLU  56           HA       GLU  56   0.565   4.618  13.921
  419    HB2  GLU  56           HB2      GLU  56   0.661   2.240  12.062
  420    HB3  GLU  56           HB3      GLU  56  -0.510   3.545  11.849
  421    HG2  GLU  56           HG2      GLU  56   2.488   4.018  12.058
  422    HG3  GLU  56           HG3      GLU  56   1.645   3.779  10.525
  423    H    GLU  57           H        GLU  57  -0.207   1.185  14.634
  424    HA   GLU  57           HA       GLU  57  -3.071   1.559  14.607
  425    HB2  GLU  57           HB2      GLU  57  -1.226  -0.676  15.543
  426    HB3  GLU  57           HB3      GLU  57  -2.965  -0.801  15.593
  427    HG2  GLU  57           HG2      GLU  57  -1.415  -0.413  13.002
  428    HG3  GLU  57           HG3      GLU  57  -1.745  -1.979  13.726
  429    H    VAL  58           H        VAL  58  -0.599   0.978  17.170
  430    HA   VAL  58           HA       VAL  58  -2.603   1.690  19.269
  431    HB   VAL  58           HB       VAL  58  -1.294  -0.105  20.614
  432   HG11  VAL  58          HG11      VAL  58  -3.618  -0.439  19.720
  433   HG12  VAL  58          HG12      VAL  58  -2.900  -1.053  18.207
  434   HG13  VAL  58          HG13      VAL  58  -2.661  -1.927  19.732
  435   HG21  VAL  58          HG21      VAL  58  -0.400  -1.050  17.895
  436   HG22  VAL  58          HG22      VAL  58   0.629  -0.230  19.087
  437   HG23  VAL  58          HG23      VAL  58  -0.127  -1.782  19.504
  438    H    GLY  59           H        GLY  59   0.029   3.039  17.903
  439    HA2  GLY  59           HA2      GLY  59   1.218   4.863  18.621
  440    HA3  GLY  59           HA3      GLY  59   0.264   4.822  20.104
  441    H    LEU  60           H        LEU  60   1.819   1.857  19.639
  442    HA   LEU  60           HA       LEU  60   3.657   2.361  21.838
  443    HB2  LEU  60           HB2      LEU  60   1.913   0.666  21.863
  444    HB3  LEU  60           HB3      LEU  60   2.566  -0.031  20.364
  445    HG   LEU  60           HG       LEU  60   4.587  -0.798  21.575
  446   HD11  LEU  60          HD11      LEU  60   3.170   0.338  24.008
  447   HD12  LEU  60          HD12      LEU  60   4.576  -0.755  24.013
  448   HD13  LEU  60          HD13      LEU  60   4.727   0.878  23.349
  449   HD21  LEU  60          HD21      LEU  60   2.411  -2.092  21.288
  450   HD22  LEU  60          HD22      LEU  60   3.250  -2.535  22.795
  451   HD23  LEU  60          HD23      LEU  60   1.840  -1.448  22.820
  452    H    SER  61           H        SER  61   5.823   1.973  21.731
  453    HA   SER  61           HA       SER  61   7.046   1.718  19.025
  454    HB2  SER  61           HB2      SER  61   8.849   3.177  20.069
  455    HB3  SER  61           HB3      SER  61   7.278   3.947  19.835
  456    HG   SER  61           HG       SER  61   8.072   4.403  21.925
  457    H    ARG  62           H        ARG  62   9.308   0.902  19.096
  458    HA   ARG  62           HA       ARG  62   9.555  -1.722  19.872
  459    HB2  ARG  62           HB2      ARG  62  11.922   0.187  19.748
  460    HB3  ARG  62           HB3      ARG  62  11.905  -1.557  19.498
  461    HG2  ARG  62           HG2      ARG  62  10.273  -0.982  17.510
  462    HG3  ARG  62           HG3      ARG  62  10.954   0.641  17.654
  463    HD2  ARG  62           HD2      ARG  62  13.274  -0.464  17.549
  464    HD3  ARG  62           HD3      ARG  62  12.440  -1.975  17.191
  465    HE   ARG  62           HE       ARG  62  12.083  -1.310  15.039
  466   HH11  ARG  62          HH11      ARG  62  13.055   1.606  16.862
  467   HH12  ARG  62          HH12      ARG  62  13.293   2.565  15.452
  468   HH21  ARG  62          HH21      ARG  62  12.549  -0.061  13.171
  469   HH22  ARG  62          HH22      ARG  62  12.935   1.621  13.312
  470    H    LYS  63           H        LYS  63  10.292   1.164  21.798
  471    HA   LYS  63           HA       LYS  63  12.027  -0.059  23.681
  472    HB2  LYS  63           HB2      LYS  63  12.298   1.999  24.505
  473    HB3  LYS  63           HB3      LYS  63  11.687   2.410  22.927
  474    HG2  LYS  63           HG2      LYS  63  10.362   3.785  24.237
  475    HG3  LYS  63           HG3      LYS  63   9.321   2.364  24.097
  476    HD2  LYS  63           HD2      LYS  63   9.312   2.504  26.418
  477    HD3  LYS  63           HD3      LYS  63  10.855   1.620  26.231
  478    HE2  LYS  63           HE2      LYS  63  12.093   3.774  26.268
  479    HE3  LYS  63           HE3      LYS  63  10.573   4.657  26.448
  480    HZ1  LYS  63           HZ1      LYS  63  10.246   3.568  28.593
  481    HZ2  LYS  63           HZ2      LYS  63  11.653   2.731  28.434
  482    HZ3  LYS  63           HZ3      LYS  63  11.675   4.353  28.571
  483    H    ASP  64           H        ASP  64   8.445  -0.083  23.529
  484    HA   ASP  64           HA       ASP  64   8.588  -1.367  26.225
  485    HB2  ASP  64           HB2      ASP  64   7.431   0.893  26.053
  486    HB3  ASP  64           HB3      ASP  64   6.138   0.041  25.237
  487    H    VAL  65           H        VAL  65   8.991  -2.616  23.539
  488    HA   VAL  65           HA       VAL  65   7.112  -4.838  24.086
  489    HB   VAL  65           HB       VAL  65   6.930  -5.269  21.624
  490   HG11  VAL  65          HG11      VAL  65   5.651  -2.685  22.565
  491   HG12  VAL  65          HG12      VAL  65   5.034  -3.820  21.334
  492   HG13  VAL  65          HG13      VAL  65   5.107  -4.299  23.037
  493   HG21  VAL  65          HG21      VAL  65   7.264  -3.513  20.005
  494   HG22  VAL  65          HG22      VAL  65   7.749  -2.376  21.279
  495   HG23  VAL  65          HG23      VAL  65   8.792  -3.750  20.895
  496    H    ARG  66           H        ARG  66   7.820  -6.884  23.139
  497    HA   ARG  66           HA       ARG  66  10.661  -7.104  22.362
  498    HB2  ARG  66           HB2      ARG  66  11.127  -8.897  23.905
  499    HB3  ARG  66           HB3      ARG  66  10.561  -7.511  24.828
  500    HG2  ARG  66           HG2      ARG  66   8.182  -8.964  24.401
  501    HG3  ARG  66           HG3      ARG  66   9.380 -10.228  24.538
  502    HD2  ARG  66           HD2      ARG  66   8.831  -7.954  26.483
  503    HD3  ARG  66           HD3      ARG  66   8.295  -9.638  26.672
  504    HE   ARG  66           HE       ARG  66  11.084  -9.732  26.422
  505   HH11  ARG  66          HH21      ARG  66   8.746  -8.358  28.757
  506   HH12  ARG  66          HH22      ARG  66   9.864  -8.440  30.088
  507   HH21  ARG  66          HH11      ARG  66  12.480  -9.935  28.280
  508   HH22  ARG  66          HH12      ARG  66  11.876  -9.487  29.854
  509    H    ILE  67           H        ILE  67  10.871  -8.945  20.831
  510    HA   ILE  67           HA       ILE  67   8.262  -9.904  19.817
  511    HB   ILE  67           HB       ILE  67  11.081 -10.375  18.772
  512   HG12  ILE  67          HG12      ILE  67   8.982  -8.649  17.417
  513   HG13  ILE  67          HG13      ILE  67  10.116  -7.956  18.580
  514   HG21  ILE  67          HG21      ILE  67   9.556 -12.211  18.155
  515   HG22  ILE  67          HG22      ILE  67   8.347 -11.052  17.563
  516   HG23  ILE  67          HG23      ILE  67   9.901 -11.250  16.731
  517   HD11  ILE  67          HD11      ILE  67  10.841  -9.355  15.987
  518   HD12  ILE  67          HD12      ILE  67  10.973  -7.634  16.368
  519   HD13  ILE  67          HD13      ILE  67  12.011  -8.795  17.218
  520    H    LEU  68           H        LEU  68   7.438 -11.631  20.662
  521    HA   LEU  68           HA       LEU  68   9.170 -13.536  22.197
  522    HB2  LEU  68           HB2      LEU  68   6.157 -13.317  21.872
  523    HB3  LEU  68           HB3      LEU  68   6.995 -14.499  22.857
  524    HG   LEU  68           HG       LEU  68   6.991 -11.498  23.419
  525   HD11  LEU  68          HD11      LEU  68   5.678 -12.508  25.425
  526   HD12  LEU  68          HD12      LEU  68   4.849 -12.235  23.872
  527   HD13  LEU  68          HD13      LEU  68   5.375 -13.877  24.363
  528   HD21  LEU  68          HD21      LEU  68   8.010 -12.171  25.564
  529   HD22  LEU  68          HD22      LEU  68   8.128 -13.853  24.996
  530   HD23  LEU  68          HD23      LEU  68   9.072 -12.568  24.202
  531    H    ALA  69           H        ALA  69   7.161 -13.212  19.287
  532    HA   ALA  69           HA       ALA  69   8.005 -15.795  18.225
  533    HB1  ALA  69           HB1      ALA  69   6.068 -16.289  19.927
  534    HB2  ALA  69           HB2      ALA  69   5.031 -15.583  18.672
  535    HB3  ALA  69           HB3      ALA  69   6.021 -16.992  18.299
  536    H    SER  70           H        SER  70   7.108 -16.156  16.168
  537    HA   SER  70           HA       SER  70   5.544 -14.256  14.803
  538    HB2  SER  70           HB2      SER  70   7.310 -13.599  13.064
  539    HB3  SER  70           HB3      SER  70   7.412 -12.815  14.642
  540    HG   SER  70           HG       SER  70   9.480 -13.542  13.927
  541    H    THR  71           H        THR  71   5.062 -14.976  12.531
  542    HA   THR  71           HA       THR  71   4.892 -17.878  12.509
  543    HB   THR  71           HB       THR  71   3.959 -17.268  10.136
  544    HG1  THR  71           HG1      THR  71   4.579 -15.203   9.923
  545   HG21  THR  71          HG21      THR  71   2.697 -16.919  12.806
  546   HG22  THR  71          HG22      THR  71   1.831 -16.289  11.372
  547   HG23  THR  71          HG23      THR  71   2.344 -17.991  11.425
  548    H    ARG  72           H        ARG  72   5.941 -19.356  11.361
  549    HA   ARG  72           HA       ARG  72   8.504 -18.641  10.150
  550    HB2  ARG  72           HB2      ARG  72   7.027 -21.313  10.190
  551    HB3  ARG  72           HB3      ARG  72   8.685 -21.047   9.680
  552    HG2  ARG  72           HG2      ARG  72   9.360 -21.425  11.745
  553    HG3  ARG  72           HG3      ARG  72   8.618 -19.920  12.266
  554    HD2  ARG  72           HD2      ARG  72   6.870 -22.382  12.071
  555    HD3  ARG  72           HD3      ARG  72   8.058 -22.333  13.358
  556    HE   ARG  72           HE       ARG  72   5.579 -20.814  13.158
  557   HH11  ARG  72          HH11      ARG  72   8.742 -20.931  14.817
  558   HH12  ARG  72          HH12      ARG  72   8.129 -20.210  16.262
  559   HH21  ARG  72          HH21      ARG  72   4.847 -19.839  14.883
  560   HH22  ARG  72          HH22      ARG  72   5.773 -19.630  16.363
  561    H    ASN  73           H        ASN  73   5.487 -20.070   8.970
  562    HA   ASN  73           HA       ASN  73   6.185 -19.511   6.179
  563    HB2  ASN  73           HB2      ASN  73   4.485 -20.977   5.513
  564    HB3  ASN  73           HB3      ASN  73   5.234 -21.775   6.884
  565   HD21  ASN  73          HD22      ASN  73   3.954 -21.897   8.946
  566   HD22  ASN  73          HD21      ASN  73   2.259 -21.501   8.947
  567    H    TRP  74           H        TRP  74   4.672 -18.267   4.803
  568    HA   TRP  74           HA       TRP  74   3.493 -16.031   6.319
  569    HB2  TRP  74           HB2      TRP  74   3.892 -16.553   3.341
  570    HB3  TRP  74           HB3      TRP  74   3.074 -15.141   3.990
  571    HD1  TRP  74           HD1      TRP  74   6.603 -16.724   3.964
  572    HE1  TRP  74           HE1      TRP  74   8.337 -14.868   4.290
  573    HE3  TRP  74           HE3      TRP  74   3.451 -12.781   4.688
  574    HZ2  TRP  74           HZ2      TRP  74   8.356 -12.082   5.002
  575    HZ3  TRP  74           HZ3      TRP  74   4.341 -10.518   5.194
  576    HH2  TRP  74           HH2      TRP  74   6.779 -10.195   5.501
  577    H    LEU  75           H        LEU  75   1.396 -15.571   6.545
  578    HA   LEU  75           HA       LEU  75  -0.523 -17.725   5.818
  579    HB2  LEU  75           HB2      LEU  75  -1.023 -15.283   7.559
  580    HB3  LEU  75           HB3      LEU  75  -2.028 -16.711   7.362
  581    HG   LEU  75           HG       LEU  75   0.583 -16.421   8.869
  582   HD11  LEU  75          HD11      LEU  75  -2.163 -17.494   9.689
  583   HD12  LEU  75          HD12      LEU  75  -0.745 -17.286  10.745
  584   HD13  LEU  75          HD13      LEU  75  -1.522 -15.875  10.021
  585   HD21  LEU  75          HD21      LEU  75  -0.717 -19.054   8.081
  586   HD22  LEU  75          HD22      LEU  75   0.937 -18.478   7.714
  587   HD23  LEU  75          HD23      LEU  75   0.491 -18.864   9.373
  588    H    ARG  76           H        ARG  76  -0.874 -17.415   3.606
  589    HA   ARG  76           HA       ARG  76  -1.571 -14.713   2.640
  590    HB2  ARG  76           HB2      ARG  76   0.148 -16.071   1.506
  591    HB3  ARG  76           HB3      ARG  76  -1.003 -17.398   1.309
  592    HG2  ARG  76           HG2      ARG  76  -2.350 -15.936  -0.253
  593    HG3  ARG  76           HG3      ARG  76  -1.116 -14.676  -0.051
  594    HD2  ARG  76           HD2      ARG  76  -0.549 -15.841  -2.043
  595    HD3  ARG  76           HD3      ARG  76   0.594 -16.384  -0.775
  596    HE   ARG  76           HE       ARG  76  -1.664 -18.141  -0.892
  597   HH11  ARG  76          HH11      ARG  76   1.267 -17.356  -2.749
  598   HH12  ARG  76          HH12      ARG  76   1.457 -18.946  -3.390
  599   HH21  ARG  76          HH21      ARG  76  -1.401 -20.270  -1.736
  600   HH22  ARG  76          HH22      ARG  76  -0.107 -20.628  -2.820
  601    H    TYR  77           H        TYR  77  -3.480 -14.294   1.510
  602    HA   TYR  77           HA       TYR  77  -5.428 -16.419   1.150
  603    HB2  TYR  77           HB2      TYR  77  -7.315 -15.384   2.128
  604    HB3  TYR  77           HB3      TYR  77  -6.110 -15.698   3.368
  605    HD1  TYR  77           HD2      TYR  77  -4.669 -13.729   4.194
  606    HD2  TYR  77           HD1      TYR  77  -8.214 -13.227   1.775
  607    HE1  TYR  77           HE2      TYR  77  -4.825 -11.385   4.904
  608    HE2  TYR  77           HE1      TYR  77  -8.378 -10.885   2.484
  609    HH   TYR  77           HH       TYR  77  -7.450  -9.167   3.817
  610    H    LYS  78           H        LYS  78  -6.825 -15.984  -0.573
  611    HA   LYS  78           HA       LYS  78  -6.201 -13.557  -2.188
  612    HB2  LYS  78           HB2      LYS  78  -7.460 -16.242  -2.796
  613    HB3  LYS  78           HB3      LYS  78  -7.981 -14.833  -3.710
  614    HG2  LYS  78           HG2      LYS  78  -6.288 -16.007  -4.915
  615    HG3  LYS  78           HG3      LYS  78  -5.754 -14.378  -4.507
  616    HD2  LYS  78           HD2      LYS  78  -4.167 -15.110  -2.951
  617    HD3  LYS  78           HD3      LYS  78  -4.917 -16.701  -2.732
  618    HE2  LYS  78           HE2      LYS  78  -3.570 -15.781  -5.321
  619    HE3  LYS  78           HE3      LYS  78  -2.735 -16.663  -4.036
  620    HZ1  LYS  78           HZ1      LYS  78  -5.037 -17.719  -5.602
  621    HZ2  LYS  78           HZ2      LYS  78  -3.482 -18.178  -5.740
  622    HZ3  LYS  78           HZ3      LYS  78  -4.306 -18.513  -4.367
  623    H    LEU  79           H        LEU  79  -7.817 -12.070  -2.600
  624    HA   LEU  79           HA       LEU  79 -10.061 -11.778  -0.736
  625    HB2  LEU  79           HB2      LEU  79  -9.214 -10.459  -3.346
  626    HB3  LEU  79           HB3      LEU  79 -10.707 -10.022  -2.544
  627    HG   LEU  79           HG       LEU  79  -8.308  -9.945  -0.780
  628   HD11  LEU  79          HD11      LEU  79  -7.515  -7.788  -1.711
  629   HD12  LEU  79          HD12      LEU  79  -7.317  -9.139  -2.846
  630   HD13  LEU  79          HD13      LEU  79  -8.645  -7.975  -3.078
  631   HD21  LEU  79          HD21      LEU  79 -10.541  -7.954  -1.385
  632   HD22  LEU  79          HD22      LEU  79 -10.582  -9.174  -0.090
  633   HD23  LEU  79          HD23      LEU  79  -9.395  -7.857  -0.025
  634    HA   PRO  80           HA       PRO  80 -12.899 -14.153  -3.465
  635    HB2  PRO  80           HB2      PRO  80 -15.292 -13.305  -2.380
  636    HB3  PRO  80           HB3      PRO  80 -14.248 -14.521  -1.578
  637    HG2  PRO  80           HG2      PRO  80 -14.362 -11.555  -1.086
  638    HG3  PRO  80           HG3      PRO  80 -14.466 -12.871   0.131
  639    HD2  PRO  80           HD2      PRO  80 -12.117 -11.606  -0.356
  640    HD3  PRO  80           HD3      PRO  80 -12.150 -13.375  -0.110
  641    H    LYS  81           H        LYS  81 -14.116 -13.315  -5.418
  642    HA   LYS  81           HA       LYS  81 -12.948 -10.820  -6.089
  643    HB2  LYS  81           HB2      LYS  81 -14.936 -12.288  -7.774
  644    HB3  LYS  81           HB3      LYS  81 -13.800 -10.969  -8.232
  645    HG2  LYS  81           HG2      LYS  81 -11.894 -12.323  -7.990
  646    HG3  LYS  81           HG3      LYS  81 -12.788 -13.619  -7.196
  647    HD2  LYS  81           HD2      LYS  81 -12.251 -14.176  -9.527
  648    HD3  LYS  81           HD3      LYS  81 -13.989 -14.168  -9.207
  649    HE2  LYS  81           HE2      LYS  81 -14.191 -11.944 -10.307
  650    HE3  LYS  81           HE3      LYS  81 -12.448 -11.938 -10.618
  651    HZ1  LYS  81           HZ1      LYS  81 -13.691 -12.674 -12.550
  652    HZ2  LYS  81           HZ2      LYS  81 -12.750 -13.901 -12.021
  653    HZ3  LYS  81           HZ3      LYS  81 -14.365 -13.911 -11.729
  654    H    ARG  82           H        ARG  82 -15.991 -11.350  -4.568
  655    HA   ARG  82           HA       ARG  82 -17.175  -8.904  -5.358
  656    HB2  ARG  82           HB2      ARG  82 -18.518  -9.022  -3.326
  657    HB3  ARG  82           HB3      ARG  82 -18.461 -10.568  -4.191
  658    HG2  ARG  82           HG2      ARG  82 -16.631 -11.235  -2.469
  659    HG3  ARG  82           HG3      ARG  82 -17.141  -9.809  -1.559
  660    HD2  ARG  82           HD2      ARG  82 -18.943 -12.087  -2.455
  661    HD3  ARG  82           HD3      ARG  82 -18.236 -11.946  -0.832
  662    HE   ARG  82           HE       ARG  82 -19.569  -9.542  -1.215
  663   HH11  ARG  82          HH21      ARG  82 -20.523 -12.967  -1.140
  664   HH12  ARG  82          HH22      ARG  82 -22.135 -12.651  -0.616
  665   HH21  ARG  82          HH11      ARG  82 -21.731  -9.122  -0.522
  666   HH22  ARG  82          HH12      ARG  82 -22.828 -10.424  -0.239
  667    H    LEU  83           H        LEU  83 -14.570  -9.518  -3.091
  668    HA   LEU  83           HA       LEU  83 -14.626  -6.754  -2.110
  669    HB2  LEU  83           HB2      LEU  83 -12.774  -9.054  -1.434
  670    HB3  LEU  83           HB3      LEU  83 -12.833  -7.494  -0.614
  671    HG   LEU  83           HG       LEU  83 -15.021  -9.602  -0.637
  672   HD11  LEU  83          HD11      LEU  83 -14.516  -9.924   1.694
  673   HD12  LEU  83          HD12      LEU  83 -13.018 -10.086   0.769
  674   HD13  LEU  83          HD13      LEU  83 -13.329  -8.590   1.673
  675   HD21  LEU  83          HD21      LEU  83 -16.201  -8.192   1.036
  676   HD22  LEU  83          HD22      LEU  83 -15.083  -6.864   0.645
  677   HD23  LEU  83          HD23      LEU  83 -16.183  -7.527  -0.598
  678    H    VAL  84           H        VAL  84 -12.974  -8.695  -4.482
  679    HA   VAL  84           HA       VAL  84 -10.582  -7.158  -4.792
  680    HB   VAL  84           HB       VAL  84 -12.258  -8.719  -6.815
  681   HG11  VAL  84          HG11      VAL  84  -9.481  -7.573  -7.091
  682   HG12  VAL  84          HG12      VAL  84 -10.107  -8.864  -8.130
  683   HG13  VAL  84          HG13      VAL  84 -10.888  -7.275  -8.127
  684   HG21  VAL  84          HG21      VAL  84 -10.802 -10.551  -6.582
  685   HG22  VAL  84          HG22      VAL  84  -9.645  -9.628  -5.574
  686   HG23  VAL  84          HG23      VAL  84 -11.234 -10.097  -4.931
  687    H    ARG  85           H        ARG  85 -10.236  -5.178  -5.739
  688    HA   ARG  85           HA       ARG  85 -12.539  -3.825  -6.993
  689    HB2  ARG  85           HB2      ARG  85 -10.414  -3.011  -5.151
  690    HB3  ARG  85           HB3      ARG  85 -10.438  -1.959  -6.576
  691    HG2  ARG  85           HG2      ARG  85 -12.891  -2.676  -4.985
  692    HG3  ARG  85           HG3      ARG  85 -11.917  -1.200  -4.724
  693    HD2  ARG  85           HD2      ARG  85 -12.290  -0.687  -7.212
  694    HD3  ARG  85           HD3      ARG  85 -13.521  -1.937  -7.235
  695    HE   ARG  85           HE       ARG  85 -13.583   0.723  -5.994
  696   HH11  ARG  85          HH21      ARG  85 -15.265  -2.433  -6.015
  697   HH12  ARG  85          HH22      ARG  85 -16.745  -1.784  -5.418
  698   HH21  ARG  85          HH11      ARG  85 -15.555   1.552  -5.207
  699   HH22  ARG  85          HH12      ARG  85 -16.912   0.515  -4.944
  700    H    TRP  86           H        TRP  86 -12.504  -4.827  -8.884
  701    HA   TRP  86           HA       TRP  86 -10.294  -4.860 -10.692
  702    HB2  TRP  86           HB2      TRP  86 -13.304  -4.978 -11.076
  703    HB3  TRP  86           HB3      TRP  86 -12.141  -5.273 -12.377
  704    HD1  TRP  86           HD1      TRP  86 -14.029  -7.082  -9.802
  705    HE1  TRP  86           HE1      TRP  86 -13.167  -9.441  -9.423
  706    HE3  TRP  86           HE3      TRP  86  -9.627  -6.739 -12.393
  707    HZ2  TRP  86           HZ2      TRP  86 -10.725 -10.936  -9.941
  708    HZ3  TRP  86           HZ3      TRP  86  -8.051  -8.661 -12.440
  709    HH2  TRP  86           HH2      TRP  86  -8.583 -10.751 -11.208
  710    H    ASP  87           H        ASP  87 -12.555  -2.348  -9.740
  711    HA   ASP  87           HA       ASP  87 -12.527  -0.864 -12.186
  712    HB2  ASP  87           HB2      ASP  87 -14.374  -0.876 -10.533
  713    HB3  ASP  87           HB3      ASP  87 -13.344  -0.028  -9.384
  714    H    THR  88           H        THR  88 -10.044  -1.164  -9.894
  715    HA   THR  88           HA       THR  88  -8.870   1.406 -10.730
  716    HB   THR  88           HB       THR  88  -9.902   1.463  -8.378
  717    HG1  THR  88           HG1      THR  88  -8.315   2.856  -7.769
  718   HG21  THR  88          HG21      THR  88  -8.914  -0.783  -7.682
  719   HG22  THR  88          HG22      THR  88  -7.339   0.023  -7.597
  720   HG23  THR  88          HG23      THR  88  -8.685   0.552  -6.544
  721    H    LYS  89           H        LYS  89  -6.480   1.404 -10.439
  722    HA   LYS  89           HA       LYS  89  -5.336  -1.245 -11.037
  723    HB2  LYS  89           HB2      LYS  89  -4.775   1.336 -12.538
  724    HB3  LYS  89           HB3      LYS  89  -4.047  -0.233 -12.875
  725    HG2  LYS  89           HG2      LYS  89  -7.013   0.437 -13.145
  726    HG3  LYS  89           HG3      LYS  89  -5.837   0.444 -14.460
  727    HD2  LYS  89           HD2      LYS  89  -5.443  -1.986 -14.188
  728    HD3  LYS  89           HD3      LYS  89  -6.550  -2.026 -12.817
  729    HE2  LYS  89           HE2      LYS  89  -7.745  -2.871 -14.690
  730    HE3  LYS  89           HE3      LYS  89  -8.424  -1.295 -14.283
  731    HZ1  LYS  89           HZ1      LYS  89  -7.196  -0.347 -16.164
  732    HZ2  LYS  89           HZ2      LYS  89  -6.498  -1.793 -16.498
  733    HZ3  LYS  89           HZ3      LYS  89  -8.103  -1.597 -16.681
  734    HA   PRO  90           HA       PRO  90  -3.594  -2.341 -10.987
  735    HB2  PRO  90           HB2      PRO  90  -1.997  -3.700  -9.322
  736    HB3  PRO  90           HB3      PRO  90  -1.387  -2.610 -10.609
  737    HG2  PRO  90           HG2      PRO  90  -1.761  -1.956  -7.658
  738    HG3  PRO  90           HG3      PRO  90  -0.289  -1.689  -8.653
  739    HD2  PRO  90           HD2      PRO  90  -2.143   0.270  -8.197
  740    HD3  PRO  90           HD3      PRO  90  -1.287   0.139  -9.764
  741    H    VAL  91           H        VAL  91  -4.889  -4.116 -10.367
  742    HA   VAL  91           HA       VAL  91  -6.666  -3.663  -8.121
  743    HB   VAL  91           HB       VAL  91  -7.695  -4.370 -10.120
  744   HG11  VAL  91          HG11      VAL  91  -7.145  -6.442 -11.379
  745   HG12  VAL  91          HG12      VAL  91  -5.858  -5.250 -11.442
  746   HG13  VAL  91          HG13      VAL  91  -5.708  -6.662 -10.366
  747   HG21  VAL  91          HG21      VAL  91  -8.462  -5.603  -8.041
  748   HG22  VAL  91          HG22      VAL  91  -8.831  -6.414  -9.570
  749   HG23  VAL  91          HG23      VAL  91  -7.482  -6.980  -8.575
  750    H    CYS  92           H        CYS  92  -6.763  -4.675  -6.222
  751    HA   CYS  92           HA       CYS  92  -4.516  -6.346  -5.388
  752    HB2  CYS  92           HB2      CYS  92  -5.819  -6.244  -3.192
  753    HB3  CYS  92           HB3      CYS  92  -5.193  -4.708  -3.816
  754    HG   CYS  92           HG       CYS  92  -7.523  -4.274  -2.707
  755    H    ILE  93           H        ILE  93  -4.603  -8.601  -5.575
  756    HA   ILE  93           HA       ILE  93  -7.332  -9.806  -5.326
  757    HB   ILE  93           HB       ILE  93  -6.975 -11.466  -6.827
  758   HG12  ILE  93          HG12      ILE  93  -4.754 -12.248  -6.426
  759   HG13  ILE  93          HG13      ILE  93  -4.985 -11.952  -8.136
  760   HG21  ILE  93          HG21      ILE  93  -7.578  -9.331  -7.827
  761   HG22  ILE  93          HG22      ILE  93  -5.876  -8.977  -8.183
  762   HG23  ILE  93          HG23      ILE  93  -6.679 -10.351  -8.961
  763   HD11  ILE  93          HD11      ILE  93  -2.787 -11.222  -7.587
  764   HD12  ILE  93          HD12      ILE  93  -3.728  -9.746  -7.827
  765   HD13  ILE  93          HD13      ILE  93  -3.346 -10.316  -6.180
  766    H    GLY  94           H        GLY  94  -4.137  -9.736  -3.915
  767    HA2  GLY  94           HA2      GLY  94  -5.033 -11.631  -1.937
  768    HA3  GLY  94           HA3      GLY  94  -3.743 -12.267  -2.977
  769    H    GLN  95           H        GLN  95  -3.256 -12.018  -0.367
  770    HA   GLN  95           HA       GLN  95  -1.078 -10.101  -0.278
  771    HB2  GLN  95           HB2      GLN  95  -1.821  -9.219   1.981
  772    HB3  GLN  95           HB3      GLN  95  -2.667  -8.593   0.583
  773    HG2  GLN  95           HG2      GLN  95  -3.844 -10.877   2.196
  774    HG3  GLN  95           HG3      GLN  95  -4.024  -9.201   2.709
  775   HE21  GLN  95          HE22      GLN  95  -5.474 -11.635   0.758
  776   HE22  GLN  95          HE21      GLN  95  -6.532 -10.548  -0.121
  777    H    LYS  96           H        LYS  96   0.419 -10.644   1.375
  778    HA   LYS  96           HA       LYS  96   0.036 -13.355   2.570
  779    HB2  LYS  96           HB2      LYS  96   2.494 -13.756   2.164
  780    HB3  LYS  96           HB3      LYS  96   1.430 -13.795   0.781
  781    HG2  LYS  96           HG2      LYS  96   3.109 -12.683  -0.192
  782    HG3  LYS  96           HG3      LYS  96   2.220 -11.305   0.384
  783    HD2  LYS  96           HD2      LYS  96   4.469 -10.822   0.870
  784    HD3  LYS  96           HD3      LYS  96   3.780 -11.276   2.417
  785    HE2  LYS  96           HE2      LYS  96   5.902 -12.325   2.335
  786    HE3  LYS  96           HE3      LYS  96   4.755 -13.627   2.045
  787    HZ1  LYS  96           HZ1      LYS  96   5.286 -13.462  -0.352
  788    HZ2  LYS  96           HZ2      LYS  96   6.329 -12.222  -0.067
  789    HZ3  LYS  96           HZ3      LYS  96   6.642 -13.707   0.521
  790    H    GLN  97           H        GLN  97   0.240 -13.347   4.745
  791    HA   GLN  97           HA       GLN  97   1.119 -10.790   5.970
  792    HB2  GLN  97           HB2      GLN  97  -0.801 -12.845   7.083
  793    HB3  GLN  97           HB3      GLN  97  -0.405 -11.261   7.758
  794    HG2  GLN  97           HG2      GLN  97  -1.370 -10.265   5.599
  795    HG3  GLN  97           HG3      GLN  97  -1.977 -11.877   5.223
  796   HE21  GLN  97          HE22      GLN  97  -2.332  -9.056   7.353
  797   HE22  GLN  97          HE21      GLN  97  -3.831  -9.591   8.092
  798    H    LYS  98           H        LYS  98   2.750 -10.823   7.476
  799    HA   LYS  98           HA       LYS  98   3.533 -13.475   8.650
  800    HB2  LYS  98           HB2      LYS  98   5.303 -12.539   7.286
  801    HB3  LYS  98           HB3      LYS  98   5.226 -10.985   8.157
  802    HG2  LYS  98           HG2      LYS  98   6.189 -11.890  10.067
  803    HG3  LYS  98           HG3      LYS  98   5.867 -13.567   9.602
  804    HD2  LYS  98           HD2      LYS  98   7.725 -11.779   8.027
  805    HD3  LYS  98           HD3      LYS  98   8.311 -12.660   9.428
  806    HE2  LYS  98           HE2      LYS  98   6.852 -14.180   7.228
  807    HE3  LYS  98           HE3      LYS  98   8.498 -13.633   6.937
  808    HZ1  LYS  98           HZ1      LYS  98   8.458 -15.879   7.841
  809    HZ2  LYS  98           HZ2      LYS  98   9.260 -14.884   8.852
  810    HZ3  LYS  98           HZ3      LYS  98   7.744 -15.396   9.230
  811    H    TRP  99           H        TRP  99   3.136 -13.622  10.818
  812    HA   TRP  99           HA       TRP  99   1.988 -11.190  12.102
  813    HB2  TRP  99           HB2      TRP  99   1.414 -14.143  12.425
  814    HB3  TRP  99           HB3      TRP  99   0.814 -12.886  13.513
  815    HD1  TRP  99           HD1      TRP  99   0.369 -14.177   9.950
  816    HE1  TRP  99           HE1      TRP  99  -1.856 -13.279   9.009
  817    HE3  TRP  99           HE3      TRP  99  -0.864 -10.993  13.738
  818    HZ2  TRP  99           HZ2      TRP  99  -3.838 -11.337   9.768
  819    HZ3  TRP  99           HZ3      TRP  99  -2.811  -9.501  13.532
  820    HH2  TRP  99           HH2      TRP  99  -4.331  -9.664  11.544
  821    H    PHE 100           H        PHE 100   2.590 -10.676  14.227
  822    HA   PHE 100           HA       PHE 100   4.989 -12.104  15.305
  823    HB2  PHE 100           HB2      PHE 100   4.425  -9.120  15.083
  824    HB3  PHE 100           HB3      PHE 100   5.765  -9.816  15.980
  825    HD1  PHE 100           HD1      PHE 100   4.370  -9.383  12.506
  826    HD2  PHE 100           HD2      PHE 100   7.830 -10.358  14.916
  827    HE1  PHE 100           HE1      PHE 100   5.813  -9.319  10.496
  828    HE2  PHE 100           HE2      PHE 100   9.250 -10.292  12.903
  829    HZ   PHE 100           HZ       PHE 100   8.249  -9.789  10.687
  830    H    LEU 101           H        LEU 101   4.792 -12.579  17.463
  831    HA   LEU 101           HA       LEU 101   2.572 -11.338  19.024
  832    HB2  LEU 101           HB2      LEU 101   2.514 -13.728  19.290
  833    HB3  LEU 101           HB3      LEU 101   4.275 -13.802  19.486
  834    HG   LEU 101           HG       LEU 101   4.128 -12.687  21.647
  835   HD11  LEU 101          HD11      LEU 101   1.135 -12.664  21.235
  836   HD12  LEU 101          HD12      LEU 101   2.005 -12.273  22.759
  837   HD13  LEU 101          HD13      LEU 101   2.187 -11.239  21.356
  838   HD21  LEU 101          HD21      LEU 101   3.148 -14.464  22.958
  839   HD22  LEU 101          HD22      LEU 101   2.179 -15.020  21.580
  840   HD23  LEU 101          HD23      LEU 101   3.950 -15.189  21.564
  841    H    LEU 102           H        LEU 102   3.235  -9.550  20.136
  842    HA   LEU 102           HA       LEU 102   6.034  -9.568  21.139
  843    HB2  LEU 102           HB2      LEU 102   4.287  -7.096  20.968
  844    HB3  LEU 102           HB3      LEU 102   5.983  -7.212  21.301
  845    HG   LEU 102           HG       LEU 102   5.782  -6.199  19.251
  846   HD11  LEU 102          HD11      LEU 102   6.521  -9.088  18.665
  847   HD12  LEU 102          HD12      LEU 102   6.926  -7.663  17.675
  848   HD13  LEU 102          HD13      LEU 102   7.582  -7.809  19.315
  849   HD21  LEU 102          HD21      LEU 102   4.103  -8.406  18.044
  850   HD22  LEU 102          HD22      LEU 102   3.468  -6.875  18.694
  851   HD23  LEU 102          HD23      LEU 102   4.575  -6.849  17.326
  852    H    GLN 103           H        GLN 103   6.216  -9.218  23.478
  853    HA   GLN 103           HA       GLN 103   3.539  -9.099  24.842
  854    HB2  GLN 103           HB2      GLN 103   4.464 -10.815  25.784
  855    HB3  GLN 103           HB3      GLN 103   6.132 -10.179  25.798
  856    HG2  GLN 103           HG2      GLN 103   5.683  -8.892  27.769
  857    HG3  GLN 103           HG3      GLN 103   3.963  -8.757  27.407
  858   HE21  GLN 103          HE22      GLN 103   2.545 -10.673  27.658
  859   HE22  GLN 103          HE21      GLN 103   2.952 -11.803  28.945
  860    H    LEU 104           H        LEU 104   2.917  -7.171  25.581
  861    HA   LEU 104           HA       LEU 104   4.421  -4.754  25.315
  862    HB2  LEU 104           HB2      LEU 104   1.755  -5.643  26.158
  863    HB3  LEU 104           HB3      LEU 104   2.378  -4.526  27.358
  864    HG   LEU 104           HG       LEU 104   2.359  -3.958  24.371
  865   HD11  LEU 104          HD11      LEU 104   0.397  -2.605  24.708
  866   HD12  LEU 104          HD12      LEU 104   0.047  -4.253  25.234
  867   HD13  LEU 104          HD13      LEU 104   0.367  -2.992  26.447
  868   HD21  LEU 104          HD21      LEU 104   3.963  -2.559  25.334
  869   HD22  LEU 104          HD22      LEU 104   2.518  -1.548  25.359
  870   HD23  LEU 104          HD23      LEU 104   3.073  -2.346  26.848
  871    H    VAL 105           H        VAL 105   5.788  -3.714  26.776
  872    HA   VAL 105           HA       VAL 105   6.878  -5.524  28.769
  873    HB   VAL 105           HB       VAL 105   7.794  -2.867  27.665
  874   HG11  VAL 105          HG11      VAL 105  10.013  -3.340  28.657
  875   HG12  VAL 105          HG12      VAL 105   8.772  -3.061  29.885
  876   HG13  VAL 105          HG13      VAL 105   9.315  -4.721  29.537
  877   HG21  VAL 105          HG21      VAL 105   7.827  -4.995  26.165
  878   HG22  VAL 105          HG22      VAL 105   9.309  -4.049  26.286
  879   HG23  VAL 105          HG23      VAL 105   9.126  -5.563  27.216
  880    H    SER 106           H        SER 106   5.383  -2.259  28.822
  881    HA   SER 106           HA       SER 106   5.402  -2.281  31.788
  882    HB2  SER 106           HB2      SER 106   4.384  -0.262  29.762
  883    HB3  SER 106           HB3      SER 106   4.383  -0.040  31.519
  884    HG   SER 106           HG       SER 106   6.563  -0.207  29.724
  885    H    GLY 107           H        GLY 107   3.270  -3.060  29.144
  886    HA2  GLY 107           HA2      GLY 107   1.360  -4.541  29.577
  887    HA3  GLY 107           HA3      GLY 107   1.045  -3.639  31.058
  888    H    ASP 108           H        ASP 108  -1.109  -3.542  29.949
  889    HA   ASP 108           HA       ASP 108  -1.623  -2.324  27.559
  890    HB2  ASP 108           HB2      ASP 108  -3.858  -2.470  28.144
  891    HB3  ASP 108           HB3      ASP 108  -3.108  -3.722  29.113
  892    H    ALA 109           H        ALA 109  -0.882  -0.801  30.557
  893    HA   ALA 109           HA       ALA 109  -1.900   1.780  30.303
  894    HB1  ALA 109           HB1      ALA 109   0.034   2.472  31.697
  895    HB2  ALA 109           HB2      ALA 109  -0.662   0.948  32.285
  896    HB3  ALA 109           HB3      ALA 109   0.847   0.941  31.334
  897    H    GLU 110           H        GLU 110   0.767   0.348  28.453
  898    HA   GLU 110           HA       GLU 110   1.544   2.978  27.511
  899    HB2  GLU 110           HB2      GLU 110   2.918   0.312  27.569
  900    HB3  GLU 110           HB3      GLU 110   3.493   1.511  26.409
  901    HG2  GLU 110           HG2      GLU 110   3.204   2.016  29.388
  902    HG3  GLU 110           HG3      GLU 110   4.711   1.568  28.579
  903    H    ILE 111           H        ILE 111  -0.860   1.615  26.627
  904    HA   ILE 111           HA       ILE 111  -0.475   1.554  23.669
  905    HB   ILE 111           HB       ILE 111  -2.986   1.021  25.310
  906   HG12  ILE 111          HG12      ILE 111  -1.421  -1.031  23.690
  907   HG13  ILE 111          HG13      ILE 111  -1.053  -0.758  25.396
  908   HG21  ILE 111          HG21      ILE 111  -3.867   0.154  23.110
  909   HG22  ILE 111          HG22      ILE 111  -3.540   1.879  23.077
  910   HG23  ILE 111          HG23      ILE 111  -2.394   0.741  22.325
  911   HD11  ILE 111          HD11      ILE 111  -3.830  -1.557  24.431
  912   HD12  ILE 111          HD12      ILE 111  -2.600  -2.669  25.043
  913   HD13  ILE 111          HD13      ILE 111  -3.277  -1.415  26.090
  914    H    ASN 112           H        ASN 112  -1.220   3.251  22.373
  915    HA   ASN 112           HA       ASN 112  -2.777   5.449  23.634
  916    HB2  ASN 112           HB2      ASN 112  -0.522   6.341  23.640
  917    HB3  ASN 112           HB3      ASN 112  -0.240   5.787  21.988
  918   HD21  ASN 112          HD22      ASN 112   0.291   8.107  21.437
  919   HD22  ASN 112          HD21      ASN 112  -1.067   9.180  21.120
  920    H    MET 113           H        MET 113  -4.595   5.717  22.465
  921    HA   MET 113           HA       MET 113  -4.852   4.354  19.852
  922    HB2  MET 113           HB2      MET 113  -6.865   5.695  21.693
  923    HB3  MET 113           HB3      MET 113  -7.284   4.841  20.208
  924    HG2  MET 113           HG2      MET 113  -5.631   3.322  22.212
  925    HG3  MET 113           HG3      MET 113  -7.295   3.682  22.655
  926    HE1  MET 113           HE1      MET 113  -5.045   1.100  21.137
  927    HE2  MET 113           HE2      MET 113  -6.119   0.776  22.523
  928    HE3  MET 113           HE3      MET 113  -6.335  -0.109  20.998
  929    H    GLN 114           H        GLN 114  -3.747   7.403  20.646
  930    HA   GLN 114           HA       GLN 114  -4.876   8.668  18.282
  931    HB2  GLN 114           HB2      GLN 114  -5.231  10.775  19.514
  932    HB3  GLN 114           HB3      GLN 114  -6.430   9.508  19.769
  933    HG2  GLN 114           HG2      GLN 114  -5.489   8.953  21.969
  934    HG3  GLN 114           HG3      GLN 114  -4.212  10.153  21.767
  935   HE21  GLN 114          HE22      GLN 114  -4.876  12.487  21.606
  936   HE22  GLN 114          HE21      GLN 114  -6.349  12.993  22.394
  937    H    THR 115           H        THR 115  -3.059   8.202  17.440
  938    HA   THR 115           HA       THR 115  -0.449   9.139  18.230
  939    HB   THR 115           HB       THR 115  -0.177   8.304  15.751
  940    HG1  THR 115           HG1      THR 115  -1.874   6.970  15.056
  941   HG21  THR 115          HG21      THR 115   0.514   6.948  17.715
  942   HG22  THR 115          HG22      THR 115  -1.181   6.508  18.059
  943   HG23  THR 115          HG23      THR 115  -0.363   5.893  16.598
  944    H    SER 116           H        SER 116  -2.598   9.674  15.516
  945    HA   SER 116           HA       SER 116  -1.804  12.401  14.902
  946    HB2  SER 116           HB2      SER 116  -4.242  10.758  14.062
  947    HB3  SER 116           HB3      SER 116  -3.705  12.278  13.319
  948    HG   SER 116           HG       SER 116  -2.947  10.443  12.150
  949    H    SER 117           H        SER 117  -3.691  14.157  14.841
  950    HA   SER 117           HA       SER 117  -4.562  14.707  17.487
  951    HB2  SER 117           HB2      SER 117  -5.724  15.784  14.884
  952    HB3  SER 117           HB3      SER 117  -5.722  16.571  16.465
  953    HG   SER 117           HG       SER 117  -3.463  16.805  16.312
  954    H    THR 118           H        THR 118  -6.083  13.114  14.697
  955    HA   THR 118           HA       THR 118  -8.565  12.495  16.037
  956    HB   THR 118           HB       THR 118  -8.221  10.893  13.833
  957    HG1  THR 118           HG1      THR 118  -7.707  12.335  12.162
  958   HG21  THR 118          HG21      THR 118 -10.069  12.198  12.921
  959   HG22  THR 118          HG22      THR 118 -10.270  11.730  14.615
  960   HG23  THR 118          HG23      THR 118  -9.817  13.412  14.211
  961    HA   PRO 119           HA       PRO 119  -6.842   8.688  17.695
  962    HB2  PRO 119           HB2      PRO 119  -9.689   7.770  17.381
  963    HB3  PRO 119           HB3      PRO 119  -8.584   7.568  18.780
  964    HG2  PRO 119           HG2      PRO 119 -10.523   9.468  18.833
  965    HG3  PRO 119           HG3      PRO 119  -8.870   9.823  19.439
  966    HD2  PRO 119           HD2      PRO 119 -10.070  10.572  16.748
  967    HD3  PRO 119           HD3      PRO 119  -9.046  11.557  17.843
  968    H    GLU 120           H        GLU 120  -6.107   6.845  16.643
  969    HA   GLU 120           HA       GLU 120  -6.795   6.468  13.814
  970    HB2  GLU 120           HB2      GLU 120  -4.437   6.137  14.403
  971    HB3  GLU 120           HB3      GLU 120  -4.868   5.003  15.684
  972    HG2  GLU 120           HG2      GLU 120  -4.084   3.819  13.707
  973    HG3  GLU 120           HG3      GLU 120  -5.732   3.418  14.114
  974    H    PHE 121           H        PHE 121  -7.401   5.064  17.055
  975    HA   PHE 121           HA       PHE 121  -9.183   3.033  15.886
  976    HB2  PHE 121           HB2      PHE 121  -7.245   3.016  18.208
  977    HB3  PHE 121           HB3      PHE 121  -8.599   1.902  18.145
  978    HD1  PHE 121           HD1      PHE 121  -7.572   2.035  14.751
  979    HD2  PHE 121           HD2      PHE 121  -6.269   0.657  18.613
  980    HE1  PHE 121           HE1      PHE 121  -6.374   0.166  13.676
  981    HE2  PHE 121           HE2      PHE 121  -5.032  -1.181  17.527
  982    HZ   PHE 121           HZ       PHE 121  -5.125  -1.466  15.080
  983    H    ASP 122           H        ASP 122 -11.011   2.565  17.045
  984    HA   ASP 122           HA       ASP 122 -11.813   4.339  19.317
  985    HB2  ASP 122           HB2      ASP 122 -13.067   5.143  17.405
  986    HB3  ASP 122           HB3      ASP 122 -13.530   3.496  16.955
  987    H    GLY 123           H        GLY 123 -11.546   1.213  17.820
  988    HA2  GLY 123           HA2      GLY 123 -13.297  -0.098  19.870
  989    HA3  GLY 123           HA3      GLY 123 -12.722  -0.839  18.364
  990    H    TRP 124           H        TRP 124 -12.205  -1.103  21.578
  991    HA   TRP 124           HA       TRP 124  -9.642  -2.380  21.110
  992    HB2  TRP 124           HB2      TRP 124  -8.755  -0.209  21.535
  993    HB3  TRP 124           HB3      TRP 124  -9.875   0.075  22.853
  994    HD1  TRP 124           HD1      TRP 124  -7.658  -3.099  22.671
  995    HE1  TRP 124           HE1      TRP 124  -6.214  -3.166  24.758
  996    HE3  TRP 124           HE3      TRP 124  -8.672   1.587  24.477
  997    HZ2  TRP 124           HZ2      TRP 124  -5.466  -1.323  26.924
  998    HZ3  TRP 124           HZ3      TRP 124  -7.531   2.421  26.513
  999    HH2  TRP 124           HH2      TRP 124  -5.929   0.963  27.740
 1000    H    ARG 125           H        ARG 125  -9.652  -4.228  22.263
 1001    HA   ARG 125           HA       ARG 125 -10.679  -4.297  24.974
 1002    HB2  ARG 125           HB2      ARG 125 -12.118  -6.337  24.523
 1003    HB3  ARG 125           HB3      ARG 125 -12.755  -4.796  23.969
 1004    HG2  ARG 125           HG2      ARG 125 -12.061  -5.331  21.640
 1005    HG3  ARG 125           HG3      ARG 125 -11.467  -6.903  22.185
 1006    HD2  ARG 125           HD2      ARG 125 -13.681  -7.597  22.842
 1007    HD3  ARG 125           HD3      ARG 125 -14.311  -5.927  22.645
 1008    HE   ARG 125           HE       ARG 125 -13.310  -6.920  20.162
 1009   HH11  ARG 125          HH11      ARG 125 -16.104  -7.106  22.364
 1010   HH12  ARG 125          HH12      ARG 125 -17.202  -7.671  21.159
 1011   HH21  ARG 125          HH21      ARG 125 -14.768  -7.792  18.579
 1012   HH22  ARG 125          HH22      ARG 125 -16.439  -8.009  18.954
 1013    H    TRP 126           H        TRP 126 -10.069  -6.350  26.019
 1014    HA   TRP 126           HA       TRP 126  -7.816  -7.769  24.675
 1015    HB2  TRP 126           HB2      TRP 126  -8.249  -7.056  27.591
 1016    HB3  TRP 126           HB3      TRP 126  -7.162  -8.326  27.069
 1017    HD1  TRP 126           HD1      TRP 126  -7.413  -4.497  27.115
 1018    HE1  TRP 126           HE1      TRP 126  -5.079  -3.549  26.953
 1019    HE3  TRP 126           HE3      TRP 126  -4.879  -8.782  25.913
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.399  -4.503  26.410
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.426  -8.721  25.569
 1022    HH2  TRP 126           HH2      TRP 126  -1.172  -6.584  25.881
 1023    H    VAL 127           H        VAL 127  -8.166  -9.985  24.444
 1024    HA   VAL 127           HA       VAL 127 -10.596 -11.203  25.681
 1025    HB   VAL 127           HB       VAL 127 -10.880 -12.166  23.247
 1026   HG11  VAL 127          HG11      VAL 127 -12.489 -10.410  22.710
 1027   HG12  VAL 127          HG12      VAL 127 -12.541 -10.769  24.440
 1028   HG13  VAL 127          HG13      VAL 127 -11.719  -9.302  23.871
 1029   HG21  VAL 127          HG21      VAL 127  -9.606  -9.519  22.470
 1030   HG22  VAL 127          HG22      VAL 127  -8.834 -11.113  22.303
 1031   HG23  VAL 127          HG23      VAL 127 -10.315 -10.762  21.415
 1032    H    SER 128           H        SER 128 -10.600 -13.552  25.734
 1033    HA   SER 128           HA       SER 128  -8.091 -14.887  25.841
 1034    HB2  SER 128           HB2      SER 128 -10.892 -15.983  25.335
 1035    HB3  SER 128           HB3      SER 128  -9.488 -16.921  25.912
 1036    HG   SER 128           HG       SER 128 -10.906 -16.204  27.631
 1037    H    TYR 129           H        TYR 129  -6.957 -16.085  24.288
 1038    HA   TYR 129           HA       TYR 129  -6.832 -15.016  21.783
 1039    HB2  TYR 129           HB2      TYR 129  -5.676 -17.480  21.350
 1040    HB3  TYR 129           HB3      TYR 129  -4.905 -16.072  22.027
 1041    HD1  TYR 129           HD1      TYR 129  -6.885 -19.082  23.101
 1042    HD2  TYR 129           HD2      TYR 129  -3.754 -16.267  24.092
 1043    HE1  TYR 129           HE1      TYR 129  -6.473 -20.289  25.219
 1044    HE2  TYR 129           HE2      TYR 129  -3.333 -17.484  26.191
 1045    HH   TYR 129           HH       TYR 129  -3.996 -19.239  27.612
 1046    H    TRP 130           H        TRP 130  -8.867 -17.907  22.539
 1047    HA   TRP 130           HA       TRP 130  -9.215 -18.378  19.689
 1048    HB2  TRP 130           HB2      TRP 130 -10.676 -19.595  22.047
 1049    HB3  TRP 130           HB3      TRP 130 -10.720 -20.170  20.381
 1050    HD1  TRP 130           HD1      TRP 130  -9.178 -21.106  23.444
 1051    HE1  TRP 130           HE1      TRP 130  -6.962 -22.354  23.160
 1052    HE3  TRP 130           HE3      TRP 130  -8.248 -20.061  18.494
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.990 -22.754  21.127
 1054    HZ3  TRP 130           HZ3      TRP 130  -6.192 -20.925  17.411
 1055    HH2  TRP 130           HH2      TRP 130  -4.546 -22.246  18.715
 1056    H    TYR 131           H        TYR 131 -10.881 -16.286  21.955
 1057    HA   TYR 131           HA       TYR 131 -13.446 -16.462  20.700
 1058    HB2  TYR 131           HB2      TYR 131 -13.164 -15.732  22.981
 1059    HB3  TYR 131           HB3      TYR 131 -12.317 -14.272  22.455
 1060    HD1  TYR 131           HD1      TYR 131 -15.573 -16.104  22.379
 1061    HD2  TYR 131           HD2      TYR 131 -13.582 -12.354  21.611
 1062    HE1  TYR 131           HE1      TYR 131 -17.769 -15.012  22.038
 1063    HE2  TYR 131           HE2      TYR 131 -15.774 -11.253  21.284
 1064    HH   TYR 131           HH       TYR 131 -18.107 -11.513  21.268
 1065    HA   PRO 132           HA       PRO 132 -12.444 -12.513  18.287
 1066    HB2  PRO 132           HB2      PRO 132  -9.888 -11.814  17.579
 1067    HB3  PRO 132           HB3      PRO 132 -10.673 -11.328  19.118
 1068    HG2  PRO 132           HG2      PRO 132  -8.840 -13.702  18.700
 1069    HG3  PRO 132           HG3      PRO 132  -8.700 -12.392  19.921
 1070    HD2  PRO 132           HD2      PRO 132  -9.877 -14.706  20.527
 1071    HD3  PRO 132           HD3      PRO 132 -10.611 -13.188  21.105
 1072    H    VAL 133           H        VAL 133 -10.964 -15.591  17.772
 1073    HA   VAL 133           HA       VAL 133 -10.749 -15.455  14.883
 1074    HB   VAL 133           HB       VAL 133 -11.163 -17.924  16.600
 1075   HG11  VAL 133          HG11      VAL 133  -9.780 -17.578  13.899
 1076   HG12  VAL 133          HG12      VAL 133  -9.978 -19.097  14.797
 1077   HG13  VAL 133          HG13      VAL 133 -11.388 -18.277  14.145
 1078   HG21  VAL 133          HG21      VAL 133  -8.656 -18.136  16.598
 1079   HG22  VAL 133          HG22      VAL 133  -8.543 -16.487  15.942
 1080   HG23  VAL 133          HG23      VAL 133  -9.223 -16.769  17.553
 1081    H    ARG 134           H        ARG 134 -13.369 -16.037  17.270
 1082    HA   ARG 134           HA       ARG 134 -15.180 -17.371  15.511
 1083    HB2  ARG 134           HB2      ARG 134 -15.901 -15.497  17.812
 1084    HB3  ARG 134           HB3      ARG 134 -16.896 -16.786  17.138
 1085    HG2  ARG 134           HG2      ARG 134 -14.310 -17.273  18.643
 1086    HG3  ARG 134           HG3      ARG 134 -15.898 -17.214  19.397
 1087    HD2  ARG 134           HD2      ARG 134 -15.176 -19.092  17.134
 1088    HD3  ARG 134           HD3      ARG 134 -15.000 -19.505  18.860
 1089    HE   ARG 134           HE       ARG 134 -17.637 -18.617  18.529
 1090   HH11  ARG 134          HH11      ARG 134 -15.674 -21.355  17.389
 1091   HH12  ARG 134          HH12      ARG 134 -17.018 -22.421  17.202
 1092   HH21  ARG 134          HH21      ARG 134 -19.425 -20.039  18.285
 1093   HH22  ARG 134          HH22      ARG 134 -19.191 -21.660  17.739
 1094    H    GLN 135           H        GLN 135 -14.496 -13.895  15.993
 1095    HA   GLN 135           HA       GLN 135 -17.048 -13.196  14.793
 1096    HB2  GLN 135           HB2      GLN 135 -14.836 -11.432  15.791
 1097    HB3  GLN 135           HB3      GLN 135 -16.341 -10.820  15.115
 1098    HG2  GLN 135           HG2      GLN 135 -16.093 -12.738  17.462
 1099    HG3  GLN 135           HG3      GLN 135 -16.467 -11.012  17.600
 1100   HE21  GLN 135          HE22      GLN 135 -17.966 -13.580  18.415
 1101   HE22  GLN 135          HE21      GLN 135 -19.557 -13.347  17.732
 1102    H    VAL 136           H        VAL 136 -13.874 -13.734  13.417
 1103    HA   VAL 136           HA       VAL 136 -14.463 -12.102  11.064
 1104    HB   VAL 136           HB       VAL 136 -12.320 -13.143  10.264
 1105   HG11  VAL 136          HG11      VAL 136 -10.927 -11.642  11.595
 1106   HG12  VAL 136          HG12      VAL 136 -12.480 -10.863  11.255
 1107   HG13  VAL 136          HG13      VAL 136 -12.168 -11.560  12.859
 1108   HG21  VAL 136          HG21      VAL 136 -11.855 -13.969  13.141
 1109   HG22  VAL 136          HG22      VAL 136 -12.250 -15.111  11.839
 1110   HG23  VAL 136          HG23      VAL 136 -10.767 -14.148  11.756
 1111    H    VAL 137           H        VAL 137 -14.359 -13.170   8.864
 1112    HA   VAL 137           HA       VAL 137 -16.357 -15.326   8.756
 1113    HB   VAL 137           HB       VAL 137 -16.629 -14.739   6.485
 1114   HG11  VAL 137          HG11      VAL 137 -17.072 -12.392   6.439
 1115   HG12  VAL 137          HG12      VAL 137 -17.425 -12.985   8.073
 1116   HG13  VAL 137          HG13      VAL 137 -15.935 -12.063   7.755
 1117   HG21  VAL 137          HG21      VAL 137 -14.925 -13.091   5.374
 1118   HG22  VAL 137          HG22      VAL 137 -13.802 -13.652   6.660
 1119   HG23  VAL 137          HG23      VAL 137 -14.524 -14.806   5.529
 1120    H    SER 138           H        SER 138 -15.870 -16.955   6.773
 1121    HA   SER 138           HA       SER 138 -14.184 -18.852   7.771
 1122    HB2  SER 138           HB2      SER 138 -14.969 -18.510   4.861
 1123    HB3  SER 138           HB3      SER 138 -14.622 -20.036   5.710
 1124    HG   SER 138           HG       SER 138 -16.886 -19.630   5.559
 1125    H    PHE 139           H        PHE 139 -13.278 -16.728   4.926
 1126    HA   PHE 139           HA       PHE 139 -10.767 -18.077   4.690
 1127    HB2  PHE 139           HB2      PHE 139 -10.225 -16.511   2.978
 1128    HB3  PHE 139           HB3      PHE 139 -11.883 -17.036   2.796
 1129    HD1  PHE 139           HD2      PHE 139  -9.672 -14.191   3.691
 1130    HD2  PHE 139           HD1      PHE 139 -13.744 -15.422   2.948
 1131    HE1  PHE 139           HE2      PHE 139 -10.367 -11.817   3.506
 1132    HE2  PHE 139           HE1      PHE 139 -14.421 -13.050   2.766
 1133    HZ   PHE 139           HZ       PHE 139 -12.739 -11.242   3.058
 1134    H    LYS 140           H        LYS 140 -11.730 -15.320   6.629
 1135    HA   LYS 140           HA       LYS 140  -8.917 -14.633   7.314
 1136    HB2  LYS 140           HB2      LYS 140 -11.638 -13.537   8.033
 1137    HB3  LYS 140           HB3      LYS 140 -10.193 -13.066   8.961
 1138    HG2  LYS 140           HG2      LYS 140  -9.243 -11.896   7.244
 1139    HG3  LYS 140           HG3      LYS 140  -9.921 -12.913   5.985
 1140    HD2  LYS 140           HD2      LYS 140 -10.800 -10.585   5.978
 1141    HD3  LYS 140           HD3      LYS 140 -12.047 -11.833   6.066
 1142    HE2  LYS 140           HE2      LYS 140 -12.306 -11.491   8.478
 1143    HE3  LYS 140           HE3      LYS 140 -10.971 -10.329   8.503
 1144    HZ1  LYS 140           HZ1      LYS 140 -12.292  -8.851   7.051
 1145    HZ2  LYS 140           HZ2      LYS 140 -13.538  -9.901   7.016
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.129  -9.162   8.419
 1147    H    ARG 141           H        ARG 141 -11.765 -16.061   8.944
 1148    HA   ARG 141           HA       ARG 141 -10.669 -16.957  11.371
 1149    HB2  ARG 141           HB2      ARG 141 -12.406 -18.510   9.392
 1150    HB3  ARG 141           HB3      ARG 141 -11.898 -19.207  10.927
 1151    HG2  ARG 141           HG2      ARG 141 -13.012 -17.507  12.179
 1152    HG3  ARG 141           HG3      ARG 141 -13.473 -16.650  10.699
 1153    HD2  ARG 141           HD2      ARG 141 -14.836 -18.609  10.007
 1154    HD3  ARG 141           HD3      ARG 141 -14.352 -19.454  11.502
 1155    HE   ARG 141           HE       ARG 141 -15.547 -16.834  11.947
 1156   HH11  ARG 141          HH21      ARG 141 -16.491 -20.172  11.159
 1157   HH12  ARG 141          HH22      ARG 141 -18.023 -20.073  11.952
 1158   HH21  ARG 141          HH11      ARG 141 -17.453 -16.785  13.207
 1159   HH22  ARG 141          HH12      ARG 141 -18.621 -18.061  13.080
 1160    H    ASP 142           H        ASP 142 -10.164 -18.522   8.187
 1161    HA   ASP 142           HA       ASP 142  -8.656 -20.705   9.064
 1162    HB2  ASP 142           HB2      ASP 142  -9.669 -20.417   6.817
 1163    HB3  ASP 142           HB3      ASP 142  -8.495 -19.145   6.452
 1164    H    VAL 143           H        VAL 143  -7.569 -17.421   8.285
 1165    HA   VAL 143           HA       VAL 143  -4.731 -17.964   8.868
 1166    HB   VAL 143           HB       VAL 143  -6.444 -15.470   8.366
 1167   HG11  VAL 143          HG11      VAL 143  -4.384 -14.124   8.269
 1168   HG12  VAL 143          HG12      VAL 143  -4.739 -14.663   9.899
 1169   HG13  VAL 143          HG13      VAL 143  -3.476 -15.487   8.950
 1170   HG21  VAL 143          HG21      VAL 143  -5.128 -15.297   6.290
 1171   HG22  VAL 143          HG22      VAL 143  -4.287 -16.809   6.697
 1172   HG23  VAL 143          HG23      VAL 143  -6.031 -16.811   6.383
 1173    H    TYR 144           H        TYR 144  -7.466 -16.360  10.583
 1174    HA   TYR 144           HA       TYR 144  -5.877 -15.409  12.699
 1175    HB2  TYR 144           HB2      TYR 144  -8.835 -15.883  12.320
 1176    HB3  TYR 144           HB3      TYR 144  -8.213 -15.407  13.893
 1177    HD1  TYR 144           HD2      TYR 144  -7.023 -14.189  10.492
 1178    HD2  TYR 144           HD1      TYR 144  -9.039 -13.245  14.203
 1179    HE1  TYR 144           HE2      TYR 144  -6.922 -11.820   9.928
 1180    HE2  TYR 144           HE1      TYR 144  -8.939 -10.861  13.631
 1181    HH   TYR 144           HH       TYR 144  -7.446  -9.670  10.567
 1182    H    ARG 145           H        ARG 145  -7.560 -18.562  12.417
 1183    HA   ARG 145           HA       ARG 145  -6.835 -19.388  15.079
 1184    HB2  ARG 145           HB2      ARG 145  -7.410 -21.623  14.409
 1185    HB3  ARG 145           HB3      ARG 145  -8.557 -20.486  13.706
 1186    HG2  ARG 145           HG2      ARG 145  -6.964 -20.595  11.602
 1187    HG3  ARG 145           HG3      ARG 145  -6.423 -22.121  12.317
 1188    HD2  ARG 145           HD2      ARG 145  -9.291 -21.322  11.727
 1189    HD3  ARG 145           HD3      ARG 145  -8.253 -22.304  10.648
 1190    HE   ARG 145           HE       ARG 145  -8.236 -23.580  13.151
 1191   HH11  ARG 145          HH11      ARG 145 -10.653 -22.927  10.604
 1192   HH12  ARG 145          HH12      ARG 145 -11.625 -24.293  11.002
 1193   HH21  ARG 145          HH21      ARG 145  -9.543 -25.396  13.659
 1194   HH22  ARG 145          HH22      ARG 145 -10.974 -25.729  12.758
 1195    H    ARG 146           H        ARG 146  -4.963 -19.575  11.961
 1196    HA   ARG 146           HA       ARG 146  -2.768 -20.915  13.216
 1197    HB2  ARG 146           HB2      ARG 146  -3.090 -19.297  10.640
 1198    HB3  ARG 146           HB3      ARG 146  -1.471 -19.591  11.286
 1199    HG2  ARG 146           HG2      ARG 146  -1.699 -21.393   9.889
 1200    HG3  ARG 146           HG3      ARG 146  -2.197 -22.091  11.446
 1201    HD2  ARG 146           HD2      ARG 146  -4.580 -21.655  10.813
 1202    HD3  ARG 146           HD3      ARG 146  -3.996 -21.034   9.250
 1203    HE   ARG 146           HE       ARG 146  -3.036 -23.712   9.745
 1204   HH11  ARG 146          HH11      ARG 146  -5.829 -21.823   8.752
 1205   HH12  ARG 146          HH12      ARG 146  -6.569 -23.039   7.780
 1206   HH21  ARG 146          HH21      ARG 146  -4.001 -25.455   8.495
 1207   HH22  ARG 146          HH22      ARG 146  -5.518 -25.213   7.708
 1208    H    VAL 147           H        VAL 147  -3.434 -17.398  12.744
 1209    HA   VAL 147           HA       VAL 147  -1.100 -16.402  13.871
 1210    HB   VAL 147           HB       VAL 147  -3.942 -15.293  14.089
 1211   HG11  VAL 147          HG11      VAL 147  -2.503 -14.064  15.641
 1212   HG12  VAL 147          HG12      VAL 147  -1.292 -13.813  14.367
 1213   HG13  VAL 147          HG13      VAL 147  -2.902 -13.060  14.255
 1214   HG21  VAL 147          HG21      VAL 147  -1.738 -14.794  12.056
 1215   HG22  VAL 147          HG22      VAL 147  -3.239 -15.655  11.738
 1216   HG23  VAL 147          HG23      VAL 147  -3.308 -13.944  12.114
 1217    H    MET 148           H        MET 148  -3.864 -17.803  15.530
 1218    HA   MET 148           HA       MET 148  -2.954 -16.988  18.164
 1219    HB2  MET 148           HB2      MET 148  -5.292 -18.689  17.273
 1220    HB3  MET 148           HB3      MET 148  -4.900 -18.340  18.965
 1221    HG2  MET 148           HG2      MET 148  -5.543 -16.242  16.847
 1222    HG3  MET 148           HG3      MET 148  -6.658 -16.890  18.028
 1223    HE1  MET 148           HE1      MET 148  -3.004 -14.807  18.073
 1224    HE2  MET 148           HE2      MET 148  -4.364 -14.257  17.064
 1225    HE3  MET 148           HE3      MET 148  -3.941 -13.369  18.542
 1226    H    LYS 149           H        LYS 149  -3.377 -20.161  16.428
 1227    HA   LYS 149           HA       LYS 149  -2.255 -21.666  18.508
 1228    HB2  LYS 149           HB2      LYS 149  -2.408 -23.477  17.198
 1229    HB3  LYS 149           HB3      LYS 149  -3.574 -22.395  16.446
 1230    HG2  LYS 149           HG2      LYS 149  -2.586 -23.367  14.643
 1231    HG3  LYS 149           HG3      LYS 149  -1.735 -21.825  14.764
 1232    HD2  LYS 149           HD2      LYS 149   0.256 -22.855  15.583
 1233    HD3  LYS 149           HD3      LYS 149  -0.582 -24.368  15.948
 1234    HE2  LYS 149           HE2      LYS 149  -0.807 -24.922  13.638
 1235    HE3  LYS 149           HE3      LYS 149  -0.458 -23.271  13.109
 1236    HZ1  LYS 149           HZ1      LYS 149   1.418 -24.817  12.779
 1237    HZ2  LYS 149           HZ2      LYS 149   1.838 -23.538  13.708
 1238    HZ3  LYS 149           HZ3      LYS 149   1.571 -25.028  14.392
 1239    H    GLU 150           H        GLU 150  -0.640 -19.999  15.871
 1240    HA   GLU 150           HA       GLU 150   1.833 -21.165  15.942
 1241    HB2  GLU 150           HB2      GLU 150   0.724 -18.448  15.230
 1242    HB3  GLU 150           HB3      GLU 150   2.488 -18.640  15.236
 1243    HG2  GLU 150           HG2      GLU 150   0.622 -20.401  13.678
 1244    HG3  GLU 150           HG3      GLU 150   1.525 -18.980  13.096
 1245    H    PHE 151           H        PHE 151   0.582 -18.536  17.938
 1246    HA   PHE 151           HA       PHE 151   3.172 -18.424  19.419
 1247    HB2  PHE 151           HB2      PHE 151   1.084 -16.274  19.456
 1248    HB3  PHE 151           HB3      PHE 151   2.820 -16.188  19.759
 1249    HD1  PHE 151           HD2      PHE 151   3.921 -17.509  17.149
 1250    HD2  PHE 151           HD1      PHE 151   0.734 -14.642  17.823
 1251    HE1  PHE 151           HE2      PHE 151   4.124 -16.727  14.891
 1252    HE2  PHE 151           HE1      PHE 151   1.058 -13.788  15.553
 1253    HZ   PHE 151           HZ       PHE 151   2.764 -14.840  14.050
 1254    H    ALA 152           H        ALA 152  -0.126 -19.427  19.777
 1255    HA   ALA 152           HA       ALA 152  -0.733 -18.964  22.433
 1256    HB1  ALA 152           HB1      ALA 152  -1.235 -21.442  20.694
 1257    HB2  ALA 152           HB2      ALA 152  -2.030 -21.126  22.251
 1258    HB3  ALA 152           HB3      ALA 152  -2.307 -20.038  20.886
 1259    H    SER 153           H        SER 153   1.386 -21.474  21.065
 1260    HA   SER 153           HA       SER 153   1.777 -22.921  23.481
 1261    HB2  SER 153           HB2      SER 153   3.661 -22.694  21.106
 1262    HB3  SER 153           HB3      SER 153   3.552 -24.037  22.270
 1263    HG   SER 153           HG       SER 153   2.413 -24.529  20.337
 1264    H    VAL 154           H        VAL 154   3.318 -19.995  22.191
 1265    HA   VAL 154           HA       VAL 154   5.434 -19.967  24.228
 1266    HB   VAL 154           HB       VAL 154   4.385 -17.767  22.398
 1267   HG11  VAL 154          HG11      VAL 154   6.459 -16.587  22.952
 1268   HG12  VAL 154          HG12      VAL 154   5.457 -16.800  24.403
 1269   HG13  VAL 154          HG13      VAL 154   6.886 -17.833  24.137
 1270   HG21  VAL 154          HG21      VAL 154   6.517 -18.174  21.136
 1271   HG22  VAL 154          HG22      VAL 154   6.830 -19.582  22.167
 1272   HG23  VAL 154          HG23      VAL 154   5.424 -19.558  21.076
 1273    H    VAL 155           H        VAL 155   2.207 -18.509  23.677
 1274    HA   VAL 155           HA       VAL 155   2.249 -16.842  25.919
 1275    HB   VAL 155           HB       VAL 155  -0.186 -18.140  24.659
 1276   HG11  VAL 155          HG11      VAL 155   0.142 -15.806  26.608
 1277   HG12  VAL 155          HG12      VAL 155  -1.354 -16.093  25.634
 1278   HG13  VAL 155          HG13      VAL 155  -0.821 -17.278  26.844
 1279   HG21  VAL 155          HG21      VAL 155   1.198 -16.672  23.120
 1280   HG22  VAL 155          HG22      VAL 155  -0.411 -16.042  23.453
 1281   HG23  VAL 155          HG23      VAL 155   1.028 -15.357  24.287
 1282    H    MET 156           H        MET 156   1.217 -20.338  25.825
 1283    HA   MET 156           HA       MET 156   0.214 -20.467  28.385
 1284    HB2  MET 156           HB2      MET 156   2.089 -22.500  27.034
 1285    HB3  MET 156           HB3      MET 156   1.031 -22.857  28.405
 1286    HG2  MET 156           HG2      MET 156   0.209 -22.191  25.577
 1287    HG3  MET 156           HG3      MET 156  -0.010 -23.713  26.404
 1288    HE1  MET 156           HE1      MET 156  -1.890 -20.919  24.977
 1289    HE2  MET 156           HE2      MET 156  -2.277 -22.648  24.781
 1290    HE3  MET 156           HE3      MET 156  -3.454 -21.548  25.533
 1291    H    SER 157           H        SER 157   3.573 -20.953  27.363
 1292    HA   SER 157           HA       SER 157   4.600 -21.239  30.002
 1293    HB2  SER 157           HB2      SER 157   5.672 -20.932  27.191
 1294    HB3  SER 157           HB3      SER 157   6.794 -21.087  28.589
 1295    HG   SER 157           HG       SER 157   6.297 -23.124  27.621
 1296    H    LEU 158           H        LEU 158   4.118 -18.482  27.893
 1297    HA   LEU 158           HA       LEU 158   5.691 -16.570  29.272
 1298    HB2  LEU 158           HB2      LEU 158   4.537 -16.403  26.959
 1299    HB3  LEU 158           HB3      LEU 158   3.011 -16.197  27.831
 1300    HG   LEU 158           HG       LEU 158   3.971 -14.126  28.898
 1301   HD11  LEU 158          HD11      LEU 158   6.062 -14.571  26.705
 1302   HD12  LEU 158          HD12      LEU 158   5.884 -13.095  27.698
 1303   HD13  LEU 158          HD13      LEU 158   6.362 -14.619  28.446
 1304   HD21  LEU 158          HD21      LEU 158   3.466 -14.489  25.908
 1305   HD22  LEU 158          HD22      LEU 158   2.305 -14.077  27.194
 1306   HD23  LEU 158          HD23      LEU 158   3.531 -12.890  26.667
 1307    H    GLN 159           H        GLN 159   2.298 -17.610  29.665
 1308    HA   GLN 159           HA       GLN 159   1.694 -15.918  31.906
 1309    HB2  GLN 159           HB2      GLN 159   0.578 -18.726  31.470
 1310    HB3  GLN 159           HB3      GLN 159  -0.096 -17.444  32.442
 1311    HG2  GLN 159           HG2      GLN 159  -0.295 -16.129  30.139
 1312    HG3  GLN 159           HG3      GLN 159  -0.066 -17.746  29.444
 1313   HE21  GLN 159          HE21      GLN 159  -2.041 -16.425  32.168
 1314   HE22  GLN 159          HE22      GLN 159  -3.493 -17.315  31.720
 1315    H    GLU 160           H        GLU 160   3.019 -19.193  31.709
 1316    HA   GLU 160           HA       GLU 160   2.921 -19.740  34.467
 1317    HB2  GLU 160           HB2      GLU 160   4.517 -20.995  32.204
 1318    HB3  GLU 160           HB3      GLU 160   4.584 -21.605  33.864
 1319    HG2  GLU 160           HG2      GLU 160   2.163 -21.953  33.903
 1320    HG3  GLU 160           HG3      GLU 160   2.018 -21.310  32.275
 1321    H    ASN 161           H        ASN 161   5.442 -18.231  32.524
 1322    HA   ASN 161           HA       ASN 161   7.418 -18.442  34.731
 1323    HB2  ASN 161           HB2      ASN 161   7.596 -17.463  31.849
 1324    HB3  ASN 161           HB3      ASN 161   8.854 -17.150  33.040
 1325   HD21  ASN 161          HD22      ASN 161   7.033 -19.833  31.481
 1326   HD22  ASN 161          HD21      ASN 161   8.298 -21.030  31.701
 1327    H    THR 162           H        THR 162   5.123 -16.248  33.250
 1328    HA   THR 162           HA       THR 162   4.837 -14.062  33.236
 1329    HB   THR 162           HB       THR 162   3.523 -14.663  35.063
 1330    HG1  THR 162           HG1      THR 162   3.382 -12.719  36.123
 1331   HG21  THR 162          HG21      THR 162   4.215 -14.537  37.446
 1332   HG22  THR 162          HG22      THR 162   4.943 -15.875  36.554
 1333   HG23  THR 162          HG23      THR 162   5.912 -14.431  36.915
 1334    HA   PRO 163           HA       PRO 163   9.332 -13.690  33.604
 1335    HB2  PRO 163           HB2      PRO 163  10.138 -13.155  31.064
 1336    HB3  PRO 163           HB3      PRO 163   9.751 -14.792  31.672
 1337    HG2  PRO 163           HG2      PRO 163   7.939 -12.914  30.117
 1338    HG3  PRO 163           HG3      PRO 163   8.221 -14.670  29.853
 1339    HD2  PRO 163           HD2      PRO 163   6.078 -13.669  31.277
 1340    HD3  PRO 163           HD3      PRO 163   6.825 -15.255  31.625
 1341    H    LYS 164           H        LYS 164  10.870 -11.807  33.124
 1342    HA   LYS 164           HA       LYS 164   9.351  -9.343  33.711
 1343    HB2  LYS 164           HB2      LYS 164  12.281  -9.868  34.283
 1344    HB3  LYS 164           HB3      LYS 164  11.216  -8.684  35.040
 1345    HG2  LYS 164           HG2      LYS 164  11.112 -11.724  35.344
 1346    HG3  LYS 164           HG3      LYS 164  11.713 -10.576  36.546
 1347    HD2  LYS 164           HD2      LYS 164   9.459  -9.634  36.850
 1348    HD3  LYS 164           HD3      LYS 164   8.823 -10.671  35.561
 1349    HE2  LYS 164           HE2      LYS 164   9.701 -12.672  36.928
 1350    HE3  LYS 164           HE3      LYS 164   9.909 -11.534  38.266
 1351    HZ1  LYS 164           HZ1      LYS 164   7.501 -11.048  38.072
 1352    HZ2  LYS 164           HZ2      LYS 164   7.369 -12.158  36.854
 1353    HZ3  LYS 164           HZ3      LYS 164   7.766 -12.632  38.380
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1   0.057  -0.482  -1.898
    2    H2   MET   1           H2       MET   1   0.774   0.826  -2.577
    3    H3   MET   1           H3       MET   1  -0.440   0.058  -3.363
    4    HA   MET   1           HA       MET   1   1.651  -0.518  -4.384
    5    HB2  MET   1           HB2      MET   1   2.906  -0.164  -2.154
    6    HB3  MET   1           HB3      MET   1   2.470  -1.814  -1.733
    7    HG2  MET   1           HG2      MET   1   4.093  -0.912  -4.149
    8    HG3  MET   1           HG3      MET   1   4.747  -1.562  -2.651
    9    HE1  MET   1           HE1      MET   1   4.446  -5.312  -2.901
   10    HE2  MET   1           HE2      MET   1   5.546  -3.990  -2.423
   11    HE3  MET   1           HE3      MET   1   3.895  -4.047  -1.769
   12    H    ILE   2           H        ILE   2   1.287  -2.320  -5.682
   13    HA   ILE   2           HA       ILE   2   0.215  -4.812  -4.451
   14    HB   ILE   2           HB       ILE   2  -0.666  -3.640  -7.104
   15   HG12  ILE   2          HG12      ILE   2  -1.818  -3.621  -4.374
   16   HG13  ILE   2          HG13      ILE   2  -2.117  -2.552  -5.742
   17   HG21  ILE   2          HG21      ILE   2  -1.978  -5.670  -7.371
   18   HG22  ILE   2          HG22      ILE   2  -0.302  -6.126  -7.160
   19   HG23  ILE   2          HG23      ILE   2  -1.429  -6.278  -5.786
   20   HD11  ILE   2          HD11      ILE   2  -4.155  -3.643  -5.120
   21   HD12  ILE   2          HD12      ILE   2  -3.651  -4.394  -6.642
   22   HD13  ILE   2          HD13      ILE   2  -3.339  -5.224  -5.059
   23    H    ASP   3           H        ASP   3   1.593  -6.494  -4.994
   24    HA   ASP   3           HA       ASP   3   4.155  -5.878  -5.825
   25    HB2  ASP   3           HB2      ASP   3   3.591  -7.806  -4.412
   26    HB3  ASP   3           HB3      ASP   3   2.816  -8.582  -5.809
   27    H    ASP   4           H        ASP   4   1.891  -7.991  -7.629
   28    HA   ASP   4           HA       ASP   4   2.553  -6.750 -10.128
   29    HB2  ASP   4           HB2      ASP   4   4.548  -8.158  -9.917
   30    HB3  ASP   4           HB3      ASP   4   3.540  -9.562  -9.580
   31    H    ASP   5           H        ASP   5   1.362  -9.853  -8.842
   32    HA   ASP   5           HA       ASP   5  -0.521 -10.057 -11.045
   33    HB2  ASP   5           HB2      ASP   5   1.101 -11.859 -10.496
   34    HB3  ASP   5           HB3      ASP   5   0.215 -12.158  -9.001
   35    H    GLY   6           H        GLY   6  -1.013  -8.298  -8.657
   36    HA2  GLY   6           HA2      GLY   6  -3.092  -7.509  -7.876
   37    HA3  GLY   6           HA3      GLY   6  -3.851  -9.049  -8.255
   38    H    TYR   7           H        TYR   7  -0.926  -9.483  -6.524
   39    HA   TYR   7           HA       TYR   7  -2.365  -9.736  -3.933
   40    HB2  TYR   7           HB2      TYR   7   0.205 -11.084  -4.856
   41    HB3  TYR   7           HB3      TYR   7  -0.544 -11.263  -3.269
   42    HD1  TYR   7           HD2      TYR   7  -2.625 -12.549  -2.974
   43    HD2  TYR   7           HD1      TYR   7  -0.746 -12.186  -6.838
   44    HE1  TYR   7           HE2      TYR   7  -4.110 -14.328  -3.869
   45    HE2  TYR   7           HE1      TYR   7  -2.184 -13.976  -7.725
   46    HH   TYR   7           HH       TYR   7  -3.926 -15.473  -7.280
   47    H    ARG   8           H        ARG   8  -1.263  -8.870  -2.044
   48    HA   ARG   8           HA       ARG   8   1.043  -7.112  -2.596
   49    HB2  ARG   8           HB2      ARG   8   0.035  -5.191  -1.485
   50    HB3  ARG   8           HB3      ARG   8  -0.914  -5.650  -2.917
   51    HG2  ARG   8           HG2      ARG   8  -1.873  -6.791  -0.322
   52    HG3  ARG   8           HG3      ARG   8  -2.011  -5.045  -0.532
   53    HD2  ARG   8           HD2      ARG   8  -3.203  -5.326  -2.645
   54    HD3  ARG   8           HD3      ARG   8  -2.982  -7.063  -2.597
   55    HE   ARG   8           HE       ARG   8  -4.601  -7.350  -0.998
   56   HH11  ARG   8          HH21      ARG   8  -4.137  -3.812  -1.392
   57   HH12  ARG   8          HH22      ARG   8  -5.456  -3.411  -0.356
   58   HH21  ARG   8          HH11      ARG   8  -6.201  -6.782   0.494
   59   HH22  ARG   8          HH12      ARG   8  -6.697  -5.130   0.694
   60    HA   PRO   9           HA       PRO   9   2.108  -9.018   1.247
   61    HB2  PRO   9           HB2      PRO   9   4.511  -7.913   1.776
   62    HB3  PRO   9           HB3      PRO   9   4.218  -8.810   0.263
   63    HG2  PRO   9           HG2      PRO   9   4.164  -5.795   0.668
   64    HG3  PRO   9           HG3      PRO   9   5.005  -6.735  -0.601
   65    HD2  PRO   9           HD2      PRO   9   2.509  -5.566  -0.892
   66    HD3  PRO   9           HD3      PRO   9   3.053  -7.008  -1.801
   67    H    ASN  10           H        ASN  10   1.772  -8.837   3.489
   68    HA   ASN  10           HA       ASN  10   1.374  -6.114   4.653
   69    HB2  ASN  10           HB2      ASN  10  -0.744  -7.085   3.621
   70    HB3  ASN  10           HB3      ASN  10  -0.638  -8.406   4.764
   71   HD21  ASN  10          HD22      ASN  10  -1.965  -5.289   4.226
   72   HD22  ASN  10          HD21      ASN  10  -2.458  -4.990   5.867
   73    H    VAL  11           H        VAL  11   1.392  -6.108   7.023
   74    HA   VAL  11           HA       VAL  11   2.434  -8.536   8.299
   75    HB   VAL  11           HB       VAL  11   4.116  -7.092   9.554
   76   HG11  VAL  11          HG11      VAL  11   5.811  -7.301   7.665
   77   HG12  VAL  11          HG12      VAL  11   5.028  -8.732   8.323
   78   HG13  VAL  11          HG13      VAL  11   4.472  -8.098   6.778
   79   HG21  VAL  11          HG21      VAL  11   3.438  -4.853   8.883
   80   HG22  VAL  11          HG22      VAL  11   5.095  -5.200   8.367
   81   HG23  VAL  11          HG23      VAL  11   3.774  -5.213   7.180
   82    H    GLY  12           H        GLY  12   1.729  -8.740  10.420
   83    HA2  GLY  12           HA2      GLY  12   0.194  -6.480  11.595
   84    HA3  GLY  12           HA3      GLY  12  -0.467  -8.103  11.503
   85    H    ILE  13           H        ILE  13  -0.254  -6.732  13.869
   86    HA   ILE  13           HA       ILE  13   2.110  -7.850  15.308
   87    HB   ILE  13           HB       ILE  13   0.537  -5.250  15.586
   88   HG12  ILE  13          HG12      ILE  13   2.864  -4.259  15.670
   89   HG13  ILE  13          HG13      ILE  13   3.485  -5.800  15.120
   90   HG21  ILE  13          HG21      ILE  13   2.565  -6.444  17.514
   91   HG22  ILE  13          HG22      ILE  13   1.916  -4.777  17.587
   92   HG23  ILE  13          HG23      ILE  13   0.830  -6.124  17.837
   93   HD11  ILE  13          HD11      ILE  13   3.138  -3.900  13.442
   94   HD12  ILE  13          HD12      ILE  13   2.437  -5.447  12.945
   95   HD13  ILE  13          HD13      ILE  13   1.396  -4.148  13.597
   96    H    VAL  14           H        VAL  14   1.675  -9.006  17.166
   97    HA   VAL  14           HA       VAL  14  -1.090  -8.952  18.296
   98    HB   VAL  14           HB       VAL  14   0.811 -11.346  18.320
   99   HG11  VAL  14          HG11      VAL  14  -1.183 -12.573  19.135
  100   HG12  VAL  14          HG12      VAL  14  -0.751 -11.265  20.230
  101   HG13  VAL  14          HG13      VAL  14  -2.122 -11.054  19.121
  102   HG21  VAL  14          HG21      VAL  14  -0.758 -12.434  16.754
  103   HG22  VAL  14          HG22      VAL  14  -1.581 -10.868  16.509
  104   HG23  VAL  14          HG23      VAL  14   0.123 -11.087  16.023
  105    H    ILE  15           H        ILE  15  -1.000  -8.425  20.547
  106    HA   ILE  15           HA       ILE  15   1.694  -8.578  21.785
  107    HB   ILE  15           HB       ILE  15  -0.380  -6.576  22.730
  108   HG12  ILE  15          HG12      ILE  15   0.287  -5.851  20.460
  109   HG13  ILE  15          HG13      ILE  15   0.853  -4.772  21.722
  110   HG21  ILE  15          HG21      ILE  15   2.562  -7.117  23.325
  111   HG22  ILE  15          HG22      ILE  15   1.724  -5.627  23.785
  112   HG23  ILE  15          HG23      ILE  15   1.174  -7.179  24.443
  113   HD11  ILE  15          HD11      ILE  15   3.135  -5.735  21.569
  114   HD12  ILE  15          HD12      ILE  15   2.545  -6.887  20.349
  115   HD13  ILE  15          HD13      ILE  15   2.582  -5.145  19.991
  116    H    CYS  16           H        CYS  16   1.759  -9.846  23.662
  117    HA   CYS  16           HA       CYS  16  -0.885 -10.470  24.869
  118    HB2  CYS  16           HB2      CYS  16  -0.382 -12.751  25.228
  119    HB3  CYS  16           HB3      CYS  16   0.025 -12.456  23.534
  120    HG   CYS  16           HG       CYS  16   1.701 -14.115  24.863
  121    H    ASN  17           H        ASN  17  -0.785 -11.246  27.087
  122    HA   ASN  17           HA       ASN  17   1.430 -10.007  28.652
  123    HB2  ASN  17           HB2      ASN  17  -0.054  -9.476  30.426
  124    HB3  ASN  17           HB3      ASN  17  -0.748  -8.817  28.969
  125   HD21  ASN  17          HD22      ASN  17  -2.587  -8.840  30.792
  126   HD22  ASN  17          HD21      ASN  17  -3.638 -10.239  30.745
  127    H    ARG  18           H        ARG  18   1.488 -11.284  30.955
  128    HA   ARG  18           HA       ARG  18   2.048 -14.036  30.141
  129    HB2  ARG  18           HB2      ARG  18   2.399 -12.641  32.820
  130    HB3  ARG  18           HB3      ARG  18   2.874 -14.301  32.472
  131    HG2  ARG  18           HG2      ARG  18   4.871 -13.479  31.942
  132    HG3  ARG  18           HG3      ARG  18   4.106 -13.144  30.397
  133    HD2  ARG  18           HD2      ARG  18   5.410 -11.234  31.250
  134    HD3  ARG  18           HD3      ARG  18   3.681 -10.846  31.043
  135    HE   ARG  18           HE       ARG  18   4.049 -11.697  33.714
  136   HH11  ARG  18          HH11      ARG  18   5.518  -9.062  31.838
  137   HH12  ARG  18          HH12      ARG  18   5.382  -7.904  33.108
  138   HH21  ARG  18          HH22      ARG  18   3.531 -10.081  35.230
  139   HH22  ARG  18          HH21      ARG  18   4.363  -8.551  35.172
  140    H    GLN  19           H        GLN  19  -0.828 -12.817  30.678
  141    HA   GLN  19           HA       GLN  19  -1.886 -15.097  32.209
  142    HB2  GLN  19           HB2      GLN  19  -3.456 -12.669  31.318
  143    HB3  GLN  19           HB3      GLN  19  -3.912 -13.875  32.513
  144    HG2  GLN  19           HG2      GLN  19  -1.723 -11.786  32.724
  145    HG3  GLN  19           HG3      GLN  19  -3.246 -11.790  33.587
  146   HE21  GLN  19          HE22      GLN  19  -0.361 -11.862  34.704
  147   HE22  GLN  19          HE21      GLN  19  -0.314 -13.292  35.699
  148    H    GLY  20           H        GLY  20  -1.115 -14.333  29.018
  149    HA2  GLY  20           HA2      GLY  20  -1.694 -15.413  27.077
  150    HA3  GLY  20           HA3      GLY  20  -2.882 -16.394  27.953
  151    H    GLN  21           H        GLN  21  -3.081 -12.896  28.407
  152    HA   GLN  21           HA       GLN  21  -5.500 -12.821  26.693
  153    HB2  GLN  21           HB2      GLN  21  -4.346 -10.655  28.472
  154    HB3  GLN  21           HB3      GLN  21  -5.887 -10.607  27.612
  155    HG2  GLN  21           HG2      GLN  21  -6.741 -12.475  28.999
  156    HG3  GLN  21           HG3      GLN  21  -5.182 -12.573  29.834
  157   HE21  GLN  21          HE22      GLN  21  -8.187 -10.693  29.613
  158   HE22  GLN  21          HE21      GLN  21  -7.807  -9.631  30.950
  159    H    VAL  22           H        VAL  22  -5.567 -11.311  24.943
  160    HA   VAL  22           HA       VAL  22  -2.980 -10.307  23.966
  161    HB   VAL  22           HB       VAL  22  -3.565 -10.921  21.712
  162   HG11  VAL  22          HG11      VAL  22  -3.301 -13.331  21.817
  163   HG12  VAL  22          HG12      VAL  22  -2.352 -12.572  23.104
  164   HG13  VAL  22          HG13      VAL  22  -3.877 -13.378  23.507
  165   HG21  VAL  22          HG21      VAL  22  -5.499 -12.356  21.147
  166   HG22  VAL  22          HG22      VAL  22  -6.143 -12.160  22.791
  167   HG23  VAL  22          HG23      VAL  22  -5.997 -10.753  21.706
  168    H    MET  23           H        MET  23  -3.119  -8.348  22.750
  169    HA   MET  23           HA       MET  23  -5.365  -6.612  23.466
  170    HB2  MET  23           HB2      MET  23  -2.992  -5.824  23.236
  171    HB3  MET  23           HB3      MET  23  -3.081  -6.150  21.508
  172    HG2  MET  23           HG2      MET  23  -5.349  -4.491  22.389
  173    HG3  MET  23           HG3      MET  23  -3.836  -3.792  22.902
  174    HE1  MET  23           HE1      MET  23  -1.975  -2.932  21.453
  175    HE2  MET  23           HE2      MET  23  -1.738  -4.478  20.614
  176    HE3  MET  23           HE3      MET  23  -1.928  -2.980  19.674
  177    H    TRP  24           H        TRP  24  -7.060  -5.943  22.084
  178    HA   TRP  24           HA       TRP  24  -7.060  -6.759  19.259
  179    HB2  TRP  24           HB2      TRP  24  -8.087  -8.566  20.761
  180    HB3  TRP  24           HB3      TRP  24  -9.363  -7.420  21.128
  181    HD1  TRP  24           HD1      TRP  24  -7.813  -8.307  17.677
  182    HE1  TRP  24           HE1      TRP  24  -9.608  -9.335  16.181
  183    HE3  TRP  24           HE3      TRP  24 -11.649  -8.453  21.036
  184    HZ2  TRP  24           HZ2      TRP  24 -12.384 -10.118  16.403
  185    HZ3  TRP  24           HZ3      TRP  24 -13.878  -9.305  20.360
  186    HH2  TRP  24           HH2      TRP  24 -14.255 -10.103  18.046
  187    H    ALA  25           H        ALA  25  -8.427  -5.082  18.032
  188    HA   ALA  25           HA       ALA  25  -9.524  -2.926  19.776
  189    HB1  ALA  25           HB1      ALA  25  -7.285  -2.542  17.763
  190    HB2  ALA  25           HB2      ALA  25  -8.120  -1.245  18.656
  191    HB3  ALA  25           HB3      ALA  25  -7.151  -2.432  19.526
  192    H    ARG  26           H        ARG  26 -10.931  -1.457  18.820
  193    HA   ARG  26           HA       ARG  26 -12.464  -2.596  16.553
  194    HB2  ARG  26           HB2      ARG  26 -13.591  -2.026  18.682
  195    HB3  ARG  26           HB3      ARG  26 -13.109  -0.342  18.512
  196    HG2  ARG  26           HG2      ARG  26 -14.542  -0.039  16.599
  197    HG3  ARG  26           HG3      ARG  26 -14.746  -1.783  16.397
  198    HD2  ARG  26           HD2      ARG  26 -16.776  -0.939  17.340
  199    HD3  ARG  26           HD3      ARG  26 -15.951  -1.909  18.561
  200    HE   ARG  26           HE       ARG  26 -15.489   1.024  18.612
  201   HH11  ARG  26          HH11      ARG  26 -17.535  -1.593  19.937
  202   HH12  ARG  26          HH12      ARG  26 -18.019  -0.651  21.304
  203   HH21  ARG  26          HH21      ARG  26 -16.166   2.207  20.253
  204   HH22  ARG  26          HH22      ARG  26 -17.215   1.607  21.526
  205    H    ARG  27           H        ARG  27 -12.122  -1.687  14.443
  206    HA   ARG  27           HA       ARG  27 -10.044   0.344  14.423
  207    HB2  ARG  27           HB2      ARG  27 -10.151  -1.590  12.826
  208    HB3  ARG  27           HB3      ARG  27 -11.482  -0.778  11.997
  209    HG2  ARG  27           HG2      ARG  27  -9.999   1.203  11.608
  210    HG3  ARG  27           HG3      ARG  27  -8.721   0.381  12.526
  211    HD2  ARG  27           HD2      ARG  27  -8.805  -1.442  10.723
  212    HD3  ARG  27           HD3      ARG  27  -9.786  -0.319   9.778
  213    HE   ARG  27           HE       ARG  27  -7.965   1.169   9.601
  214   HH11  ARG  27          HH11      ARG  27  -6.954  -1.801  11.317
  215   HH12  ARG  27          HH12      ARG  27  -5.336  -1.204  11.619
  216   HH21  ARG  27          HH21      ARG  27  -5.835   1.963  10.219
  217   HH22  ARG  27          HH22      ARG  27  -4.710   0.822  10.890
  218    H    PHE  28           H        PHE  28 -10.189   2.471  13.418
  219    HA   PHE  28           HA       PHE  28 -12.311   3.936  14.517
  220    HB2  PHE  28           HB2      PHE  28 -10.053   4.783  14.029
  221    HB3  PHE  28           HB3      PHE  28 -10.392   4.748  12.305
  222    HD1  PHE  28           HD1      PHE  28 -11.525   6.229  15.573
  223    HD2  PHE  28           HD2      PHE  28 -11.360   6.684  11.283
  224    HE1  PHE  28           HE1      PHE  28 -12.379   8.550  15.783
  225    HE2  PHE  28           HE2      PHE  28 -12.195   9.010  11.507
  226    HZ   PHE  28           HZ       PHE  28 -12.709   9.945  13.750
  227    H    GLY  29           H        GLY  29 -14.294   4.447  13.856
  228    HA2  GLY  29           HA2      GLY  29 -16.116   4.824  12.537
  229    HA3  GLY  29           HA3      GLY  29 -15.119   4.616  11.096
  230    H    GLN  30           H        GLN  30 -14.802   1.863  13.175
  231    HA   GLN  30           HA       GLN  30 -16.779   0.356  11.518
  232    HB2  GLN  30           HB2      GLN  30 -14.347  -0.889  12.802
  233    HB3  GLN  30           HB3      GLN  30 -15.352  -1.506  11.498
  234    HG2  GLN  30           HG2      GLN  30 -13.267   0.677  11.398
  235    HG3  GLN  30           HG3      GLN  30 -13.233  -0.885  10.601
  236   HE21  GLN  30          HE22      GLN  30 -13.485   2.294   9.864
  237   HE22  GLN  30          HE21      GLN  30 -14.504   2.195   8.438
  238    H    HIS  31           H        HIS  31 -17.654  -1.568  12.580
  239    HA   HIS  31           HA       HIS  31 -17.903  -1.286  15.543
  240    HB2  HIS  31           HB2      HIS  31 -19.755  -2.670  13.589
  241    HB3  HIS  31           HB3      HIS  31 -19.996  -2.509  15.326
  242    HD1  HIS  31           HD1      HIS  31 -21.828  -1.188  12.824
  243    HD2  HIS  31           HD2      HIS  31 -19.202   0.684  15.541
  244    HE1  HIS  31           HE1      HIS  31 -22.547   1.248  12.958
  245    H    SER  32           H        SER  32 -16.404  -3.227  13.111
  246    HA   SER  32           HA       SER  32 -16.433  -5.715  14.626
  247    HB2  SER  32           HB2      SER  32 -14.890  -6.339  12.636
  248    HB3  SER  32           HB3      SER  32 -16.609  -6.026  12.324
  249    HG   SER  32           HG       SER  32 -15.361  -4.917  10.792
  250    H    TRP  33           H        TRP  33 -14.435  -6.753  15.335
  251    HA   TRP  33           HA       TRP  33 -12.394  -4.777  16.248
  252    HB2  TRP  33           HB2      TRP  33 -13.350  -7.378  17.424
  253    HB3  TRP  33           HB3      TRP  33 -11.988  -6.438  18.040
  254    HD1  TRP  33           HD1      TRP  33 -15.827  -6.272  17.691
  255    HE1  TRP  33           HE1      TRP  33 -16.780  -4.716  19.462
  256    HE3  TRP  33           HE3      TRP  33 -11.441  -4.562  19.632
  257    HZ2  TRP  33           HZ2      TRP  33 -15.735  -2.839  21.456
  258    HZ3  TRP  33           HZ3      TRP  33 -11.438  -2.795  21.375
  259    HH2  TRP  33           HH2      TRP  33 -13.578  -1.936  22.304
  260    H    GLN  34           H        GLN  34 -10.209  -5.290  15.963
  261    HA   GLN  34           HA       GLN  34  -9.532  -7.518  14.112
  262    HB2  GLN  34           HB2      GLN  34  -8.903  -4.555  13.709
  263    HB3  GLN  34           HB3      GLN  34  -8.356  -5.886  12.678
  264    HG2  GLN  34           HG2      GLN  34 -10.732  -6.356  12.061
  265    HG3  GLN  34           HG3      GLN  34 -11.243  -4.976  13.043
  266   HE21  GLN  34          HE22      GLN  34 -12.165  -4.577  10.677
  267   HE22  GLN  34          HE21      GLN  34 -11.155  -3.573   9.666
  268    H    PHE  35           H        PHE  35  -7.180  -7.778  13.902
  269    HA   PHE  35           HA       PHE  35  -5.665  -6.959  16.316
  270    HB2  PHE  35           HB2      PHE  35  -4.975  -8.874  14.067
  271    HB3  PHE  35           HB3      PHE  35  -3.932  -8.501  15.437
  272    HD1  PHE  35           HD2      PHE  35  -5.147  -8.851  17.837
  273    HD2  PHE  35           HD1      PHE  35  -6.062 -10.944  14.155
  274    HE1  PHE  35           HE2      PHE  35  -6.092 -10.734  19.138
  275    HE2  PHE  35           HE1      PHE  35  -6.971 -12.826  15.485
  276    HZ   PHE  35           HZ       PHE  35  -6.998 -12.730  17.960
  277    HA   PRO  36           HA       PRO  36  -4.053  -3.556  13.999
  278    HB2  PRO  36           HB2      PRO  36  -1.524  -3.196  15.141
  279    HB3  PRO  36           HB3      PRO  36  -3.082  -2.709  15.888
  280    HG2  PRO  36           HG2      PRO  36  -1.487  -5.223  16.380
  281    HG3  PRO  36           HG3      PRO  36  -2.246  -4.137  17.579
  282    HD2  PRO  36           HD2      PRO  36  -3.407  -6.450  16.778
  283    HD3  PRO  36           HD3      PRO  36  -4.401  -4.991  17.085
  284    H    GLN  37           H        GLN  37  -3.082  -3.245  11.983
  285    HA   GLN  37           HA       GLN  37  -0.883  -4.920  11.096
  286    HB2  GLN  37           HB2      GLN  37  -2.133  -6.198   9.426
  287    HB3  GLN  37           HB3      GLN  37  -2.812  -6.501  11.020
  288    HG2  GLN  37           HG2      GLN  37  -4.533  -4.611  10.423
  289    HG3  GLN  37           HG3      GLN  37  -3.951  -4.813   8.767
  290   HE21  GLN  37          HE22      GLN  37  -5.598  -6.439  11.514
  291   HE22  GLN  37          HE21      GLN  37  -6.363  -7.679  10.528
  292    H    GLY  38           H        GLY  38  -0.289  -4.559   8.779
  293    HA2  GLY  38           HA2      GLY  38  -1.634  -2.575   7.205
  294    HA3  GLY  38           HA3      GLY  38  -0.236  -1.862   8.004
  295    H    GLY  39           H        GLY  39  -0.188  -1.857   5.262
  296    HA2  GLY  39           HA2      GLY  39   0.844  -4.221   4.056
  297    HA3  GLY  39           HA3      GLY  39   0.779  -2.596   3.367
  298    H    ILE  40           H        ILE  40   2.875  -4.590   3.373
  299    HA   ILE  40           HA       ILE  40   5.139  -3.373   4.847
  300    HB   ILE  40           HB       ILE  40   5.064  -5.515   2.688
  301   HG12  ILE  40          HG12      ILE  40   5.814  -5.889   5.611
  302   HG13  ILE  40          HG13      ILE  40   4.162  -6.089   5.065
  303   HG21  ILE  40          HG21      ILE  40   7.441  -4.468   4.309
  304   HG22  ILE  40          HG22      ILE  40   7.480  -5.927   3.317
  305   HG23  ILE  40          HG23      ILE  40   7.217  -4.381   2.548
  306   HD11  ILE  40          HD11      ILE  40   6.122  -7.624   3.438
  307   HD12  ILE  40          HD12      ILE  40   5.998  -8.114   5.129
  308   HD13  ILE  40          HD13      ILE  40   4.542  -8.071   4.101
  309    H    ASN  41           H        ASN  41   6.313  -1.662   4.027
  310    HA   ASN  41           HA       ASN  41   5.370  -0.337   1.599
  311    HB2  ASN  41           HB2      ASN  41   7.211   0.336   3.845
  312    HB3  ASN  41           HB3      ASN  41   7.804   0.861   2.282
  313   HD21  ASN  41          HD22      ASN  41   4.626   0.846   4.089
  314   HD22  ASN  41          HD21      ASN  41   4.184   2.446   3.565
  315    HA   PRO  42           HA       PRO  42   7.717  -2.566  -1.286
  316    HB2  PRO  42           HB2      PRO  42   8.707  -0.681  -3.077
  317    HB3  PRO  42           HB3      PRO  42   7.023  -1.285  -3.032
  318    HG2  PRO  42           HG2      PRO  42   8.143   1.241  -1.779
  319    HG3  PRO  42           HG3      PRO  42   6.640   1.049  -2.744
  320    HD2  PRO  42           HD2      PRO  42   6.580   1.123  -0.044
  321    HD3  PRO  42           HD3      PRO  42   5.517  -0.008  -0.934
  322    H    GLY  43           H        GLY  43   9.605  -3.551  -0.895
  323    HA2  GLY  43           HA2      GLY  43  11.862  -3.873  -0.753
  324    HA3  GLY  43           HA3      GLY  43  12.138  -2.131  -0.831
  325    H    GLU  44           H        GLU  44   9.894  -2.655   1.738
  326    HA   GLU  44           HA       GLU  44  12.037  -2.478   3.688
  327    HB2  GLU  44           HB2      GLU  44   9.101  -2.139   3.818
  328    HB3  GLU  44           HB3      GLU  44   9.776  -2.963   5.205
  329    HG2  GLU  44           HG2      GLU  44  10.638  -0.256   4.185
  330    HG3  GLU  44           HG3      GLU  44   9.611  -0.602   5.594
  331    H    SER  45           H        SER  45  12.162  -3.899   5.517
  332    HA   SER  45           HA       SER  45  11.886  -6.769   4.739
  333    HB2  SER  45           HB2      SER  45  13.177  -5.513   7.185
  334    HB3  SER  45           HB3      SER  45  13.196  -7.233   6.750
  335    HG   SER  45           HG       SER  45  15.123  -6.147   6.084
  336    H    ALA  46           H        ALA  46  10.517  -8.205   5.975
  337    HA   ALA  46           HA       ALA  46   8.024  -7.146   6.597
  338    HB1  ALA  46           HB1      ALA  46   9.250  -9.755   7.630
  339    HB2  ALA  46           HB2      ALA  46   7.513  -9.378   7.524
  340    HB3  ALA  46           HB3      ALA  46   8.470  -9.528   6.034
  341    H    GLU  47           H        GLU  47  10.687  -7.925   8.842
  342    HA   GLU  47           HA       GLU  47   9.228  -7.429  11.252
  343    HB2  GLU  47           HB2      GLU  47  11.288  -8.801  10.923
  344    HB3  GLU  47           HB3      GLU  47  12.220  -7.320  10.662
  345    HG2  GLU  47           HG2      GLU  47  11.602  -6.543  12.948
  346    HG3  GLU  47           HG3      GLU  47  10.666  -8.023  13.176
  347    H    GLN  48           H        GLN  48  11.070  -5.342   9.021
  348    HA   GLN  48           HA       GLN  48  11.160  -3.121  10.863
  349    HB2  GLN  48           HB2      GLN  48  11.647  -3.212   7.909
  350    HB3  GLN  48           HB3      GLN  48  11.954  -1.804   8.948
  351    HG2  GLN  48           HG2      GLN  48  13.180  -4.553   9.273
  352    HG3  GLN  48           HG3      GLN  48  13.993  -3.188   8.503
  353   HE21  GLN  48          HE22      GLN  48  15.192  -4.584  10.471
  354   HE22  GLN  48          HE21      GLN  48  15.299  -3.648  11.953
  355    H    ALA  49           H        ALA  49   9.046  -4.128   8.087
  356    HA   ALA  49           HA       ALA  49   7.366  -1.798   8.303
  357    HB1  ALA  49           HB1      ALA  49   6.891  -4.556   7.120
  358    HB2  ALA  49           HB2      ALA  49   5.776  -3.164   6.983
  359    HB3  ALA  49           HB3      ALA  49   7.393  -3.061   6.259
  360    H    MET  50           H        MET  50   7.455  -5.006   9.994
  361    HA   MET  50           HA       MET  50   4.983  -4.639  11.351
  362    HB2  MET  50           HB2      MET  50   6.102  -6.769  11.431
  363    HB3  MET  50           HB3      MET  50   7.512  -6.102  12.225
  364    HG2  MET  50           HG2      MET  50   4.731  -6.176  13.396
  365    HG3  MET  50           HG3      MET  50   5.989  -7.361  13.670
  366    HE1  MET  50           HE1      MET  50   8.679  -5.411  14.119
  367    HE2  MET  50           HE2      MET  50   8.624  -5.626  15.873
  368    HE3  MET  50           HE3      MET  50   8.248  -6.996  14.803
  369    H    TYR  51           H        TYR  51   8.348  -3.504  12.316
  370    HA   TYR  51           HA       TYR  51   7.322  -2.089  14.557
  371    HB2  TYR  51           HB2      TYR  51   9.830  -1.629  12.912
  372    HB3  TYR  51           HB3      TYR  51   9.441  -0.726  14.371
  373    HD1  TYR  51           HD2      TYR  51   8.723  -2.259  16.476
  374    HD2  TYR  51           HD1      TYR  51  11.298  -3.473  13.229
  375    HE1  TYR  51           HE2      TYR  51   9.930  -3.768  18.010
  376    HE2  TYR  51           HE1      TYR  51  12.498  -5.003  14.762
  377    HH   TYR  51           HH       TYR  51  11.756  -5.224  18.275
  378    H    ARG  52           H        ARG  52   7.646  -0.985  11.115
  379    HA   ARG  52           HA       ARG  52   6.866   1.709  11.512
  380    HB2  ARG  52           HB2      ARG  52   7.695   0.604   9.391
  381    HB3  ARG  52           HB3      ARG  52   6.101  -0.156   9.238
  382    HG2  ARG  52           HG2      ARG  52   5.116   2.222   9.303
  383    HG3  ARG  52           HG3      ARG  52   6.787   2.787   9.085
  384    HD2  ARG  52           HD2      ARG  52   6.926   1.212   7.086
  385    HD3  ARG  52           HD3      ARG  52   5.192   0.938   7.236
  386    HE   ARG  52           HE       ARG  52   6.566   3.221   6.160
  387   HH11  ARG  52          HH21      ARG  52   3.447   2.258   7.636
  388   HH12  ARG  52          HH22      ARG  52   2.758   3.850   7.520
  389   HH21  ARG  52          HH11      ARG  52   5.479   5.234   5.692
  390   HH22  ARG  52          HH12      ARG  52   3.835   5.460   6.168
  391    H    GLU  53           H        GLU  53   4.814  -1.227  10.930
  392    HA   GLU  53           HA       GLU  53   2.455   0.363  11.041
  393    HB2  GLU  53           HB2      GLU  53   2.763  -2.626  10.943
  394    HB3  GLU  53           HB3      GLU  53   1.220  -1.759  10.861
  395    HG2  GLU  53           HG2      GLU  53   3.561  -1.455   8.979
  396    HG3  GLU  53           HG3      GLU  53   2.032  -2.237   8.596
  397    H    LEU  54           H        LEU  54   4.264  -1.488  13.444
  398    HA   LEU  54           HA       LEU  54   2.368  -1.516  15.545
  399    HB2  LEU  54           HB2      LEU  54   4.508  -2.715  15.581
  400    HB3  LEU  54           HB3      LEU  54   5.386  -1.185  15.519
  401    HG   LEU  54           HG       LEU  54   4.201  -0.632  17.781
  402   HD11  LEU  54          HD11      LEU  54   4.022  -3.674  17.752
  403   HD12  LEU  54          HD12      LEU  54   3.684  -2.621  19.135
  404   HD13  LEU  54          HD13      LEU  54   2.636  -2.553  17.705
  405   HD21  LEU  54          HD21      LEU  54   6.004  -1.770  19.025
  406   HD22  LEU  54          HD22      LEU  54   6.357  -2.785  17.599
  407   HD23  LEU  54          HD23      LEU  54   6.621  -1.024  17.544
  408    H    PHE  55           H        PHE  55   4.726   1.079  14.519
  409    HA   PHE  55           HA       PHE  55   3.731   2.968  16.432
  410    HB2  PHE  55           HB2      PHE  55   5.908   3.174  15.303
  411    HB3  PHE  55           HB3      PHE  55   5.102   3.453  13.763
  412    HD1  PHE  55           HD2      PHE  55   5.500   4.819  17.230
  413    HD2  PHE  55           HD1      PHE  55   4.359   5.657  13.151
  414    HE1  PHE  55           HE2      PHE  55   5.387   7.240  17.756
  415    HE2  PHE  55           HE1      PHE  55   4.248   8.078  13.682
  416    HZ   PHE  55           HZ       PHE  55   4.760   8.876  15.986
  417    H    GLU  56           H        GLU  56   2.798   2.424  12.949
  418    HA   GLU  56           HA       GLU  56   1.009   4.558  12.829
  419    HB2  GLU  56           HB2      GLU  56   0.988   1.907  11.366
  420    HB3  GLU  56           HB3      GLU  56  -0.052   3.257  10.934
  421    HG2  GLU  56           HG2      GLU  56   2.911   3.818  11.116
  422    HG3  GLU  56           HG3      GLU  56   2.342   2.819   9.789
  423    H    GLU  57           H        GLU  57   0.416   1.217  13.951
  424    HA   GLU  57           HA       GLU  57  -2.476   1.607  14.085
  425    HB2  GLU  57           HB2      GLU  57  -0.619  -0.734  14.732
  426    HB3  GLU  57           HB3      GLU  57  -2.361  -0.811  14.805
  427    HG2  GLU  57           HG2      GLU  57  -0.871  -0.155  12.234
  428    HG3  GLU  57           HG3      GLU  57  -1.282  -1.787  12.746
  429    H    VAL  58           H        VAL  58   0.214   0.905  16.337
  430    HA   VAL  58           HA       VAL  58  -1.635   0.913  18.647
  431    HB   VAL  58           HB       VAL  58   1.314   0.150  18.552
  432   HG11  VAL  58          HG11      VAL  58   0.790  -1.302  20.399
  433   HG12  VAL  58          HG12      VAL  58   0.345   0.369  20.764
  434   HG13  VAL  58          HG13      VAL  58  -0.922  -0.824  20.330
  435   HG21  VAL  58          HG21      VAL  58  -1.089  -1.510  17.723
  436   HG22  VAL  58          HG22      VAL  58   0.412  -1.177  16.812
  437   HG23  VAL  58          HG23      VAL  58   0.457  -2.240  18.229
  438    H    GLY  59           H        GLY  59   1.118   2.602  17.274
  439    HA2  GLY  59           HA2      GLY  59   1.915   4.768  17.723
  440    HA3  GLY  59           HA3      GLY  59   0.879   4.880  19.154
  441    H    LEU  60           H        LEU  60   2.432   1.896  19.115
  442    HA   LEU  60           HA       LEU  60   4.310   2.600  21.227
  443    HB2  LEU  60           HB2      LEU  60   2.601   0.817  21.288
  444    HB3  LEU  60           HB3      LEU  60   3.354   0.037  19.888
  445    HG   LEU  60           HG       LEU  60   5.304  -0.582  21.222
  446   HD11  LEU  60          HD11      LEU  60   5.633   1.191  22.769
  447   HD12  LEU  60          HD12      LEU  60   3.967   1.081  23.373
  448   HD13  LEU  60          HD13      LEU  60   5.132  -0.214  23.725
  449   HD21  LEU  60          HD21      LEU  60   3.157  -1.933  21.191
  450   HD22  LEU  60          HD22      LEU  60   4.000  -2.093  22.737
  451   HD23  LEU  60          HD23      LEU  60   2.576  -1.026  22.592
  452    H    SER  61           H        SER  61   6.540   1.888  21.099
  453    HA   SER  61           HA       SER  61   7.653   1.563  18.357
  454    HB2  SER  61           HB2      SER  61   8.745   3.467  20.469
  455    HB3  SER  61           HB3      SER  61   9.309   3.257  18.798
  456    HG   SER  61           HG       SER  61   7.930   5.111  19.081
  457    H    ARG  62           H        ARG  62   9.980   0.927  18.496
  458    HA   ARG  62           HA       ARG  62  10.301  -1.597  19.441
  459    HB2  ARG  62           HB2      ARG  62  12.595   0.389  19.156
  460    HB3  ARG  62           HB3      ARG  62  12.670  -1.369  19.066
  461    HG2  ARG  62           HG2      ARG  62  10.917  -0.993  17.071
  462    HG3  ARG  62           HG3      ARG  62  11.647   0.606  17.030
  463    HD2  ARG  62           HD2      ARG  62  13.935  -0.538  16.953
  464    HD3  ARG  62           HD3      ARG  62  13.080  -2.073  16.858
  465    HE   ARG  62           HE       ARG  62  12.637  -1.746  14.648
  466   HH11  ARG  62          HH21      ARG  62  13.649   1.412  15.962
  467   HH12  ARG  62          HH22      ARG  62  13.900   2.132  14.415
  468   HH21  ARG  62          HH11      ARG  62  13.156  -0.810  12.567
  469   HH22  ARG  62          HH12      ARG  62  13.561   0.863  12.470
  470    H    LYS  63           H        LYS  63  10.999   1.362  21.275
  471    HA   LYS  63           HA       LYS  63  12.735   0.174  23.186
  472    HB2  LYS  63           HB2      LYS  63  13.057   2.252  23.934
  473    HB3  LYS  63           HB3      LYS  63  12.438   2.616  22.345
  474    HG2  LYS  63           HG2      LYS  63  11.159   4.065  23.628
  475    HG3  LYS  63           HG3      LYS  63  10.086   2.665  23.543
  476    HD2  LYS  63           HD2      LYS  63  10.102   2.846  25.851
  477    HD3  LYS  63           HD3      LYS  63  11.645   1.958  25.680
  478    HE2  LYS  63           HE2      LYS  63  12.880   4.117  25.639
  479    HE3  LYS  63           HE3      LYS  63  11.363   5.000  25.817
  480    HZ1  LYS  63           HZ1      LYS  63  11.083   3.947  27.996
  481    HZ2  LYS  63           HZ2      LYS  63  12.498   3.133  27.836
  482    HZ3  LYS  63           HZ3      LYS  63  12.491   4.761  27.933
  483    H    ASP  64           H        ASP  64   9.166   0.204  23.078
  484    HA   ASP  64           HA       ASP  64   9.319  -0.956  25.829
  485    HB2  ASP  64           HB2      ASP  64   8.168   1.283  25.551
  486    HB3  ASP  64           HB3      ASP  64   6.877   0.400  24.768
  487    H    VAL  65           H        VAL  65   9.661  -2.322  23.164
  488    HA   VAL  65           HA       VAL  65   7.815  -4.546  23.847
  489    HB   VAL  65           HB       VAL  65   7.440  -4.985  21.438
  490   HG11  VAL  65          HG11      VAL  65   5.729  -3.868  22.826
  491   HG12  VAL  65          HG12      VAL  65   6.379  -2.294  22.335
  492   HG13  VAL  65          HG13      VAL  65   5.659  -3.377  21.122
  493   HG21  VAL  65          HG21      VAL  65   8.501  -2.170  20.970
  494   HG22  VAL  65          HG22      VAL  65   9.346  -3.656  20.501
  495   HG23  VAL  65          HG23      VAL  65   7.794  -3.244  19.749
  496    H    ARG  66           H        ARG  66   8.410  -6.604  22.885
  497    HA   ARG  66           HA       ARG  66  11.115  -6.815  21.736
  498    HB2  ARG  66           HB2      ARG  66  11.754  -8.699  23.052
  499    HB3  ARG  66           HB3      ARG  66  11.491  -7.304  24.084
  500    HG2  ARG  66           HG2      ARG  66   9.190  -9.265  23.850
  501    HG3  ARG  66           HG3      ARG  66  10.647  -9.830  24.634
  502    HD2  ARG  66           HD2      ARG  66   9.212  -7.273  25.482
  503    HD3  ARG  66           HD3      ARG  66   8.969  -8.841  26.245
  504    HE   ARG  66           HE       ARG  66  11.261  -7.087  26.496
  505   HH11  ARG  66          HH11      ARG  66  11.104 -10.519  26.826
  506   HH12  ARG  66          HH12      ARG  66  11.119 -10.550  28.555
  507   HH21  ARG  66          HH21      ARG  66  10.693  -7.020  28.775
  508   HH22  ARG  66          HH22      ARG  66  11.016  -8.435  29.734
  509    H    ILE  67           H        ILE  67  11.052  -8.324  19.981
  510    HA   ILE  67           HA       ILE  67   8.465  -9.507  19.316
  511    HB   ILE  67           HB       ILE  67  11.199  -9.847  18.039
  512   HG12  ILE  67          HG12      ILE  67   8.930  -8.173  16.925
  513   HG13  ILE  67          HG13      ILE  67  10.215  -7.480  17.912
  514   HG21  ILE  67          HG21      ILE  67   9.695 -11.763  17.578
  515   HG22  ILE  67          HG22      ILE  67   8.439 -10.649  16.998
  516   HG23  ILE  67          HG23      ILE  67   9.979 -10.834  16.124
  517   HD11  ILE  67          HD11      ILE  67  10.589  -8.913  15.257
  518   HD12  ILE  67          HD12      ILE  67  10.733  -7.183  15.559
  519   HD13  ILE  67          HD13      ILE  67  11.906  -8.298  16.284
  520    H    LEU  68           H        LEU  68   7.836 -11.324  20.180
  521    HA   LEU  68           HA       LEU  68   9.748 -13.136  21.574
  522    HB2  LEU  68           HB2      LEU  68   6.735 -13.134  21.349
  523    HB3  LEU  68           HB3      LEU  68   7.682 -14.206  22.365
  524    HG   LEU  68           HG       LEU  68   7.587 -11.163  22.807
  525   HD11  LEU  68          HD11      LEU  68   5.776 -13.411  23.546
  526   HD12  LEU  68          HD12      LEU  68   6.242 -12.284  24.820
  527   HD13  LEU  68          HD13      LEU  68   5.470 -11.672  23.340
  528   HD21  LEU  68          HD21      LEU  68   9.634 -12.230  23.673
  529   HD22  LEU  68          HD22      LEU  68   8.553 -11.752  24.982
  530   HD23  LEU  68          HD23      LEU  68   8.653 -13.465  24.492
  531    H    ALA  69           H        ALA  69   7.568 -12.910  18.708
  532    HA   ALA  69           HA       ALA  69   8.630 -15.332  17.523
  533    HB1  ALA  69           HB1      ALA  69   6.941 -16.185  19.228
  534    HB2  ALA  69           HB2      ALA  69   5.692 -15.327  18.313
  535    HB3  ALA  69           HB3      ALA  69   6.620 -16.637  17.547
  536    H    SER  70           H        SER  70   7.607 -15.739  15.481
  537    HA   SER  70           HA       SER  70   6.164 -13.599  14.168
  538    HB2  SER  70           HB2      SER  70   7.968 -13.330  12.430
  539    HB3  SER  70           HB3      SER  70   8.348 -12.676  14.036
  540    HG   SER  70           HG       SER  70  10.124 -13.862  13.188
  541    H    THR  71           H        THR  71   5.369 -14.309  11.986
  542    HA   THR  71           HA       THR  71   4.547 -16.992  12.266
  543    HB   THR  71           HB       THR  71   3.824 -16.521   9.752
  544    HG1  THR  71           HG1      THR  71   4.878 -14.607   9.501
  545   HG21  THR  71          HG21      THR  71   1.842 -15.128  10.750
  546   HG22  THR  71          HG22      THR  71   2.009 -16.847  11.105
  547   HG23  THR  71          HG23      THR  71   2.526 -15.670  12.308
  548    H    ARG  72           H        ARG  72   4.965 -18.878  11.374
  549    HA   ARG  72           HA       ARG  72   7.744 -19.247  10.467
  550    HB2  ARG  72           HB2      ARG  72   5.550 -21.266  11.072
  551    HB3  ARG  72           HB3      ARG  72   7.264 -21.617  10.916
  552    HG2  ARG  72           HG2      ARG  72   7.800 -20.806  13.030
  553    HG3  ARG  72           HG3      ARG  72   6.501 -19.625  13.055
  554    HD2  ARG  72           HD2      ARG  72   4.864 -21.602  13.133
  555    HD3  ARG  72           HD3      ARG  72   6.249 -22.598  13.563
  556    HE   ARG  72           HE       ARG  72   4.883 -20.492  15.134
  557   HH11  ARG  72          HH11      ARG  72   7.775 -22.576  15.054
  558   HH12  ARG  72          HH12      ARG  72   7.981 -22.562  16.768
  559   HH21  ARG  72          HH21      ARG  72   5.110 -20.504  17.332
  560   HH22  ARG  72          HH22      ARG  72   6.433 -21.330  18.112
  561    H    ASN  73           H        ASN  73   4.399 -19.457   9.389
  562    HA   ASN  73           HA       ASN  73   5.265 -19.723   6.602
  563    HB2  ASN  73           HB2      ASN  73   3.559 -21.207   6.085
  564    HB3  ASN  73           HB3      ASN  73   4.090 -21.823   7.656
  565   HD21  ASN  73          HD22      ASN  73   2.653 -20.591   9.661
  566   HD22  ASN  73          HD21      ASN  73   0.963 -20.658   9.290
  567    H    TRP  74           H        TRP  74   3.970 -18.512   5.091
  568    HA   TRP  74           HA       TRP  74   2.951 -16.039   6.295
  569    HB2  TRP  74           HB2      TRP  74   3.196 -17.028   3.416
  570    HB3  TRP  74           HB3      TRP  74   2.413 -15.520   3.834
  571    HD1  TRP  74           HD1      TRP  74   5.911 -17.109   3.761
  572    HE1  TRP  74           HE1      TRP  74   7.654 -15.242   3.611
  573    HE3  TRP  74           HE3      TRP  74   2.847 -13.097   4.465
  574    HZ2  TRP  74           HZ2      TRP  74   7.690 -12.372   3.630
  575    HZ3  TRP  74           HZ3      TRP  74   3.744 -10.773   4.361
  576    HH2  TRP  74           HH2      TRP  74   6.173 -10.407   3.940
  577    H    LEU  75           H        LEU  75   0.878 -15.336   6.430
  578    HA   LEU  75           HA       LEU  75  -1.233 -17.396   6.035
  579    HB2  LEU  75           HB2      LEU  75  -1.466 -14.693   7.404
  580    HB3  LEU  75           HB3      LEU  75  -2.614 -16.029   7.414
  581    HG   LEU  75           HG       LEU  75   0.035 -15.764   8.858
  582   HD11  LEU  75          HD11      LEU  75  -2.022 -14.883   9.893
  583   HD12  LEU  75          HD12      LEU  75  -2.781 -16.487   9.819
  584   HD13  LEU  75          HD13      LEU  75  -1.345 -16.225  10.833
  585   HD21  LEU  75          HD21      LEU  75  -0.222 -18.091   9.704
  586   HD22  LEU  75          HD22      LEU  75  -1.490 -18.371   8.479
  587   HD23  LEU  75          HD23      LEU  75   0.196 -18.015   8.002
  588    H    ARG  76           H        ARG  76  -1.222 -17.322   3.728
  589    HA   ARG  76           HA       ARG  76  -1.914 -14.747   2.445
  590    HB2  ARG  76           HB2      ARG  76  -0.405 -16.609   1.425
  591    HB3  ARG  76           HB3      ARG  76  -1.914 -17.492   1.153
  592    HG2  ARG  76           HG2      ARG  76  -2.720 -15.459  -0.205
  593    HG3  ARG  76           HG3      ARG  76  -1.068 -14.816  -0.035
  594    HD2  ARG  76           HD2      ARG  76  -0.251 -17.045  -0.971
  595    HD3  ARG  76           HD3      ARG  76  -1.956 -17.394  -1.385
  596    HE   ARG  76           HE       ARG  76  -1.403 -14.897  -2.495
  597   HH11  ARG  76          HH21      ARG  76  -0.109 -18.187  -2.856
  598   HH12  ARG  76          HH22      ARG  76   0.448 -17.947  -4.476
  599   HH21  ARG  76          HH11      ARG  76  -0.706 -14.596  -4.707
  600   HH22  ARG  76          HH12      ARG  76   0.110 -15.874  -5.529
  601    H    TYR  77           H        TYR  77  -3.981 -14.299   1.640
  602    HA   TYR  77           HA       TYR  77  -6.004 -16.388   1.711
  603    HB2  TYR  77           HB2      TYR  77  -7.685 -15.220   2.946
  604    HB3  TYR  77           HB3      TYR  77  -6.310 -15.620   3.954
  605    HD1  TYR  77           HD1      TYR  77  -4.572 -13.781   4.469
  606    HD2  TYR  77           HD2      TYR  77  -8.485 -12.991   2.820
  607    HE1  TYR  77           HE1      TYR  77  -4.442 -11.488   5.297
  608    HE2  TYR  77           HE2      TYR  77  -8.374 -10.680   3.668
  609    HH   TYR  77           HH       TYR  77  -5.563  -9.401   5.532
  610    H    LYS  78           H        LYS  78  -7.669 -16.028   0.255
  611    HA   LYS  78           HA       LYS  78  -7.351 -13.687  -1.562
  612    HB2  LYS  78           HB2      LYS  78  -8.677 -16.409  -1.873
  613    HB3  LYS  78           HB3      LYS  78  -9.182 -15.032  -2.843
  614    HG2  LYS  78           HG2      LYS  78  -7.646 -16.267  -4.120
  615    HG3  LYS  78           HG3      LYS  78  -6.915 -14.718  -3.698
  616    HD2  LYS  78           HD2      LYS  78  -5.332 -15.696  -2.259
  617    HD3  LYS  78           HD3      LYS  78  -6.294 -17.145  -1.968
  618    HE2  LYS  78           HE2      LYS  78  -5.020 -16.501  -4.663
  619    HE3  LYS  78           HE3      LYS  78  -4.199 -17.420  -3.403
  620    HZ1  LYS  78           HZ1      LYS  78  -5.982 -19.078  -3.529
  621    HZ2  LYS  78           HZ2      LYS  78  -6.729 -18.246  -4.731
  622    HZ3  LYS  78           HZ3      LYS  78  -5.253 -18.892  -4.975
  623    H    LEU  79           H        LEU  79  -9.015 -12.314  -1.843
  624    HA   LEU  79           HA       LEU  79 -11.024 -11.907   0.202
  625    HB2  LEU  79           HB2      LEU  79 -10.812 -10.818  -2.650
  626    HB3  LEU  79           HB3      LEU  79 -11.790 -10.155  -1.352
  627    HG   LEU  79           HG       LEU  79  -8.751 -10.167  -1.525
  628   HD11  LEU  79          HD11      LEU  79  -9.845  -8.651  -3.054
  629   HD12  LEU  79          HD12      LEU  79 -10.810  -7.948  -1.733
  630   HD13  LEU  79          HD13      LEU  79  -9.036  -7.740  -1.762
  631   HD21  LEU  79          HD21      LEU  79  -9.344 -10.479   0.751
  632   HD22  LEU  79          HD22      LEU  79  -8.846  -8.782   0.542
  633   HD23  LEU  79          HD23      LEU  79 -10.577  -9.196   0.688
  634    HA   PRO  80           HA       PRO  80 -14.274 -14.212  -2.043
  635    HB2  PRO  80           HB2      PRO  80 -16.489 -13.065  -0.849
  636    HB3  PRO  80           HB3      PRO  80 -15.477 -14.281   0.005
  637    HG2  PRO  80           HG2      PRO  80 -15.333 -11.278   0.165
  638    HG3  PRO  80           HG3      PRO  80 -15.409 -12.444   1.527
  639    HD2  PRO  80           HD2      PRO  80 -13.033 -11.419   0.678
  640    HD3  PRO  80           HD3      PRO  80 -13.153 -13.133   1.156
  641    H    LYS  81           H        LYS  81 -15.566 -13.410  -3.997
  642    HA   LYS  81           HA       LYS  81 -14.233 -11.094  -4.922
  643    HB2  LYS  81           HB2      LYS  81 -16.475 -12.483  -6.367
  644    HB3  LYS  81           HB3      LYS  81 -15.276 -11.316  -7.014
  645    HG2  LYS  81           HG2      LYS  81 -13.459 -12.858  -6.522
  646    HG3  LYS  81           HG3      LYS  81 -14.632 -14.078  -5.966
  647    HD2  LYS  81           HD2      LYS  81 -15.730 -14.088  -8.164
  648    HD3  LYS  81           HD3      LYS  81 -14.660 -12.780  -8.739
  649    HE2  LYS  81           HE2      LYS  81 -12.694 -14.175  -8.357
  650    HE3  LYS  81           HE3      LYS  81 -13.719 -15.484  -7.732
  651    HZ1  LYS  81           HZ1      LYS  81 -13.117 -15.879 -10.048
  652    HZ2  LYS  81           HZ2      LYS  81 -14.729 -15.660  -9.949
  653    HZ3  LYS  81           HZ3      LYS  81 -13.776 -14.462 -10.528
  654    H    ARG  82           H        ARG  82 -17.215 -11.211  -3.210
  655    HA   ARG  82           HA       ARG  82 -18.273  -8.743  -4.071
  656    HB2  ARG  82           HB2      ARG  82 -19.418  -8.597  -1.956
  657    HB3  ARG  82           HB3      ARG  82 -19.501 -10.225  -2.636
  658    HG2  ARG  82           HG2      ARG  82 -17.555 -10.803  -1.018
  659    HG3  ARG  82           HG3      ARG  82 -17.901  -9.250  -0.238
  660    HD2  ARG  82           HD2      ARG  82 -19.903 -11.492  -0.676
  661    HD3  ARG  82           HD3      ARG  82 -19.033 -11.202   0.842
  662    HE   ARG  82           HE       ARG  82 -20.269  -8.781   0.253
  663   HH11  ARG  82          HH11      ARG  82 -21.369 -12.098   0.913
  664   HH12  ARG  82          HH12      ARG  82 -22.903 -11.617   1.544
  665   HH21  ARG  82          HH21      ARG  82 -22.311  -8.140   1.096
  666   HH22  ARG  82          HH22      ARG  82 -23.443  -9.315   1.656
  667    H    LEU  83           H        LEU  83 -15.444  -9.341  -2.071
  668    HA   LEU  83           HA       LEU  83 -15.268  -6.517  -1.289
  669    HB2  LEU  83           HB2      LEU  83 -13.494  -8.861  -0.570
  670    HB3  LEU  83           HB3      LEU  83 -13.412  -7.249   0.135
  671    HG   LEU  83           HG       LEU  83 -15.711  -9.212   0.413
  672   HD11  LEU  83          HD11      LEU  83 -15.060  -9.441   2.704
  673   HD12  LEU  83          HD12      LEU  83 -13.636  -9.732   1.704
  674   HD13  LEU  83          HD13      LEU  83 -13.809  -8.179   2.540
  675   HD21  LEU  83          HD21      LEU  83 -16.684  -7.647   2.048
  676   HD22  LEU  83          HD22      LEU  83 -15.499  -6.416   1.542
  677   HD23  LEU  83          HD23      LEU  83 -16.717  -7.046   0.394
  678    H    VAL  84           H        VAL  84 -14.095  -8.461  -3.848
  679    HA   VAL  84           HA       VAL  84 -11.484  -7.347  -4.190
  680    HB   VAL  84           HB       VAL  84 -13.498  -8.548  -6.153
  681   HG11  VAL  84          HG11      VAL  84 -10.587  -7.820  -6.592
  682   HG12  VAL  84          HG12      VAL  84 -11.512  -8.910  -7.659
  683   HG13  VAL  84          HG13      VAL  84 -11.992  -7.212  -7.484
  684   HG21  VAL  84          HG21      VAL  84 -12.494 -10.066  -4.315
  685   HG22  VAL  84          HG22      VAL  84 -12.329 -10.582  -6.009
  686   HG23  VAL  84          HG23      VAL  84 -10.945  -9.849  -5.145
  687    H    ARG  85           H        ARG  85 -10.834  -5.417  -5.007
  688    HA   ARG  85           HA       ARG  85 -12.920  -3.520  -5.835
  689    HB2  ARG  85           HB2      ARG  85 -10.454  -3.351  -4.296
  690    HB3  ARG  85           HB3      ARG  85 -10.387  -2.209  -5.640
  691    HG2  ARG  85           HG2      ARG  85 -12.729  -2.466  -3.751
  692    HG3  ARG  85           HG3      ARG  85 -11.399  -1.292  -3.563
  693    HD2  ARG  85           HD2      ARG  85 -11.957  -0.482  -5.930
  694    HD3  ARG  85           HD3      ARG  85 -13.450  -1.402  -5.838
  695    HE   ARG  85           HE       ARG  85 -12.700   1.070  -4.439
  696   HH11  ARG  85          HH21      ARG  85 -15.108  -1.572  -4.462
  697   HH12  ARG  85          HH22      ARG  85 -16.306  -0.646  -3.638
  698   HH21  ARG  85          HH11      ARG  85 -14.287   2.256  -3.323
  699   HH22  ARG  85          HH12      ARG  85 -15.822   1.561  -2.953
  700    H    TRP  86           H        TRP  86 -13.387  -4.225  -7.786
  701    HA   TRP  86           HA       TRP  86 -11.522  -4.645  -9.904
  702    HB2  TRP  86           HB2      TRP  86 -14.504  -4.049  -9.816
  703    HB3  TRP  86           HB3      TRP  86 -13.647  -4.559 -11.278
  704    HD1  TRP  86           HD1      TRP  86 -15.469  -5.930  -8.386
  705    HE1  TRP  86           HE1      TRP  86 -15.181  -8.443  -8.181
  706    HE3  TRP  86           HE3      TRP  86 -11.653  -6.558 -11.721
  707    HZ2  TRP  86           HZ2      TRP  86 -13.379 -10.491  -9.195
  708    HZ3  TRP  86           HZ3      TRP  86 -10.660  -8.814 -12.094
  709    HH2  TRP  86           HH2      TRP  86 -11.508 -10.777 -10.829
  710    H    ASP  87           H        ASP  87 -12.907  -1.743  -8.505
  711    HA   ASP  87           HA       ASP  87 -12.985  -0.159 -10.902
  712    HB2  ASP  87           HB2      ASP  87 -14.448   0.257  -8.994
  713    HB3  ASP  87           HB3      ASP  87 -13.053   0.611  -7.968
  714    H    THR  88           H        THR  88 -10.441  -0.809  -8.569
  715    HA   THR  88           HA       THR  88  -8.834   1.440  -9.577
  716    HB   THR  88           HB       THR  88  -9.345   1.239  -7.118
  717    HG1  THR  88           HG1      THR  88  -7.387   2.089  -6.650
  718   HG21  THR  88          HG21      THR  88  -7.148  -0.873  -7.099
  719   HG22  THR  88          HG22      THR  88  -8.127  -0.273  -5.734
  720   HG23  THR  88          HG23      THR  88  -8.867  -1.281  -6.987
  721    H    LYS  89           H        LYS  89  -6.424   0.898  -9.749
  722    HA   LYS  89           HA       LYS  89  -6.016  -1.716 -10.973
  723    HB2  LYS  89           HB2      LYS  89  -5.087   0.936 -12.128
  724    HB3  LYS  89           HB3      LYS  89  -4.750  -0.654 -12.800
  725    HG2  LYS  89           HG2      LYS  89  -7.532   0.534 -12.467
  726    HG3  LYS  89           HG3      LYS  89  -6.565   0.650 -13.945
  727    HD2  LYS  89           HD2      LYS  89  -6.593  -1.817 -14.198
  728    HD3  LYS  89           HD3      LYS  89  -7.487  -1.971 -12.687
  729    HE2  LYS  89           HE2      LYS  89  -9.067  -2.217 -14.447
  730    HE3  LYS  89           HE3      LYS  89  -9.380  -0.675 -13.652
  731    HZ1  LYS  89           HZ1      LYS  89  -7.906  -0.994 -16.221
  732    HZ2  LYS  89           HZ2      LYS  89  -9.461  -0.520 -16.077
  733    HZ3  LYS  89           HZ3      LYS  89  -8.277   0.440 -15.510
  734    HA   PRO  90           HA       PRO  90  -4.625  -3.134 -11.165
  735    HB2  PRO  90           HB2      PRO  90  -3.106  -4.667  -9.184
  736    HB3  PRO  90           HB3      PRO  90  -2.971  -4.633 -10.972
  737    HG2  PRO  90           HG2      PRO  90  -1.040  -3.528  -9.344
  738    HG3  PRO  90           HG3      PRO  90  -1.504  -2.800 -10.934
  739    HD2  PRO  90           HD2      PRO  90  -2.478  -1.996  -8.189
  740    HD3  PRO  90           HD3      PRO  90  -1.828  -0.969  -9.512
  741    H    VAL  91           H        VAL  91  -6.044  -4.880 -10.515
  742    HA   VAL  91           HA       VAL  91  -7.669  -4.319  -8.198
  743    HB   VAL  91           HB       VAL  91  -7.505  -6.659 -10.171
  744   HG11  VAL  91          HG11      VAL  91  -9.718  -6.029  -8.185
  745   HG12  VAL  91          HG12      VAL  91  -9.796  -7.254  -9.465
  746   HG13  VAL  91          HG13      VAL  91  -8.635  -7.429  -8.145
  747   HG21  VAL  91          HG21      VAL  91  -8.047  -4.591 -11.334
  748   HG22  VAL  91          HG22      VAL  91  -9.493  -5.601 -11.236
  749   HG23  VAL  91          HG23      VAL  91  -9.300  -4.208 -10.146
  750    H    CYS  92           H        CYS  92  -7.555  -5.123  -6.218
  751    HA   CYS  92           HA       CYS  92  -5.402  -7.008  -5.529
  752    HB2  CYS  92           HB2      CYS  92  -6.229  -6.493  -3.190
  753    HB3  CYS  92           HB3      CYS  92  -5.535  -5.131  -4.094
  754    HG   CYS  92           HG       CYS  92  -7.501  -4.224  -2.654
  755    H    ILE  93           H        ILE  93  -5.868  -9.188  -5.458
  756    HA   ILE  93           HA       ILE  93  -8.690  -9.912  -4.756
  757    HB   ILE  93           HB       ILE  93  -8.755 -11.760  -6.036
  758   HG12  ILE  93          HG12      ILE  93  -6.637 -12.843  -5.694
  759   HG13  ILE  93          HG13      ILE  93  -6.996 -12.752  -7.413
  760   HG21  ILE  93          HG21      ILE  93  -8.495 -11.028  -8.336
  761   HG22  ILE  93          HG22      ILE  93  -9.110  -9.721  -7.320
  762   HG23  ILE  93          HG23      ILE  93  -7.413  -9.708  -7.844
  763   HD11  ILE  93          HD11      ILE  93  -4.912 -11.216  -5.844
  764   HD12  ILE  93          HD12      ILE  93  -4.694 -12.300  -7.217
  765   HD13  ILE  93          HD13      ILE  93  -5.411 -10.709  -7.488
  766    H    GLY  94           H        GLY  94  -5.423 -10.045  -3.712
  767    HA2  GLY  94           HA2      GLY  94  -6.233 -11.510  -1.360
  768    HA3  GLY  94           HA3      GLY  94  -5.163 -12.447  -2.417
  769    H    GLN  95           H        GLN  95  -4.026 -12.108  -0.206
  770    HA   GLN  95           HA       GLN  95  -1.816 -10.285  -0.665
  771    HB2  GLN  95           HB2      GLN  95  -2.026  -9.284   1.667
  772    HB3  GLN  95           HB3      GLN  95  -3.132  -8.674   0.450
  773    HG2  GLN  95           HG2      GLN  95  -4.002 -10.856   2.369
  774    HG3  GLN  95           HG3      GLN  95  -4.021  -9.159   2.849
  775   HE21  GLN  95          HE22      GLN  95  -5.991 -11.576   1.452
  776   HE22  GLN  95          HE21      GLN  95  -7.157 -10.482   0.750
  777    H    LYS  96           H        LYS  96  -0.032 -10.762   0.792
  778    HA   LYS  96           HA       LYS  96  -0.290 -13.417   2.173
  779    HB2  LYS  96           HB2      LYS  96   2.108 -13.735   1.901
  780    HB3  LYS  96           HB3      LYS  96   1.276 -13.659   0.355
  781    HG2  LYS  96           HG2      LYS  96   2.021 -11.329   0.041
  782    HG3  LYS  96           HG3      LYS  96   2.913 -11.388   1.568
  783    HD2  LYS  96           HD2      LYS  96   3.433 -13.205  -0.821
  784    HD3  LYS  96           HD3      LYS  96   4.302 -11.701  -0.488
  785    HE2  LYS  96           HE2      LYS  96   5.107 -12.629   1.688
  786    HE3  LYS  96           HE3      LYS  96   4.262 -14.144   1.360
  787    HZ1  LYS  96           HZ1      LYS  96   6.476 -13.033  -0.293
  788    HZ2  LYS  96           HZ2      LYS  96   6.590 -14.304   0.732
  789    HZ3  LYS  96           HZ3      LYS  96   5.682 -14.430  -0.618
  790    H    GLN  97           H        GLN  97  -0.231 -13.214   4.394
  791    HA   GLN  97           HA       GLN  97   0.693 -10.577   5.405
  792    HB2  GLN  97           HB2      GLN  97  -1.776 -11.091   5.370
  793    HB3  GLN  97           HB3      GLN  97  -1.474 -12.319   6.604
  794    HG2  GLN  97           HG2      GLN  97  -0.588 -10.581   8.131
  795    HG3  GLN  97           HG3      GLN  97  -0.667  -9.384   6.855
  796   HE21  GLN  97          HE22      GLN  97  -2.186  -7.949   7.698
  797   HE22  GLN  97          HE21      GLN  97  -3.837  -8.388   8.076
  798    H    LYS  98           H        LYS  98   2.268 -10.533   6.846
  799    HA   LYS  98           HA       LYS  98   3.101 -13.048   8.224
  800    HB2  LYS  98           HB2      LYS  98   4.565 -10.858   7.016
  801    HB3  LYS  98           HB3      LYS  98   4.780 -10.726   8.772
  802    HG2  LYS  98           HG2      LYS  98   5.713 -12.803   8.980
  803    HG3  LYS  98           HG3      LYS  98   5.103 -13.358   7.382
  804    HD2  LYS  98           HD2      LYS  98   6.759 -11.593   6.452
  805    HD3  LYS  98           HD3      LYS  98   7.531 -11.695   8.040
  806    HE2  LYS  98           HE2      LYS  98   6.907 -14.170   6.334
  807    HE3  LYS  98           HE3      LYS  98   8.376 -13.235   6.103
  808    HZ1  LYS  98           HZ1      LYS  98   7.647 -14.638   8.635
  809    HZ2  LYS  98           HZ2      LYS  98   8.798 -15.080   7.574
  810    HZ3  LYS  98           HZ3      LYS  98   8.994 -13.713   8.427
  811    H    TRP  99           H        TRP  99   3.285 -12.979  10.572
  812    HA   TRP  99           HA       TRP  99   2.132 -10.579  11.881
  813    HB2  TRP  99           HB2      TRP  99   1.233 -13.443  12.313
  814    HB3  TRP  99           HB3      TRP  99   0.934 -12.129  13.450
  815    HD1  TRP  99           HD1      TRP  99  -0.054 -13.320   9.956
  816    HE1  TRP  99           HE1      TRP  99  -2.247 -12.173   9.278
  817    HE3  TRP  99           HE3      TRP  99  -0.495 -10.057  13.870
  818    HZ2  TRP  99           HZ2      TRP  99  -3.903 -10.011  10.251
  819    HZ3  TRP  99           HZ3      TRP  99  -2.303  -8.368  13.895
  820    HH2  TRP  99           HH2      TRP  99  -4.007  -8.334  12.085
  821    H    PHE 100           H        PHE 100   2.882 -10.253  14.042
  822    HA   PHE 100           HA       PHE 100   5.192 -11.929  14.894
  823    HB2  PHE 100           HB2      PHE 100   4.973  -8.902  14.671
  824    HB3  PHE 100           HB3      PHE 100   6.230  -9.736  15.569
  825    HD1  PHE 100           HD1      PHE 100   4.786  -9.394  12.103
  826    HD2  PHE 100           HD2      PHE 100   8.231 -10.326  14.527
  827    HE1  PHE 100           HE1      PHE 100   6.237  -9.429  10.074
  828    HE2  PHE 100           HE2      PHE 100   9.651 -10.394  12.501
  829    HZ   PHE 100           HZ       PHE 100   8.649  -9.971  10.263
  830    H    LEU 101           H        LEU 101   5.063 -12.442  17.036
  831    HA   LEU 101           HA       LEU 101   2.982 -11.100  18.696
  832    HB2  LEU 101           HB2      LEU 101   2.685 -13.406  19.012
  833    HB3  LEU 101           HB3      LEU 101   4.422 -13.725  18.948
  834    HG   LEU 101           HG       LEU 101   4.683 -12.609  21.158
  835   HD11  LEU 101          HD11      LEU 101   1.679 -12.667  21.469
  836   HD12  LEU 101          HD12      LEU 101   2.937 -11.942  22.525
  837   HD13  LEU 101          HD13      LEU 101   2.555 -11.191  20.997
  838   HD21  LEU 101          HD21      LEU 101   3.824 -14.433  22.502
  839   HD22  LEU 101          HD22      LEU 101   2.734 -14.935  21.188
  840   HD23  LEU 101          HD23      LEU 101   4.493 -15.081  20.995
  841    H    LEU 102           H        LEU 102   3.699  -9.468  19.893
  842    HA   LEU 102           HA       LEU 102   6.524  -9.457  20.790
  843    HB2  LEU 102           HB2      LEU 102   4.597  -7.259  19.964
  844    HB3  LEU 102           HB3      LEU 102   5.907  -6.916  21.086
  845    HG   LEU 102           HG       LEU 102   7.541  -7.454  19.449
  846   HD11  LEU 102          HD11      LEU 102   5.247  -8.284  17.667
  847   HD12  LEU 102          HD12      LEU 102   6.812  -7.778  17.002
  848   HD13  LEU 102          HD13      LEU 102   6.748  -9.181  18.069
  849   HD21  LEU 102          HD21      LEU 102   5.459  -5.728  18.067
  850   HD22  LEU 102          HD22      LEU 102   6.354  -5.186  19.498
  851   HD23  LEU 102          HD23      LEU 102   7.237  -5.572  18.010
  852    H    GLN 103           H        GLN 103   6.791  -8.717  22.985
  853    HA   GLN 103           HA       GLN 103   4.264  -8.864  24.626
  854    HB2  GLN 103           HB2      GLN 103   5.360 -10.511  25.421
  855    HB3  GLN 103           HB3      GLN 103   6.982  -9.809  25.308
  856    HG2  GLN 103           HG2      GLN 103   6.695  -8.725  27.399
  857    HG3  GLN 103           HG3      GLN 103   4.991  -8.401  27.113
  858   HE21  GLN 103          HE22      GLN 103   3.385 -10.197  27.292
  859   HE22  GLN 103          HE21      GLN 103   3.743 -11.481  28.440
  860    H    LEU 104           H        LEU 104   3.660  -6.884  25.510
  861    HA   LEU 104           HA       LEU 104   5.146  -4.457  25.028
  862    HB2  LEU 104           HB2      LEU 104   2.502  -5.300  26.004
  863    HB3  LEU 104           HB3      LEU 104   3.179  -4.141  27.121
  864    HG   LEU 104           HG       LEU 104   3.138  -3.663  24.122
  865   HD11  LEU 104          HD11      LEU 104   1.057  -2.719  26.116
  866   HD12  LEU 104          HD12      LEU 104   1.134  -2.343  24.380
  867   HD13  LEU 104          HD13      LEU 104   0.804  -4.001  24.912
  868   HD21  LEU 104          HD21      LEU 104   3.614  -1.914  26.573
  869   HD22  LEU 104          HD22      LEU 104   4.691  -2.226  25.205
  870   HD23  LEU 104          HD23      LEU 104   3.243  -1.235  24.980
  871    H    VAL 105           H        VAL 105   6.427  -3.272  26.505
  872    HA   VAL 105           HA       VAL 105   7.636  -5.030  28.500
  873    HB   VAL 105           HB       VAL 105   8.438  -2.378  27.309
  874   HG11  VAL 105          HG11      VAL 105  10.017  -4.055  29.293
  875   HG12  VAL 105          HG12      VAL 105  10.662  -2.690  28.349
  876   HG13  VAL 105          HG13      VAL 105   9.393  -2.408  29.544
  877   HG21  VAL 105          HG21      VAL 105  10.049  -3.560  26.026
  878   HG22  VAL 105          HG22      VAL 105   9.871  -5.038  27.011
  879   HG23  VAL 105          HG23      VAL 105   8.593  -4.543  25.897
  880    H    SER 106           H        SER 106   6.039  -1.814  28.442
  881    HA   SER 106           HA       SER 106   6.073  -1.730  31.392
  882    HB2  SER 106           HB2      SER 106   5.006   0.184  29.292
  883    HB3  SER 106           HB3      SER 106   5.014   0.472  31.048
  884    HG   SER 106           HG       SER 106   7.192   0.288  29.257
  885    H    GLY 107           H        GLY 107   3.706  -2.400  28.804
  886    HA2  GLY 107           HA2      GLY 107   1.944  -4.042  29.631
  887    HA3  GLY 107           HA3      GLY 107   1.602  -2.850  30.890
  888    H    ASP 108           H        ASP 108  -0.530  -3.368  29.563
  889    HA   ASP 108           HA       ASP 108  -1.011  -2.394  27.043
  890    HB2  ASP 108           HB2      ASP 108  -3.299  -2.624  27.518
  891    HB3  ASP 108           HB3      ASP 108  -2.458  -3.902  28.406
  892    H    ALA 109           H        ALA 109  -0.754  -0.579  29.972
  893    HA   ALA 109           HA       ALA 109  -2.148   1.784  29.343
  894    HB1  ALA 109           HB1      ALA 109  -0.497   2.899  30.853
  895    HB2  ALA 109           HB2      ALA 109  -1.173   1.411  31.553
  896    HB3  ALA 109           HB3      ALA 109   0.464   1.407  30.858
  897    H    GLU 110           H        GLU 110   1.055   0.700  28.229
  898    HA   GLU 110           HA       GLU 110   1.603   3.122  26.801
  899    HB2  GLU 110           HB2      GLU 110   3.037   0.531  27.388
  900    HB3  GLU 110           HB3      GLU 110   3.607   1.524  26.045
  901    HG2  GLU 110           HG2      GLU 110   4.759   1.989  28.142
  902    HG3  GLU 110           HG3      GLU 110   4.000   3.393  27.404
  903    H    ILE 111           H        ILE 111  -0.806   2.372  25.893
  904    HA   ILE 111           HA       ILE 111  -0.160   1.869  23.042
  905    HB   ILE 111           HB       ILE 111  -2.674   0.814  24.418
  906   HG12  ILE 111          HG12      ILE 111  -0.499  -0.841  23.061
  907   HG13  ILE 111          HG13      ILE 111  -0.505  -0.549  24.800
  908   HG21  ILE 111          HG21      ILE 111  -3.063  -0.176  22.092
  909   HG22  ILE 111          HG22      ILE 111  -3.233   1.562  22.246
  910   HG23  ILE 111          HG23      ILE 111  -1.763   0.889  21.520
  911   HD11  ILE 111          HD11      ILE 111  -2.760  -1.927  23.315
  912   HD12  ILE 111          HD12      ILE 111  -1.515  -2.703  24.307
  913   HD13  ILE 111          HD13      ILE 111  -2.695  -1.604  25.048
  914    H    ASN 112           H        ASN 112  -0.928   3.476  21.751
  915    HA   ASN 112           HA       ASN 112  -2.467   5.685  23.093
  916    HB2  ASN 112           HB2      ASN 112  -0.150   6.287  22.648
  917    HB3  ASN 112           HB3      ASN 112  -0.302   5.793  20.962
  918   HD21  ASN 112          HD22      ASN 112   0.154   7.896  20.074
  919   HD22  ASN 112          HD21      ASN 112  -1.002   9.193  20.207
  920    H    MET 113           H        MET 113  -1.870   4.251  19.854
  921    HA   MET 113           HA       MET 113  -3.128   3.831  18.085
  922    HB2  MET 113           HB2      MET 113  -5.700   4.229  19.608
  923    HB3  MET 113           HB3      MET 113  -5.354   3.217  18.208
  924    HG2  MET 113           HG2      MET 113  -3.617   2.075  19.863
  925    HG3  MET 113           HG3      MET 113  -4.644   2.810  21.094
  926    HE1  MET 113           HE1      MET 113  -5.162  -1.093  18.978
  927    HE2  MET 113           HE2      MET 113  -4.180   0.248  18.331
  928    HE3  MET 113           HE3      MET 113  -3.832  -0.418  19.948
  929    H    GLN 114           H        GLN 114  -2.540   6.793  18.907
  930    HA   GLN 114           HA       GLN 114  -3.870   7.935  16.617
  931    HB2  GLN 114           HB2      GLN 114  -4.730   9.872  17.825
  932    HB3  GLN 114           HB3      GLN 114  -5.644   8.375  18.016
  933    HG2  GLN 114           HG2      GLN 114  -4.709   8.011  20.262
  934    HG3  GLN 114           HG3      GLN 114  -3.757   9.489  20.127
  935   HE21  GLN 114          HE22      GLN 114  -4.961  11.596  19.938
  936   HE22  GLN 114          HE21      GLN 114  -6.556  11.716  20.639
  937    H    THR 115           H        THR 115  -1.744   7.654  16.189
  938    HA   THR 115           HA       THR 115   0.325   9.492  17.107
  939    HB   THR 115           HB       THR 115   1.289   8.465  14.859
  940    HG1  THR 115           HG1      THR 115   0.367   6.334  14.563
  941   HG21  THR 115          HG21      THR 115   2.109   7.948  17.177
  942   HG22  THR 115          HG22      THR 115   0.784   6.773  17.367
  943   HG23  THR 115          HG23      THR 115   2.085   6.490  16.175
  944    H    SER 116           H        SER 116  -1.356   8.806  14.100
  945    HA   SER 116           HA       SER 116  -1.235  11.401  12.895
  946    HB2  SER 116           HB2      SER 116  -3.257   9.148  12.515
  947    HB3  SER 116           HB3      SER 116  -2.979  10.502  11.402
  948    HG   SER 116           HG       SER 116  -1.824   8.608  10.760
  949    H    SER 117           H        SER 117  -3.158  12.853  12.493
  950    HA   SER 117           HA       SER 117  -4.320  13.799  14.880
  951    HB2  SER 117           HB2      SER 117  -5.801  14.999  13.079
  952    HB3  SER 117           HB3      SER 117  -4.056  15.334  13.161
  953    HG   SER 117           HG       SER 117  -4.788  14.961  11.005
  954    H    THR 118           H        THR 118  -5.521  11.618  12.320
  955    HA   THR 118           HA       THR 118  -8.009  11.083  13.713
  956    HB   THR 118           HB       THR 118  -7.688   9.170  11.801
  957    HG1  THR 118           HG1      THR 118  -7.089  10.267   9.923
  958   HG21  THR 118          HG21      THR 118  -9.491  10.393  10.685
  959   HG22  THR 118          HG22      THR 118  -9.698  10.237  12.440
  960   HG23  THR 118          HG23      THR 118  -9.161  11.797  11.748
  961    HA   PRO 119           HA       PRO 119  -6.126   7.666  15.956
  962    HB2  PRO 119           HB2      PRO 119  -9.016   6.930  16.347
  963    HB3  PRO 119           HB3      PRO 119  -7.717   7.042  17.571
  964    HG2  PRO 119           HG2      PRO 119  -9.644   8.974  17.367
  965    HG3  PRO 119           HG3      PRO 119  -7.934   9.413  17.695
  966    HD2  PRO 119           HD2      PRO 119  -9.420   9.491  15.049
  967    HD3  PRO 119           HD3      PRO 119  -8.283  10.689  15.757
  968    H    GLU 120           H        GLU 120  -5.716   5.581  15.181
  969    HA   GLU 120           HA       GLU 120  -7.163   4.690  12.755
  970    HB2  GLU 120           HB2      GLU 120  -4.752   3.564  14.227
  971    HB3  GLU 120           HB3      GLU 120  -5.566   2.694  12.931
  972    HG2  GLU 120           HG2      GLU 120  -4.249   5.419  12.699
  973    HG3  GLU 120           HG3      GLU 120  -3.655   3.901  12.035
  974    H    PHE 121           H        PHE 121  -7.482   4.266  16.177
  975    HA   PHE 121           HA       PHE 121  -9.472   2.125  15.655
  976    HB2  PHE 121           HB2      PHE 121  -7.524   2.232  17.960
  977    HB3  PHE 121           HB3      PHE 121  -8.922   1.174  17.872
  978    HD1  PHE 121           HD1      PHE 121  -9.031  -0.687  16.256
  979    HD2  PHE 121           HD2      PHE 121  -5.531   1.810  16.506
  980    HE1  PHE 121           HE1      PHE 121  -7.785  -2.321  14.879
  981    HE2  PHE 121           HE2      PHE 121  -4.276   0.158  15.197
  982    HZ   PHE 121           HZ       PHE 121  -5.395  -1.899  14.345
  983    H    ASP 122           H        ASP 122 -11.335   2.246  16.735
  984    HA   ASP 122           HA       ASP 122 -12.130   4.846  17.893
  985    HB2  ASP 122           HB2      ASP 122 -13.653   3.863  16.291
  986    HB3  ASP 122           HB3      ASP 122 -13.612   2.304  17.113
  987    H    GLY 123           H        GLY 123 -11.399   1.480  18.847
  988    HA2  GLY 123           HA2      GLY 123 -11.538   2.188  21.694
  989    HA3  GLY 123           HA3      GLY 123 -12.724   0.991  21.116
  990    H    TRP 124           H        TRP 124 -10.677   0.445  23.041
  991    HA   TRP 124           HA       TRP 124  -9.168  -1.663  21.586
  992    HB2  TRP 124           HB2      TRP 124  -7.271  -1.345  22.938
  993    HB3  TRP 124           HB3      TRP 124  -7.684   0.245  22.325
  994    HD1  TRP 124           HD1      TRP 124  -8.271   2.105  24.143
  995    HE1  TRP 124           HE1      TRP 124  -8.259   2.197  26.699
  996    HE3  TRP 124           HE3      TRP 124  -7.607  -2.833  25.086
  997    HZ2  TRP 124           HZ2      TRP 124  -8.102   0.254  28.927
  998    HZ3  TRP 124           HZ3      TRP 124  -7.619  -3.724  27.431
  999    HH2  TRP 124           HH2      TRP 124  -7.862  -2.162  29.335
 1000    H    ARG 125           H        ARG 125  -8.995  -3.669  22.750
 1001    HA   ARG 125           HA       ARG 125 -10.071  -3.807  25.448
 1002    HB2  ARG 125           HB2      ARG 125 -11.668  -5.562  25.079
 1003    HB3  ARG 125           HB3      ARG 125 -12.097  -4.171  24.098
 1004    HG2  ARG 125           HG2      ARG 125 -10.963  -5.364  22.127
 1005    HG3  ARG 125           HG3      ARG 125 -10.887  -6.804  23.139
 1006    HD2  ARG 125           HD2      ARG 125 -13.449  -5.265  22.515
 1007    HD3  ARG 125           HD3      ARG 125 -12.873  -6.639  21.573
 1008    HE   ARG 125           HE       ARG 125 -13.117  -7.237  24.413
 1009   HH11  ARG 125          HH11      ARG 125 -15.044  -6.922  21.431
 1010   HH12  ARG 125          HH12      ARG 125 -16.283  -8.005  21.959
 1011   HH21  ARG 125          HH21      ARG 125 -14.792  -8.677  25.107
 1012   HH22  ARG 125          HH22      ARG 125 -16.066  -9.111  24.025
 1013    H    TRP 126           H        TRP 126  -9.592  -6.076  26.344
 1014    HA   TRP 126           HA       TRP 126  -7.335  -7.373  24.927
 1015    HB2  TRP 126           HB2      TRP 126  -7.330  -6.127  27.645
 1016    HB3  TRP 126           HB3      TRP 126  -6.601  -7.723  27.501
 1017    HD1  TRP 126           HD1      TRP 126  -6.248  -4.290  25.689
 1018    HE1  TRP 126           HE1      TRP 126  -3.805  -3.794  25.332
 1019    HE3  TRP 126           HE3      TRP 126  -4.377  -8.780  27.127
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.278  -5.213  25.584
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.969  -9.228  26.984
 1022    HH2  TRP 126           HH2      TRP 126  -0.378  -7.421  26.278
 1023    H    VAL 127           H        VAL 127  -7.560  -9.570  24.869
 1024    HA   VAL 127           HA       VAL 127  -9.903 -10.824  26.237
 1025    HB   VAL 127           HB       VAL 127 -10.297 -11.835  23.853
 1026   HG11  VAL 127          HG11      VAL 127 -11.036  -8.940  24.483
 1027   HG12  VAL 127          HG12      VAL 127 -11.833  -9.950  23.265
 1028   HG13  VAL 127          HG13      VAL 127 -11.927 -10.398  24.972
 1029   HG21  VAL 127          HG21      VAL 127  -8.963  -9.264  22.935
 1030   HG22  VAL 127          HG22      VAL 127  -8.303 -10.909  22.749
 1031   HG23  VAL 127          HG23      VAL 127  -9.812 -10.465  21.941
 1032    H    SER 128           H        SER 128  -9.843 -13.198  26.208
 1033    HA   SER 128           HA       SER 128  -7.225 -14.409  26.258
 1034    HB2  SER 128           HB2      SER 128 -10.007 -15.618  25.987
 1035    HB3  SER 128           HB3      SER 128  -8.532 -16.485  26.492
 1036    HG   SER 128           HG       SER 128  -9.825 -15.811  28.299
 1037    H    TYR 129           H        TYR 129  -6.209 -15.698  24.594
 1038    HA   TYR 129           HA       TYR 129  -6.466 -14.631  22.068
 1039    HB2  TYR 129           HB2      TYR 129  -5.111 -16.845  21.412
 1040    HB3  TYR 129           HB3      TYR 129  -4.433 -15.472  22.236
 1041    HD1  TYR 129           HD1      TYR 129  -6.328 -18.571  23.322
 1042    HD2  TYR 129           HD2      TYR 129  -2.839 -16.071  23.820
 1043    HE1  TYR 129           HE1      TYR 129  -5.602 -19.972  25.224
 1044    HE2  TYR 129           HE2      TYR 129  -2.091 -17.519  25.692
 1045    HH   TYR 129           HH       TYR 129  -2.606 -19.319  27.103
 1046    H    TRP 130           H        TRP 130  -8.368 -17.471  23.146
 1047    HA   TRP 130           HA       TRP 130  -9.010 -18.063  20.332
 1048    HB2  TRP 130           HB2      TRP 130 -10.093 -19.335  22.853
 1049    HB3  TRP 130           HB3      TRP 130 -10.287 -19.923  21.205
 1050    HD1  TRP 130           HD1      TRP 130  -8.496 -20.887  24.044
 1051    HE1  TRP 130           HE1      TRP 130  -6.242 -22.004  23.583
 1052    HE3  TRP 130           HE3      TRP 130  -7.865 -19.524  19.121
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.344 -22.161  21.453
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.824 -20.212  17.904
 1055    HH2  TRP 130           HH2      TRP 130  -4.033 -21.487  19.067
 1056    H    TYR 131           H        TYR 131 -10.394 -16.033  22.808
 1057    HA   TYR 131           HA       TYR 131 -13.121 -16.170  21.990
 1058    HB2  TYR 131           HB2      TYR 131 -12.556 -15.286  24.107
 1059    HB3  TYR 131           HB3      TYR 131 -11.521 -14.041  23.420
 1060    HD1  TYR 131           HD1      TYR 131 -12.459 -12.034  22.344
 1061    HD2  TYR 131           HD2      TYR 131 -15.031 -15.046  24.057
 1062    HE1  TYR 131           HE1      TYR 131 -14.353 -10.455  22.271
 1063    HE2  TYR 131           HE2      TYR 131 -16.932 -13.473  23.980
 1064    HH   TYR 131           HH       TYR 131 -17.655 -11.304  23.405
 1065    HA   PRO 132           HA       PRO 132 -12.393 -12.283  19.260
 1066    HB2  PRO 132           HB2      PRO 132  -9.987 -12.015  17.903
 1067    HB3  PRO 132           HB3      PRO 132 -10.367 -11.268  19.485
 1068    HG2  PRO 132           HG2      PRO 132  -8.887 -13.857  19.005
 1069    HG3  PRO 132           HG3      PRO 132  -8.404 -12.468  20.039
 1070    HD2  PRO 132           HD2      PRO 132  -9.608 -14.573  21.109
 1071    HD3  PRO 132           HD3      PRO 132 -10.128 -12.950  21.627
 1072    H    VAL 133           H        VAL 133 -11.028 -15.424  18.497
 1073    HA   VAL 133           HA       VAL 133 -11.399 -15.410  15.661
 1074    HB   VAL 133           HB       VAL 133 -11.334 -17.773  17.587
 1075   HG11  VAL 133          HG11      VAL 133 -10.482 -17.615  14.662
 1076   HG12  VAL 133          HG12      VAL 133 -10.433 -19.046  15.729
 1077   HG13  VAL 133          HG13      VAL 133 -11.980 -18.363  15.257
 1078   HG21  VAL 133          HG21      VAL 133  -9.313 -16.422  18.035
 1079   HG22  VAL 133          HG22      VAL 133  -8.878 -17.879  17.162
 1080   HG23  VAL 133          HG23      VAL 133  -8.969 -16.331  16.294
 1081    H    ARG 134           H        ARG 134 -13.597 -15.873  18.415
 1082    HA   ARG 134           HA       ARG 134 -15.597 -17.398  17.037
 1083    HB2  ARG 134           HB2      ARG 134 -15.942 -15.470  19.372
 1084    HB3  ARG 134           HB3      ARG 134 -17.046 -16.764  18.901
 1085    HG2  ARG 134           HG2      ARG 134 -14.223 -17.239  19.928
 1086    HG3  ARG 134           HG3      ARG 134 -15.650 -17.205  20.951
 1087    HD2  ARG 134           HD2      ARG 134 -15.344 -19.061  18.582
 1088    HD3  ARG 134           HD3      ARG 134 -14.857 -19.483  20.247
 1089    HE   ARG 134           HE       ARG 134 -17.508 -18.611  20.418
 1090   HH11  ARG 134          HH11      ARG 134 -15.782 -21.317  18.885
 1091   HH12  ARG 134          HH12      ARG 134 -17.141 -22.384  18.919
 1092   HH21  ARG 134          HH21      ARG 134 -19.321 -20.028  20.452
 1093   HH22  ARG 134          HH22      ARG 134 -19.185 -21.638  19.852
 1094    H    GLN 135           H        GLN 135 -14.835 -13.930  17.041
 1095    HA   GLN 135           HA       GLN 135 -17.537 -13.210  16.147
 1096    HB2  GLN 135           HB2      GLN 135 -15.000 -11.681  16.760
 1097    HB3  GLN 135           HB3      GLN 135 -16.335 -10.880  15.965
 1098    HG2  GLN 135           HG2      GLN 135 -16.507 -10.490  18.353
 1099    HG3  GLN 135           HG3      GLN 135 -17.873 -11.435  17.778
 1100   HE21  GLN 135          HE22      GLN 135 -14.618 -11.871  19.339
 1101   HE22  GLN 135          HE21      GLN 135 -15.056 -13.319  20.203
 1102    H    VAL 136           H        VAL 136 -14.549 -14.012  14.489
 1103    HA   VAL 136           HA       VAL 136 -15.231 -12.322  12.201
 1104    HB   VAL 136           HB       VAL 136 -13.044 -13.534  11.347
 1105   HG11  VAL 136          HG11      VAL 136 -13.375 -11.080  11.664
 1106   HG12  VAL 136          HG12      VAL 136 -12.992 -11.279  13.386
 1107   HG13  VAL 136          HG13      VAL 136 -11.773 -11.624  12.134
 1108   HG21  VAL 136          HG21      VAL 136 -12.780 -14.969  13.409
 1109   HG22  VAL 136          HG22      VAL 136 -11.408 -13.906  13.048
 1110   HG23  VAL 136          HG23      VAL 136 -12.528 -13.471  14.340
 1111    H    VAL 137           H        VAL 137 -15.306 -13.005  10.026
 1112    HA   VAL 137           HA       VAL 137 -17.081 -15.251   9.583
 1113    HB   VAL 137           HB       VAL 137 -17.334 -14.396   7.397
 1114   HG11  VAL 137          HG11      VAL 137 -16.801 -11.875   9.024
 1115   HG12  VAL 137          HG12      VAL 137 -17.899 -12.094   7.652
 1116   HG13  VAL 137          HG13      VAL 137 -18.249 -12.904   9.187
 1117   HG21  VAL 137          HG21      VAL 137 -15.772 -12.570   6.479
 1118   HG22  VAL 137          HG22      VAL 137 -14.623 -13.053   7.760
 1119   HG23  VAL 137          HG23      VAL 137 -15.160 -14.221   6.537
 1120    H    SER 138           H        SER 138 -16.489 -16.543   7.381
 1121    HA   SER 138           HA       SER 138 -14.791 -18.534   8.157
 1122    HB2  SER 138           HB2      SER 138 -15.548 -17.792   5.313
 1123    HB3  SER 138           HB3      SER 138 -15.153 -19.418   5.922
 1124    HG   SER 138           HG       SER 138 -17.438 -19.056   5.819
 1125    H    PHE 139           H        PHE 139 -13.892 -16.049   5.622
 1126    HA   PHE 139           HA       PHE 139 -11.301 -17.270   5.354
 1127    HB2  PHE 139           HB2      PHE 139 -10.791 -15.639   3.755
 1128    HB3  PHE 139           HB3      PHE 139 -12.468 -16.075   3.531
 1129    HD1  PHE 139           HD2      PHE 139 -10.118 -13.414   4.540
 1130    HD2  PHE 139           HD1      PHE 139 -14.275 -14.405   3.925
 1131    HE1  PHE 139           HE2      PHE 139 -10.695 -11.005   4.538
 1132    HE2  PHE 139           HE1      PHE 139 -14.846 -11.994   3.984
 1133    HZ   PHE 139           HZ       PHE 139 -13.062 -10.291   4.276
 1134    H    LYS 140           H        LYS 140 -12.455 -14.429   7.180
 1135    HA   LYS 140           HA       LYS 140  -9.802 -13.644   8.054
 1136    HB2  LYS 140           HB2      LYS 140 -12.563 -13.029   9.185
 1137    HB3  LYS 140           HB3      LYS 140 -11.049 -12.360   9.829
 1138    HG2  LYS 140           HG2      LYS 140 -10.529 -11.424   7.568
 1139    HG3  LYS 140           HG3      LYS 140 -12.123 -11.957   7.013
 1140    HD2  LYS 140           HD2      LYS 140 -11.664 -10.056   9.350
 1141    HD3  LYS 140           HD3      LYS 140 -12.000  -9.552   7.667
 1142    HE2  LYS 140           HE2      LYS 140 -14.144 -10.874   7.795
 1143    HE3  LYS 140           HE3      LYS 140 -13.804 -11.142   9.519
 1144    HZ1  LYS 140           HZ1      LYS 140 -14.192  -8.476   8.204
 1145    HZ2  LYS 140           HZ2      LYS 140 -15.286  -9.199   9.169
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.866  -8.672   9.795
 1147    H    ARG 141           H        ARG 141 -12.372 -15.649   9.605
 1148    HA   ARG 141           HA       ARG 141 -10.880 -15.961  12.000
 1149    HB2  ARG 141           HB2      ARG 141 -12.434 -17.519  12.743
 1150    HB3  ARG 141           HB3      ARG 141 -13.319 -16.404  11.711
 1151    HG2  ARG 141           HG2      ARG 141 -13.083 -18.156   9.857
 1152    HG3  ARG 141           HG3      ARG 141 -12.524 -19.272  11.118
 1153    HD2  ARG 141           HD2      ARG 141 -14.641 -18.846  12.377
 1154    HD3  ARG 141           HD3      ARG 141 -15.153 -17.739  11.084
 1155    HE   ARG 141           HE       ARG 141 -14.486 -20.440  10.181
 1156   HH11  ARG 141          HH11      ARG 141 -17.113 -18.430  11.496
 1157   HH12  ARG 141          HH12      ARG 141 -18.375 -19.384  10.802
 1158   HH21  ARG 141          HH21      ARG 141 -16.174 -21.702   9.249
 1159   HH22  ARG 141          HH22      ARG 141 -17.825 -21.280   9.501
 1160    H    ASP 142           H        ASP 142 -10.605 -17.819   8.978
 1161    HA   ASP 142           HA       ASP 142  -8.840 -19.807  10.037
 1162    HB2  ASP 142           HB2      ASP 142  -9.845 -19.939   7.783
 1163    HB3  ASP 142           HB3      ASP 142  -8.828 -18.589   7.253
 1164    H    VAL 143           H        VAL 143  -8.173 -16.491   8.730
 1165    HA   VAL 143           HA       VAL 143  -5.332 -16.710   9.208
 1166    HB   VAL 143           HB       VAL 143  -7.198 -14.324   8.860
 1167   HG11  VAL 143          HG11      VAL 143  -5.328 -13.482  10.181
 1168   HG12  VAL 143          HG12      VAL 143  -4.168 -14.315   9.115
 1169   HG13  VAL 143          HG13      VAL 143  -5.141 -12.957   8.509
 1170   HG21  VAL 143          HG21      VAL 143  -6.880 -15.750   6.859
 1171   HG22  VAL 143          HG22      VAL 143  -6.142 -14.160   6.658
 1172   HG23  VAL 143          HG23      VAL 143  -5.121 -15.573   7.012
 1173    H    TYR 144           H        TYR 144  -8.028 -15.288  11.152
 1174    HA   TYR 144           HA       TYR 144  -6.358 -14.284  13.180
 1175    HB2  TYR 144           HB2      TYR 144  -9.300 -15.013  13.113
 1176    HB3  TYR 144           HB3      TYR 144  -8.542 -14.410  14.566
 1177    HD1  TYR 144           HD1      TYR 144  -7.874 -13.111  11.038
 1178    HD2  TYR 144           HD2      TYR 144  -9.744 -12.404  14.873
 1179    HE1  TYR 144           HE1      TYR 144  -8.227 -10.783  10.425
 1180    HE2  TYR 144           HE2      TYR 144 -10.138 -10.056  14.221
 1181    HH   TYR 144           HH       TYR 144  -9.094  -8.710  11.055
 1182    H    ARG 145           H        ARG 145  -7.905 -17.563  12.937
 1183    HA   ARG 145           HA       ARG 145  -6.894 -18.332  15.538
 1184    HB2  ARG 145           HB2      ARG 145  -7.633 -20.507  15.095
 1185    HB3  ARG 145           HB3      ARG 145  -8.778 -19.449  14.278
 1186    HG2  ARG 145           HG2      ARG 145  -7.385 -19.837  12.170
 1187    HG3  ARG 145           HG3      ARG 145  -6.618 -21.179  13.027
 1188    HD2  ARG 145           HD2      ARG 145  -9.577 -20.809  12.438
 1189    HD3  ARG 145           HD3      ARG 145  -8.445 -21.848  11.540
 1190    HE   ARG 145           HE       ARG 145  -8.293 -22.641  14.240
 1191   HH11  ARG 145          HH21      ARG 145 -10.685 -22.761  11.606
 1192   HH12  ARG 145          HH22      ARG 145 -11.529 -24.122  12.253
 1193   HH21  ARG 145          HH11      ARG 145  -9.417 -24.448  15.101
 1194   HH22  ARG 145          HH12      ARG 145 -10.777 -25.109  14.272
 1195    H    ARG 146           H        ARG 146  -5.450 -18.639  12.187
 1196    HA   ARG 146           HA       ARG 146  -3.118 -19.971  13.130
 1197    HB2  ARG 146           HB2      ARG 146  -3.837 -18.334  10.656
 1198    HB3  ARG 146           HB3      ARG 146  -2.143 -18.605  11.042
 1199    HG2  ARG 146           HG2      ARG 146  -2.531 -20.375   9.669
 1200    HG3  ARG 146           HG3      ARG 146  -2.705 -21.093  11.266
 1201    HD2  ARG 146           HD2      ARG 146  -5.215 -20.901  10.988
 1202    HD3  ARG 146           HD3      ARG 146  -4.923 -20.332   9.340
 1203    HE   ARG 146           HE       ARG 146  -4.213 -23.022  10.459
 1204   HH11  ARG 146          HH11      ARG 146  -5.332 -21.199   7.597
 1205   HH12  ARG 146          HH12      ARG 146  -4.767 -22.383   6.477
 1206   HH21  ARG 146          HH21      ARG 146  -3.711 -24.681   8.961
 1207   HH22  ARG 146          HH22      ARG 146  -4.015 -24.468   7.281
 1208    H    VAL 147           H        VAL 147  -3.810 -16.432  12.869
 1209    HA   VAL 147           HA       VAL 147  -1.316 -15.514  13.696
 1210    HB   VAL 147           HB       VAL 147  -4.123 -14.370  14.116
 1211   HG11  VAL 147          HG11      VAL 147  -2.664 -13.148  15.652
 1212   HG12  VAL 147          HG12      VAL 147  -1.461 -12.906  14.367
 1213   HG13  VAL 147          HG13      VAL 147  -3.062 -12.135  14.278
 1214   HG21  VAL 147          HG21      VAL 147  -3.451 -14.658  11.743
 1215   HG22  VAL 147          HG22      VAL 147  -3.472 -12.959  12.162
 1216   HG23  VAL 147          HG23      VAL 147  -1.933 -13.863  12.082
 1217    H    MET 148           H        MET 148  -3.672 -17.190  15.637
 1218    HA   MET 148           HA       MET 148  -2.426 -16.297  18.158
 1219    HB2  MET 148           HB2      MET 148  -4.852 -18.066  17.737
 1220    HB3  MET 148           HB3      MET 148  -4.214 -17.512  19.297
 1221    HG2  MET 148           HG2      MET 148  -5.227 -15.631  17.141
 1222    HG3  MET 148           HG3      MET 148  -6.231 -16.304  18.404
 1223    HE1  MET 148           HE1      MET 148  -4.374 -13.441  17.230
 1224    HE2  MET 148           HE2      MET 148  -3.693 -12.605  18.637
 1225    HE3  MET 148           HE3      MET 148  -2.853 -14.024  17.956
 1226    H    LYS 149           H        LYS 149  -3.287 -19.361  16.455
 1227    HA   LYS 149           HA       LYS 149  -1.778 -21.131  18.068
 1228    HB2  LYS 149           HB2      LYS 149  -3.469 -21.975  16.857
 1229    HB3  LYS 149           HB3      LYS 149  -2.954 -21.266  15.326
 1230    HG2  LYS 149           HG2      LYS 149  -1.305 -23.381  16.734
 1231    HG3  LYS 149           HG3      LYS 149  -2.658 -23.814  15.689
 1232    HD2  LYS 149           HD2      LYS 149  -1.586 -23.296  13.764
 1233    HD3  LYS 149           HD3      LYS 149  -0.866 -21.823  14.430
 1234    HE2  LYS 149           HE2      LYS 149   0.810 -23.119  15.642
 1235    HE3  LYS 149           HE3      LYS 149   0.097 -24.632  15.067
 1236    HZ1  LYS 149           HZ1      LYS 149   0.695 -23.993  12.782
 1237    HZ2  LYS 149           HZ2      LYS 149   1.407 -22.595  13.283
 1238    HZ3  LYS 149           HZ3      LYS 149   2.021 -24.050  13.716
 1239    H    GLU 150           H        GLU 150  -0.561 -19.181  15.308
 1240    HA   GLU 150           HA       GLU 150   1.792 -20.602  15.059
 1241    HB2  GLU 150           HB2      GLU 150   0.642 -18.829  13.542
 1242    HB3  GLU 150           HB3      GLU 150   1.440 -17.626  14.539
 1243    HG2  GLU 150           HG2      GLU 150   2.873 -17.942  12.804
 1244    HG3  GLU 150           HG3      GLU 150   3.622 -18.964  14.016
 1245    H    PHE 151           H        PHE 151   0.892 -18.116  17.385
 1246    HA   PHE 151           HA       PHE 151   3.649 -18.140  18.556
 1247    HB2  PHE 151           HB2      PHE 151   1.553 -16.084  19.144
 1248    HB3  PHE 151           HB3      PHE 151   3.314 -16.018  19.309
 1249    HD1  PHE 151           HD2      PHE 151   4.430 -16.733  16.713
 1250    HD2  PHE 151           HD1      PHE 151   0.874 -14.414  17.617
 1251    HE1  PHE 151           HE2      PHE 151   4.397 -15.828  14.466
 1252    HE2  PHE 151           HE1      PHE 151   0.976 -13.413  15.390
 1253    HZ   PHE 151           HZ       PHE 151   2.746 -14.128  13.795
 1254    H    ALA 152           H        ALA 152   0.474 -19.348  19.123
 1255    HA   ALA 152           HA       ALA 152   0.009 -18.928  21.802
 1256    HB1  ALA 152           HB1      ALA 152  -0.542 -21.443  20.144
 1257    HB2  ALA 152           HB2      ALA 152  -1.336 -21.021  21.677
 1258    HB3  ALA 152           HB3      ALA 152  -1.591 -20.012  20.242
 1259    H    SER 153           H        SER 153   2.120 -21.354  20.321
 1260    HA   SER 153           HA       SER 153   2.722 -22.910  22.626
 1261    HB2  SER 153           HB2      SER 153   4.815 -23.341  21.050
 1262    HB3  SER 153           HB3      SER 153   3.184 -23.847  20.517
 1263    HG   SER 153           HG       SER 153   4.194 -22.748  18.839
 1264    H    VAL 154           H        VAL 154   4.074 -19.922  21.275
 1265    HA   VAL 154           HA       VAL 154   6.332 -19.867  23.135
 1266    HB   VAL 154           HB       VAL 154   5.156 -17.724  21.315
 1267   HG11  VAL 154          HG11      VAL 154   7.289 -16.532  21.649
 1268   HG12  VAL 154          HG12      VAL 154   6.423 -16.697  23.187
 1269   HG13  VAL 154          HG13      VAL 154   7.809 -17.752  22.833
 1270   HG21  VAL 154          HG21      VAL 154   6.046 -19.668  20.064
 1271   HG22  VAL 154          HG22      VAL 154   7.149 -18.299  19.882
 1272   HG23  VAL 154          HG23      VAL 154   7.548 -19.612  21.002
 1273    H    VAL 155           H        VAL 155   3.066 -18.408  22.845
 1274    HA   VAL 155           HA       VAL 155   3.260 -16.750  25.070
 1275    HB   VAL 155           HB       VAL 155   0.752 -18.181  24.146
 1276   HG11  VAL 155          HG11      VAL 155   0.335 -17.304  26.355
 1277   HG12  VAL 155          HG12      VAL 155   1.279 -15.837  26.039
 1278   HG13  VAL 155          HG13      VAL 155  -0.310 -16.080  25.245
 1279   HG21  VAL 155          HG21      VAL 155   1.678 -16.779  22.344
 1280   HG22  VAL 155          HG22      VAL 155   0.257 -16.001  23.018
 1281   HG23  VAL 155          HG23      VAL 155   1.884 -15.429  23.470
 1282    H    MET 156           H        MET 156   2.424 -20.306  25.069
 1283    HA   MET 156           HA       MET 156   1.684 -20.455  27.726
 1284    HB2  MET 156           HB2      MET 156   3.431 -22.429  26.138
 1285    HB3  MET 156           HB3      MET 156   2.550 -22.840  27.619
 1286    HG2  MET 156           HG2      MET 156   1.388 -22.144  24.915
 1287    HG3  MET 156           HG3      MET 156   1.305 -23.684  25.739
 1288    HE1  MET 156           HE1      MET 156  -0.842 -20.972  24.564
 1289    HE2  MET 156           HE2      MET 156  -1.179 -22.717  24.426
 1290    HE3  MET 156           HE3      MET 156  -2.288 -21.661  25.323
 1291    H    SER 157           H        SER 157   4.914 -20.942  26.356
 1292    HA   SER 157           HA       SER 157   6.325 -21.214  28.796
 1293    HB2  SER 157           HB2      SER 157   6.916 -20.634  25.902
 1294    HB3  SER 157           HB3      SER 157   8.258 -20.701  27.101
 1295    HG   SER 157           HG       SER 157   7.868 -22.745  26.104
 1296    H    LEU 158           H        LEU 158   5.446 -18.372  26.865
 1297    HA   LEU 158           HA       LEU 158   7.024 -16.456  28.196
 1298    HB2  LEU 158           HB2      LEU 158   5.929 -16.463  25.896
 1299    HB3  LEU 158           HB3      LEU 158   4.394 -16.127  26.694
 1300    HG   LEU 158           HG       LEU 158   5.766 -14.392  25.513
 1301   HD11  LEU 158          HD11      LEU 158   4.702 -12.653  26.562
 1302   HD12  LEU 158          HD12      LEU 158   3.686 -14.043  26.945
 1303   HD13  LEU 158          HD13      LEU 158   4.816 -13.442  28.182
 1304   HD21  LEU 158          HD21      LEU 158   7.346 -13.050  26.773
 1305   HD22  LEU 158          HD22      LEU 158   7.221 -14.160  28.153
 1306   HD23  LEU 158          HD23      LEU 158   7.904 -14.731  26.604
 1307    H    GLN 159           H        GLN 159   3.827 -17.862  28.912
 1308    HA   GLN 159           HA       GLN 159   3.300 -16.068  31.172
 1309    HB2  GLN 159           HB2      GLN 159   2.209 -18.874  30.700
 1310    HB3  GLN 159           HB3      GLN 159   1.612 -17.664  31.814
 1311    HG2  GLN 159           HG2      GLN 159   1.120 -16.210  29.677
 1312    HG3  GLN 159           HG3      GLN 159   1.399 -17.719  28.797
 1313   HE21  GLN 159          HE22      GLN 159  -0.419 -16.941  31.825
 1314   HE22  GLN 159          HE21      GLN 159  -1.842 -17.873  31.358
 1315    H    GLU 160           H        GLU 160   4.726 -19.333  30.762
 1316    HA   GLU 160           HA       GLU 160   4.807 -19.988  33.460
 1317    HB2  GLU 160           HB2      GLU 160   6.603 -20.799  31.129
 1318    HB3  GLU 160           HB3      GLU 160   6.765 -21.514  32.732
 1319    HG2  GLU 160           HG2      GLU 160   4.463 -22.284  32.743
 1320    HG3  GLU 160           HG3      GLU 160   4.163 -21.536  31.182
 1321    H    ASN 161           H        ASN 161   6.820 -17.851  31.739
 1322    HA   ASN 161           HA       ASN 161   9.162 -18.093  33.471
 1323    HB2  ASN 161           HB2      ASN 161   8.463 -16.415  31.067
 1324    HB3  ASN 161           HB3      ASN 161   9.742 -15.860  32.150
 1325   HD21  ASN 161          HD22      ASN 161   8.717 -18.948  30.458
 1326   HD22  ASN 161          HD21      ASN 161  10.366 -19.481  30.207
 1327    H    THR 162           H        THR 162   6.366 -15.853  33.346
 1328    HA   THR 162           HA       THR 162   6.806 -15.179  36.095
 1329    HB   THR 162           HB       THR 162   8.486 -13.752  35.289
 1330    HG1  THR 162           HG1      THR 162   7.825 -11.877  36.197
 1331   HG21  THR 162          HG21      THR 162   8.235 -11.899  33.744
 1332   HG22  THR 162          HG22      THR 162   7.923 -13.435  32.931
 1333   HG23  THR 162          HG23      THR 162   6.571 -12.375  33.381
 1334    HA   PRO 163           HA       PRO 163   2.525 -15.011  34.449
 1335    HB2  PRO 163           HB2      PRO 163   1.276 -16.863  36.038
 1336    HB3  PRO 163           HB3      PRO 163   2.339 -17.322  34.679
 1337    HG2  PRO 163           HG2      PRO 163   3.100 -17.029  37.610
 1338    HG3  PRO 163           HG3      PRO 163   3.376 -18.448  36.544
 1339    HD2  PRO 163           HD2      PRO 163   5.316 -16.603  36.947
 1340    HD3  PRO 163           HD3      PRO 163   5.061 -17.325  35.326
 1341    H    LYS 164           H        LYS 164   3.751 -13.195  36.307
 1342    HA   LYS 164           HA       LYS 164   1.776 -12.685  38.464
 1343    HB2  LYS 164           HB2      LYS 164   4.266 -11.128  37.676
 1344    HB3  LYS 164           HB3      LYS 164   3.284 -10.867  39.107
 1345    HG2  LYS 164           HG2      LYS 164   5.047 -13.300  38.539
 1346    HG3  LYS 164           HG3      LYS 164   5.371 -11.983  39.647
 1347    HD2  LYS 164           HD2      LYS 164   4.674 -13.602  41.105
 1348    HD3  LYS 164           HD3      LYS 164   3.179 -12.695  40.865
 1349    HE2  LYS 164           HE2      LYS 164   2.432 -14.430  39.201
 1350    HE3  LYS 164           HE3      LYS 164   3.959 -15.288  39.424
 1351    HZ1  LYS 164           HZ1      LYS 164   3.331 -15.647  41.758
 1352    HZ2  LYS 164           HZ2      LYS 164   1.911 -14.862  41.538
 1353    HZ3  LYS 164           HZ3      LYS 164   2.200 -16.267  40.761
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1   0.652   1.476  -2.802
    2    H2   MET   1           H2       MET   1   0.577   0.372  -1.598
    3    H3   MET   1           H3       MET   1   1.454   1.745  -1.402
    4    HA   MET   1           HA       MET   1   2.991   1.135  -3.098
    5    HB2  MET   1           HB2      MET   1   3.418   0.464  -0.724
    6    HB3  MET   1           HB3      MET   1   2.832  -1.148  -1.070
    7    HG2  MET   1           HG2      MET   1   5.097   0.189  -2.611
    8    HG3  MET   1           HG3      MET   1   5.353  -0.733  -1.136
    9    HE1  MET   1           HE1      MET   1   4.366  -3.322  -0.937
   10    HE2  MET   1           HE2      MET   1   5.329  -4.343  -2.040
   11    HE3  MET   1           HE3      MET   1   6.122  -3.074  -1.086
   12    H    ILE   2           H        ILE   2   1.575  -2.136  -2.513
   13    HA   ILE   2           HA       ILE   2   1.050  -3.827  -3.840
   14    HB   ILE   2           HB       ILE   2   0.364  -1.909  -6.040
   15   HG12  ILE   2          HG12      ILE   2  -0.914  -2.344  -3.495
   16   HG13  ILE   2          HG13      ILE   2  -1.363  -1.270  -4.820
   17   HG21  ILE   2          HG21      ILE   2  -0.410  -4.812  -5.576
   18   HG22  ILE   2          HG22      ILE   2  -0.984  -3.768  -6.899
   19   HG23  ILE   2          HG23      ILE   2   0.717  -4.218  -6.828
   20   HD11  ILE   2          HD11      ILE   2  -3.199  -2.659  -4.084
   21   HD12  ILE   2          HD12      ILE   2  -2.806  -3.080  -5.749
   22   HD13  ILE   2          HD13      ILE   2  -2.251  -4.131  -4.393
   23    H    ASP   3           H        ASP   3   2.513  -5.211  -4.392
   24    HA   ASP   3           HA       ASP   3   5.126  -4.451  -4.941
   25    HB2  ASP   3           HB2      ASP   3   4.513  -6.549  -3.826
   26    HB3  ASP   3           HB3      ASP   3   3.847  -7.152  -5.357
   27    H    ASP   4           H        ASP   4   3.035  -6.352  -7.150
   28    HA   ASP   4           HA       ASP   4   3.818  -4.792  -9.417
   29    HB2  ASP   4           HB2      ASP   4   5.843  -6.166  -9.243
   30    HB3  ASP   4           HB3      ASP   4   4.860  -7.624  -9.166
   31    H    ASP   5           H        ASP   5   2.665  -8.057  -8.595
   32    HA   ASP   5           HA       ASP   5   0.867  -8.009 -10.879
   33    HB2  ASP   5           HB2      ASP   5   2.559  -9.807 -10.568
   34    HB3  ASP   5           HB3      ASP   5   1.634 -10.377  -9.178
   35    H    GLY   6           H        GLY   6   0.229  -6.629  -8.314
   36    HA2  GLY   6           HA2      GLY   6  -1.877  -6.040  -7.485
   37    HA3  GLY   6           HA3      GLY   6  -2.583  -7.516  -8.142
   38    H    TYR   7           H        TYR   7   0.306  -7.870  -6.224
   39    HA   TYR   7           HA       TYR   7  -1.281  -8.633  -3.825
   40    HB2  TYR   7           HB2      TYR   7   1.507  -9.591  -4.569
   41    HB3  TYR   7           HB3      TYR   7   0.557 -10.092  -3.181
   42    HD1  TYR   7           HD1      TYR   7  -1.340 -11.690  -3.428
   43    HD2  TYR   7           HD2      TYR   7   1.036 -10.443  -6.808
   44    HE1  TYR   7           HE1      TYR   7  -2.270 -13.547  -4.764
   45    HE2  TYR   7           HE2      TYR   7   0.113 -12.304  -8.152
   46    HH   TYR   7           HH       TYR   7  -2.254 -14.675  -6.841
   47    H    ARG   8           H        ARG   8  -0.319  -7.908  -1.752
   48    HA   ARG   8           HA       ARG   8   1.915  -6.002  -1.999
   49    HB2  ARG   8           HB2      ARG   8   0.839  -4.285  -0.646
   50    HB3  ARG   8           HB3      ARG   8   0.013  -4.518  -2.186
   51    HG2  ARG   8           HG2      ARG   8  -1.118  -5.985   0.205
   52    HG3  ARG   8           HG3      ARG   8  -1.282  -4.236   0.146
   53    HD2  ARG   8           HD2      ARG   8  -2.274  -4.414  -2.148
   54    HD3  ARG   8           HD3      ARG   8  -2.183  -6.166  -2.032
   55    HE   ARG   8           HE       ARG   8  -3.977  -6.240  -0.611
   56   HH11  ARG   8          HH21      ARG   8  -3.026  -2.791  -0.852
   57   HH12  ARG   8          HH22      ARG   8  -4.458  -2.222  -0.086
   58   HH21  ARG   8          HH11      ARG   8  -5.857  -5.433   0.451
   59   HH22  ARG   8          HH12      ARG   8  -6.077  -3.738   0.667
   60    HA   PRO   9           HA       PRO   9   2.711  -8.405   1.694
   61    HB2  PRO   9           HB2      PRO   9   5.115  -6.720   2.175
   62    HB3  PRO   9           HB3      PRO   9   5.021  -8.477   1.864
   63    HG2  PRO   9           HG2      PRO   9   5.987  -6.727   0.018
   64    HG3  PRO   9           HG3      PRO   9   4.936  -8.095  -0.495
   65    HD2  PRO   9           HD2      PRO   9   4.099  -5.241   0.130
   66    HD3  PRO   9           HD3      PRO   9   3.809  -6.176  -1.364
   67    H    ASN  10           H        ASN  10   2.035  -8.246   3.826
   68    HA   ASN  10           HA       ASN  10   1.776  -5.557   5.098
   69    HB2  ASN  10           HB2      ASN  10  -0.226  -7.827   4.873
   70    HB3  ASN  10           HB3      ASN  10  -0.422  -6.473   5.980
   71   HD21  ASN  10          HD22      ASN  10  -2.422  -7.050   4.264
   72   HD22  ASN  10          HD21      ASN  10  -2.566  -5.732   3.096
   73    H    VAL  11           H        VAL  11   1.506  -5.743   7.477
   74    HA   VAL  11           HA       VAL  11   2.409  -8.304   8.579
   75    HB   VAL  11           HB       VAL  11   4.046  -7.274  10.052
   76   HG11  VAL  11          HG11      VAL  11   4.625  -6.369   7.289
   77   HG12  VAL  11          HG12      VAL  11   5.781  -6.721   8.580
   78   HG13  VAL  11          HG13      VAL  11   4.816  -8.035   7.874
   79   HG21  VAL  11          HG21      VAL  11   3.353  -4.634   8.684
   80   HG22  VAL  11          HG22      VAL  11   3.076  -5.051  10.398
   81   HG23  VAL  11          HG23      VAL  11   4.722  -4.936   9.786
   82    H    GLY  12           H        GLY  12   1.833  -8.601  10.833
   83    HA2  GLY  12           HA2      GLY  12  -0.133  -6.651  11.913
   84    HA3  GLY  12           HA3      GLY  12  -0.600  -8.342  11.765
   85    H    ILE  13           H        ILE  13  -0.448  -6.818  14.171
   86    HA   ILE  13           HA       ILE  13   1.831  -8.047  15.649
   87    HB   ILE  13           HB       ILE  13   0.217  -5.502  16.084
   88   HG12  ILE  13          HG12      ILE  13   3.114  -5.115  15.995
   89   HG13  ILE  13          HG13      ILE  13   2.585  -5.967  14.542
   90   HG21  ILE  13          HG21      ILE  13   1.745  -5.038  17.954
   91   HG22  ILE  13          HG22      ILE  13   0.725  -6.440  18.253
   92   HG23  ILE  13          HG23      ILE  13   2.437  -6.672  17.796
   93   HD11  ILE  13          HD11      ILE  13   2.563  -3.573  14.168
   94   HD12  ILE  13          HD12      ILE  13   0.908  -4.195  14.097
   95   HD13  ILE  13          HD13      ILE  13   1.478  -3.330  15.549
   96    H    VAL  14           H        VAL  14   1.346  -9.247  17.410
   97    HA   VAL  14           HA       VAL  14  -1.469  -9.339  18.412
   98    HB   VAL  14           HB       VAL  14   0.565 -11.621  18.305
   99   HG11  VAL  14          HG11      VAL  14  -2.330 -11.558  19.262
  100   HG12  VAL  14          HG12      VAL  14  -1.304 -13.013  19.137
  101   HG13  VAL  14          HG13      VAL  14  -0.896 -11.749  20.290
  102   HG21  VAL  14          HG21      VAL  14  -0.266 -11.254  16.051
  103   HG22  VAL  14          HG22      VAL  14  -1.009 -12.710  16.723
  104   HG23  VAL  14          HG23      VAL  14  -1.949 -11.199  16.636
  105    H    ILE  15           H        ILE  15  -1.508  -8.878  20.671
  106    HA   ILE  15           HA       ILE  15   1.121  -8.943  22.033
  107    HB   ILE  15           HB       ILE  15  -1.091  -7.063  22.916
  108   HG12  ILE  15          HG12      ILE  15  -0.273  -6.259  20.697
  109   HG13  ILE  15          HG13      ILE  15   0.100  -5.180  22.030
  110   HG21  ILE  15          HG21      ILE  15   0.344  -7.661  24.710
  111   HG22  ILE  15          HG22      ILE  15   1.805  -7.491  23.704
  112   HG23  ILE  15          HG23      ILE  15   0.868  -6.062  24.145
  113   HD11  ILE  15          HD11      ILE  15   2.427  -5.936  22.101
  114   HD12  ILE  15          HD12      ILE  15   2.064  -7.177  20.871
  115   HD13  ILE  15          HD13      ILE  15   2.003  -5.448  20.452
  116    H    CYS  16           H        CYS  16   1.172 -10.305  23.826
  117    HA   CYS  16           HA       CYS  16  -1.485 -10.929  24.981
  118    HB2  CYS  16           HB2      CYS  16  -1.112 -13.265  25.202
  119    HB3  CYS  16           HB3      CYS  16  -0.702 -12.854  23.523
  120    HG   CYS  16           HG       CYS  16   1.178 -13.493  26.154
  121    H    ASN  17           H        ASN  17  -1.470 -11.741  27.164
  122    HA   ASN  17           HA       ASN  17   0.736 -10.559  28.800
  123    HB2  ASN  17           HB2      ASN  17  -0.896 -10.011  30.481
  124    HB3  ASN  17           HB3      ASN  17  -1.424  -9.350  28.949
  125   HD21  ASN  17          HD22      ASN  17  -3.497  -9.278  30.409
  126   HD22  ASN  17          HD21      ASN  17  -4.519 -10.690  30.325
  127    H    ARG  18           H        ARG  18   0.561 -11.807  31.185
  128    HA   ARG  18           HA       ARG  18   1.241 -14.564  30.462
  129    HB2  ARG  18           HB2      ARG  18   1.237 -13.208  33.208
  130    HB3  ARG  18           HB3      ARG  18   1.782 -14.852  32.884
  131    HG2  ARG  18           HG2      ARG  18   3.804 -13.937  32.630
  132    HG3  ARG  18           HG3      ARG  18   3.217 -13.613  30.992
  133    HD2  ARG  18           HD2      ARG  18   2.479 -11.343  31.799
  134    HD3  ARG  18           HD3      ARG  18   3.233 -11.686  33.359
  135    HE   ARG  18           HE       ARG  18   4.641 -11.562  30.700
  136   HH11  ARG  18          HH11      ARG  18   4.860 -10.922  34.224
  137   HH12  ARG  18          HH12      ARG  18   6.556 -10.571  34.103
  138   HH21  ARG  18          HH21      ARG  18   6.678 -10.803  30.582
  139   HH22  ARG  18          HH22      ARG  18   7.524 -10.146  31.963
  140    H    GLN  19           H        GLN  19  -1.699 -13.215  30.909
  141    HA   GLN  19           HA       GLN  19  -2.926 -15.503  32.283
  142    HB2  GLN  19           HB2      GLN  19  -4.419 -13.206  31.010
  143    HB3  GLN  19           HB3      GLN  19  -4.976 -14.300  32.265
  144    HG2  GLN  19           HG2      GLN  19  -2.907 -12.088  32.513
  145    HG3  GLN  19           HG3      GLN  19  -4.539 -12.073  33.140
  146   HE21  GLN  19          HE22      GLN  19  -2.190 -11.613  34.772
  147   HE22  GLN  19          HE21      GLN  19  -2.117 -12.905  35.946
  148    H    GLY  20           H        GLY  20  -1.764 -14.852  29.166
  149    HA2  GLY  20           HA2      GLY  20  -2.087 -15.919  27.185
  150    HA3  GLY  20           HA3      GLY  20  -3.244 -17.028  27.952
  151    H    GLN  21           H        GLN  21  -3.653 -13.478  28.185
  152    HA   GLN  21           HA       GLN  21  -6.002 -13.694  26.380
  153    HB2  GLN  21           HB2      GLN  21  -5.224 -11.445  28.259
  154    HB3  GLN  21           HB3      GLN  21  -6.643 -11.476  27.223
  155    HG2  GLN  21           HG2      GLN  21  -6.117 -13.401  29.530
  156    HG3  GLN  21           HG3      GLN  21  -7.165 -11.994  29.589
  157   HE21  GLN  21          HE22      GLN  21  -6.937 -15.368  28.653
  158   HE22  GLN  21          HE21      GLN  21  -8.580 -15.510  28.087
  159    H    VAL  22           H        VAL  22  -6.003 -12.423  24.527
  160    HA   VAL  22           HA       VAL  22  -3.445 -11.162  23.774
  161    HB   VAL  22           HB       VAL  22  -3.823 -11.682  21.505
  162   HG11  VAL  22          HG11      VAL  22  -2.855 -13.466  23.012
  163   HG12  VAL  22          HG12      VAL  22  -4.445 -14.226  23.081
  164   HG13  VAL  22          HG13      VAL  22  -3.593 -14.081  21.513
  165   HG21  VAL  22          HG21      VAL  22  -5.743 -13.053  20.700
  166   HG22  VAL  22          HG22      VAL  22  -6.533 -12.849  22.285
  167   HG23  VAL  22          HG23      VAL  22  -6.227 -11.442  21.244
  168    H    MET  23           H        MET  23  -3.586  -9.071  22.819
  169    HA   MET  23           HA       MET  23  -6.097  -7.640  23.463
  170    HB2  MET  23           HB2      MET  23  -3.802  -6.814  24.126
  171    HB3  MET  23           HB3      MET  23  -3.499  -6.458  22.435
  172    HG2  MET  23           HG2      MET  23  -5.991  -5.437  23.869
  173    HG3  MET  23           HG3      MET  23  -4.455  -4.614  24.062
  174    HE1  MET  23           HE1      MET  23  -3.043  -4.594  21.230
  175    HE2  MET  23           HE2      MET  23  -3.632  -2.973  20.789
  176    HE3  MET  23           HE3      MET  23  -3.211  -3.348  22.483
  177    H    TRP  24           H        TRP  24  -7.429  -6.726  21.917
  178    HA   TRP  24           HA       TRP  24  -6.950  -7.266  19.051
  179    HB2  TRP  24           HB2      TRP  24  -7.884  -9.285  20.220
  180    HB3  TRP  24           HB3      TRP  24  -9.250  -8.316  20.734
  181    HD1  TRP  24           HD1      TRP  24  -7.665  -8.949  17.221
  182    HE1  TRP  24           HE1      TRP  24  -9.486  -9.834  15.659
  183    HE3  TRP  24           HE3      TRP  24 -11.549  -8.998  20.513
  184    HZ2  TRP  24           HZ2      TRP  24 -12.252 -10.676  15.885
  185    HZ3  TRP  24           HZ3      TRP  24 -13.780  -9.836  19.820
  186    HH2  TRP  24           HH2      TRP  24 -14.125 -10.674  17.525
  187    H    ALA  25           H        ALA  25  -8.398  -5.755  17.738
  188    HA   ALA  25           HA       ALA  25  -9.862  -3.772  19.395
  189    HB1  ALA  25           HB1      ALA  25  -7.508  -3.057  19.367
  190    HB2  ALA  25           HB2      ALA  25  -7.522  -3.089  17.593
  191    HB3  ALA  25           HB3      ALA  25  -8.544  -1.931  18.488
  192    H    ARG  26           H        ARG  26 -11.108  -2.234  18.256
  193    HA   ARG  26           HA       ARG  26 -12.501  -3.529  15.972
  194    HB2  ARG  26           HB2      ARG  26 -13.524  -2.893  18.281
  195    HB3  ARG  26           HB3      ARG  26 -13.437  -1.229  17.737
  196    HG2  ARG  26           HG2      ARG  26 -14.864  -1.903  15.737
  197    HG3  ARG  26           HG3      ARG  26 -14.984  -3.523  16.466
  198    HD2  ARG  26           HD2      ARG  26 -15.833  -2.375  18.594
  199    HD3  ARG  26           HD3      ARG  26 -15.898  -0.884  17.656
  200    HE   ARG  26           HE       ARG  26 -17.343  -3.255  16.620
  201   HH11  ARG  26          HH11      ARG  26 -17.597   0.024  18.072
  202   HH12  ARG  26          HH12      ARG  26 -19.322  -0.049  18.212
  203   HH21  ARG  26          HH21      ARG  26 -19.648  -3.279  16.763
  204   HH22  ARG  26          HH22      ARG  26 -20.510  -1.905  17.348
  205    H    ARG  27           H        ARG  27 -12.173  -2.460  13.807
  206    HA   ARG  27           HA       ARG  27 -10.340  -0.178  14.054
  207    HB2  ARG  27           HB2      ARG  27  -9.836  -1.977  12.508
  208    HB3  ARG  27           HB3      ARG  27 -11.309  -1.667  11.606
  209    HG2  ARG  27           HG2      ARG  27 -10.451   0.679  11.116
  210    HG3  ARG  27           HG3      ARG  27  -9.032   0.302  12.092
  211    HD2  ARG  27           HD2      ARG  27  -8.876  -1.724  10.270
  212    HD3  ARG  27           HD3      ARG  27  -9.724  -0.523   9.300
  213    HE   ARG  27           HE       ARG  27  -7.879   0.905   9.400
  214   HH11  ARG  27          HH11      ARG  27  -7.070  -2.118  11.187
  215   HH12  ARG  27          HH12      ARG  27  -5.585  -1.429  11.821
  216   HH21  ARG  27          HH21      ARG  27  -5.989   1.753  10.444
  217   HH22  ARG  27          HH22      ARG  27  -4.975   0.665  11.329
  218    H    PHE  28           H        PHE  28 -10.723   1.908  13.405
  219    HA   PHE  28           HA       PHE  28 -13.187   2.948  14.190
  220    HB2  PHE  28           HB2      PHE  28 -11.016   4.104  14.207
  221    HB3  PHE  28           HB3      PHE  28 -11.019   4.185  12.451
  222    HD1  PHE  28           HD1      PHE  28 -12.990   5.237  15.493
  223    HD2  PHE  28           HD2      PHE  28 -11.893   6.130  11.411
  224    HE1  PHE  28           HE1      PHE  28 -14.100   7.444  15.673
  225    HE2  PHE  28           HE2      PHE  28 -12.971   8.355  11.621
  226    HZ   PHE  28           HZ       PHE  28 -14.097   9.008  13.741
  227    H    GLY  29           H        GLY  29 -15.118   3.247  13.199
  228    HA2  GLY  29           HA2      GLY  29 -16.723   3.439  11.609
  229    HA3  GLY  29           HA3      GLY  29 -15.465   3.655  10.390
  230    H    GLN  30           H        GLN  30 -14.640   0.698  11.726
  231    HA   GLN  30           HA       GLN  30 -15.945  -0.678   9.452
  232    HB2  GLN  30           HB2      GLN  30 -13.945  -1.879  11.387
  233    HB3  GLN  30           HB3      GLN  30 -14.386  -2.435   9.776
  234    HG2  GLN  30           HG2      GLN  30 -12.706  -0.051  10.550
  235    HG3  GLN  30           HG3      GLN  30 -12.231  -1.468   9.638
  236   HE21  GLN  30          HE22      GLN  30 -13.075   1.801   9.274
  237   HE22  GLN  30          HE21      GLN  30 -13.502   1.758   7.574
  238    H    HIS  31           H        HIS  31 -16.002  -0.639  12.959
  239    HA   HIS  31           HA       HIS  31 -17.166  -1.615  14.549
  240    HB2  HIS  31           HB2      HIS  31 -19.181  -2.570  12.513
  241    HB3  HIS  31           HB3      HIS  31 -19.419  -2.346  14.238
  242    HD1  HIS  31           HD1      HIS  31 -19.743  -0.459  11.031
  243    HD2  HIS  31           HD2      HIS  31 -19.102   0.379  15.112
  244    HE1  HIS  31           HE1      HIS  31 -20.250   2.014  11.344
  245    H    SER  32           H        SER  32 -16.228  -3.739  11.897
  246    HA   SER  32           HA       SER  32 -16.245  -6.168  13.452
  247    HB2  SER  32           HB2      SER  32 -14.603  -5.432  10.990
  248    HB3  SER  32           HB3      SER  32 -14.982  -7.065  11.575
  249    HG   SER  32           HG       SER  32 -16.388  -6.391   9.856
  250    H    TRP  33           H        TRP  33 -14.211  -7.373  14.063
  251    HA   TRP  33           HA       TRP  33 -12.272  -5.492  15.300
  252    HB2  TRP  33           HB2      TRP  33 -13.309  -8.196  16.110
  253    HB3  TRP  33           HB3      TRP  33 -11.993  -7.339  16.933
  254    HD1  TRP  33           HD1      TRP  33 -15.784  -7.016  16.288
  255    HE1  TRP  33           HE1      TRP  33 -16.848  -5.701  18.196
  256    HE3  TRP  33           HE3      TRP  33 -11.549  -5.849  18.885
  257    HZ2  TRP  33           HZ2      TRP  33 -15.944  -4.167  20.504
  258    HZ3  TRP  33           HZ3      TRP  33 -11.665  -4.387  20.878
  259    HH2  TRP  33           HH2      TRP  33 -13.849  -3.527  21.694
  260    H    GLN  34           H        GLN  34 -10.063  -6.049  15.394
  261    HA   GLN  34           HA       GLN  34  -9.011  -7.947  13.368
  262    HB2  GLN  34           HB2      GLN  34  -8.566  -4.922  13.497
  263    HB3  GLN  34           HB3      GLN  34  -7.568  -6.027  12.557
  264    HG2  GLN  34           HG2      GLN  34  -9.564  -6.657  11.203
  265    HG3  GLN  34           HG3      GLN  34 -10.502  -5.422  12.058
  266   HE21  GLN  34          HE22      GLN  34 -10.273  -5.233   9.285
  267   HE22  GLN  34          HE21      GLN  34  -9.199  -3.929   8.852
  268    H    PHE  35           H        PHE  35  -6.768  -8.324  13.583
  269    HA   PHE  35           HA       PHE  35  -5.533  -7.696  16.197
  270    HB2  PHE  35           HB2      PHE  35  -4.591  -9.293  13.788
  271    HB3  PHE  35           HB3      PHE  35  -3.632  -9.048  15.235
  272    HD1  PHE  35           HD1      PHE  35  -5.073  -9.629  17.521
  273    HD2  PHE  35           HD2      PHE  35  -5.511 -11.466  13.615
  274    HE1  PHE  35           HE1      PHE  35  -6.103 -11.617  18.571
  275    HE2  PHE  35           HE2      PHE  35  -6.532 -13.445  14.692
  276    HZ   PHE  35           HZ       PHE  35  -6.855 -13.522  17.150
  277    HA   PRO  36           HA       PRO  36  -4.262  -3.806  14.404
  278    HB2  PRO  36           HB2      PRO  36  -1.728  -4.269  16.029
  279    HB3  PRO  36           HB3      PRO  36  -2.669  -2.766  15.862
  280    HG2  PRO  36           HG2      PRO  36  -2.987  -4.291  18.052
  281    HG3  PRO  36           HG3      PRO  36  -4.446  -3.642  17.230
  282    HD2  PRO  36           HD2      PRO  36  -3.276  -6.423  17.070
  283    HD3  PRO  36           HD3      PRO  36  -4.988  -5.899  17.168
  284    H    GLN  37           H        GLN  37  -3.298  -3.294  12.362
  285    HA   GLN  37           HA       GLN  37  -0.900  -4.724  11.502
  286    HB2  GLN  37           HB2      GLN  37  -1.977  -6.051   9.749
  287    HB3  GLN  37           HB3      GLN  37  -2.639  -6.488  11.313
  288    HG2  GLN  37           HG2      GLN  37  -4.604  -4.915  10.778
  289    HG3  GLN  37           HG3      GLN  37  -3.927  -4.767   9.150
  290   HE21  GLN  37          HE22      GLN  37  -5.282  -7.044  11.541
  291   HE22  GLN  37          HE21      GLN  37  -5.810  -8.245  10.358
  292    H    GLY  38           H        GLY  38  -0.316  -4.294   9.238
  293    HA2  GLY  38           HA2      GLY  38  -1.712  -2.352   7.660
  294    HA3  GLY  38           HA3      GLY  38  -0.378  -1.577   8.511
  295    H    GLY  39           H        GLY  39   0.083  -1.299   5.995
  296    HA2  GLY  39           HA2      GLY  39   1.156  -3.660   4.708
  297    HA3  GLY  39           HA3      GLY  39   0.918  -2.062   3.996
  298    H    ILE  40           H        ILE  40   3.118  -3.808   3.879
  299    HA   ILE  40           HA       ILE  40   5.381  -2.504   5.279
  300    HB   ILE  40           HB       ILE  40   5.279  -4.614   3.077
  301   HG12  ILE  40          HG12      ILE  40   6.175  -4.924   5.974
  302   HG13  ILE  40          HG13      ILE  40   4.506  -5.192   5.500
  303   HG21  ILE  40          HG21      ILE  40   7.686  -3.605   4.651
  304   HG22  ILE  40          HG22      ILE  40   7.709  -4.961   3.521
  305   HG23  ILE  40          HG23      ILE  40   7.391  -3.350   2.913
  306   HD11  ILE  40          HD11      ILE  40   4.960  -7.140   4.375
  307   HD12  ILE  40          HD12      ILE  40   6.677  -6.767   4.101
  308   HD13  ILE  40          HD13      ILE  40   6.115  -7.218   5.712
  309    H    ASN  41           H        ASN  41   6.329  -0.687   4.529
  310    HA   ASN  41           HA       ASN  41   5.386   0.606   2.082
  311    HB2  ASN  41           HB2      ASN  41   7.495   1.352   4.156
  312    HB3  ASN  41           HB3      ASN  41   7.165   2.331   2.749
  313   HD21  ASN  41          HD22      ASN  41   5.691   0.973   5.686
  314   HD22  ASN  41          HD21      ASN  41   4.303   2.071   5.725
  315    HA   PRO  42           HA       PRO  42   8.311  -1.154  -0.644
  316    HB2  PRO  42           HB2      PRO  42   9.279   0.902  -2.224
  317    HB3  PRO  42           HB3      PRO  42   7.658   0.166  -2.391
  318    HG2  PRO  42           HG2      PRO  42   8.434   2.702  -0.928
  319    HG3  PRO  42           HG3      PRO  42   7.049   2.443  -2.036
  320    HD2  PRO  42           HD2      PRO  42   6.781   2.381   0.670
  321    HD3  PRO  42           HD3      PRO  42   5.827   1.293  -0.365
  322    H    GLY  43           H        GLY  43  10.236  -1.934   0.036
  323    HA2  GLY  43           HA2      GLY  43  12.495  -1.954   0.523
  324    HA3  GLY  43           HA3      GLY  43  12.507  -0.196   0.677
  325    H    GLU  44           H        GLU  44   9.929  -1.275   2.660
  326    HA   GLU  44           HA       GLU  44  11.522  -1.074   5.074
  327    HB2  GLU  44           HB2      GLU  44   8.673  -1.094   4.417
  328    HB3  GLU  44           HB3      GLU  44   9.021  -2.221   5.730
  329    HG2  GLU  44           HG2      GLU  44   9.890  -0.592   7.127
  330    HG3  GLU  44           HG3      GLU  44  10.056   0.590   5.809
  331    H    SER  45           H        SER  45  11.720  -2.776   6.631
  332    HA   SER  45           HA       SER  45  11.736  -5.541   5.521
  333    HB2  SER  45           HB2      SER  45  12.968  -4.485   8.104
  334    HB3  SER  45           HB3      SER  45  13.154  -6.106   7.413
  335    HG   SER  45           HG       SER  45  14.953  -4.736   6.926
  336    H    ALA  46           H        ALA  46  10.544  -7.163   6.819
  337    HA   ALA  46           HA       ALA  46   7.963  -6.271   7.397
  338    HB1  ALA  46           HB1      ALA  46   8.610  -8.596   6.780
  339    HB2  ALA  46           HB2      ALA  46   9.318  -8.820   8.404
  340    HB3  ALA  46           HB3      ALA  46   7.563  -8.552   8.210
  341    H    GLU  47           H        GLU  47  10.627  -6.912   9.677
  342    HA   GLU  47           HA       GLU  47   9.079  -6.514  12.054
  343    HB2  GLU  47           HB2      GLU  47  11.137  -7.805  11.852
  344    HB3  GLU  47           HB3      GLU  47  12.064  -6.338  11.510
  345    HG2  GLU  47           HG2      GLU  47  11.435  -5.451  13.766
  346    HG3  GLU  47           HG3      GLU  47  10.575  -6.961  14.086
  347    H    GLN  48           H        GLN  48  10.767  -4.286   9.853
  348    HA   GLN  48           HA       GLN  48  10.630  -2.012  11.643
  349    HB2  GLN  48           HB2      GLN  48  11.080  -2.161   8.651
  350    HB3  GLN  48           HB3      GLN  48  11.137  -0.671   9.598
  351    HG2  GLN  48           HG2      GLN  48  12.813  -3.134  10.170
  352    HG3  GLN  48           HG3      GLN  48  13.393  -1.768   9.211
  353   HE21  GLN  48          HE22      GLN  48  14.258  -3.024  11.861
  354   HE22  GLN  48          HE21      GLN  48  14.343  -1.677  12.975
  355    H    ALA  49           H        ALA  49   8.580  -3.391   8.983
  356    HA   ALA  49           HA       ALA  49   6.610  -1.310   9.041
  357    HB1  ALA  49           HB1      ALA  49   6.870  -2.961   7.211
  358    HB2  ALA  49           HB2      ALA  49   6.313  -4.267   8.311
  359    HB3  ALA  49           HB3      ALA  49   5.217  -2.943   7.876
  360    H    MET  50           H        MET  50   7.112  -4.330  10.938
  361    HA   MET  50           HA       MET  50   4.648  -4.228  12.346
  362    HB2  MET  50           HB2      MET  50   5.984  -6.226  12.284
  363    HB3  MET  50           HB3      MET  50   7.348  -5.443  13.072
  364    HG2  MET  50           HG2      MET  50   4.638  -5.802  14.332
  365    HG3  MET  50           HG3      MET  50   5.951  -6.951  14.487
  366    HE1  MET  50           HE1      MET  50   8.128  -6.652  15.525
  367    HE2  MET  50           HE2      MET  50   8.600  -5.022  14.986
  368    HE3  MET  50           HE3      MET  50   8.550  -5.409  16.717
  369    H    TYR  51           H        TYR  51   7.916  -2.861  13.336
  370    HA   TYR  51           HA       TYR  51   6.723  -1.669  15.634
  371    HB2  TYR  51           HB2      TYR  51   9.270  -0.927  14.172
  372    HB3  TYR  51           HB3      TYR  51   8.759  -0.233  15.716
  373    HD1  TYR  51           HD2      TYR  51   7.988  -2.095  17.538
  374    HD2  TYR  51           HD1      TYR  51  10.939  -2.573  14.429
  375    HE1  TYR  51           HE2      TYR  51   9.280  -3.605  19.007
  376    HE2  TYR  51           HE1      TYR  51  12.224  -4.101  15.873
  377    HH   TYR  51           HH       TYR  51  11.225  -4.912  19.245
  378    H    ARG  52           H        ARG  52   6.969  -0.379  12.240
  379    HA   ARG  52           HA       ARG  52   6.060   2.256  12.900
  380    HB2  ARG  52           HB2      ARG  52   6.910   1.802  10.685
  381    HB3  ARG  52           HB3      ARG  52   5.791   0.453  10.468
  382    HG2  ARG  52           HG2      ARG  52   3.857   2.076  10.529
  383    HG3  ARG  52           HG3      ARG  52   5.026   3.404  10.588
  384    HD2  ARG  52           HD2      ARG  52   5.106   1.223   8.482
  385    HD3  ARG  52           HD3      ARG  52   3.979   2.585   8.317
  386    HE   ARG  52           HE       ARG  52   6.828   2.534   7.849
  387   HH11  ARG  52          HH11      ARG  52   4.133   4.736   8.758
  388   HH12  ARG  52          HH12      ARG  52   4.911   6.138   8.103
  389   HH21  ARG  52          HH21      ARG  52   7.857   4.397   7.087
  390   HH22  ARG  52          HH22      ARG  52   7.096   5.952   7.149
  391    H    GLU  53           H        GLU  53   4.240  -0.779  12.023
  392    HA   GLU  53           HA       GLU  53   1.766   0.600  12.238
  393    HB2  GLU  53           HB2      GLU  53   2.421  -2.343  12.052
  394    HB3  GLU  53           HB3      GLU  53   0.763  -1.722  12.098
  395    HG2  GLU  53           HG2      GLU  53   2.903  -0.907  10.102
  396    HG3  GLU  53           HG3      GLU  53   1.596  -2.042   9.772
  397    H    LEU  54           H        LEU  54   3.714  -1.178  14.594
  398    HA   LEU  54           HA       LEU  54   1.822  -1.337  16.691
  399    HB2  LEU  54           HB2      LEU  54   4.097  -2.369  16.584
  400    HB3  LEU  54           HB3      LEU  54   4.800  -0.759  16.806
  401    HG   LEU  54           HG       LEU  54   3.371  -0.706  19.018
  402   HD11  LEU  54          HD11      LEU  54   3.545  -3.697  18.386
  403   HD12  LEU  54          HD12      LEU  54   3.098  -3.035  19.967
  404   HD13  LEU  54          HD13      LEU  54   2.052  -2.747  18.563
  405   HD21  LEU  54          HD21      LEU  54   5.846  -0.784  18.904
  406   HD22  LEU  54          HD22      LEU  54   5.219  -1.763  20.231
  407   HD23  LEU  54          HD23      LEU  54   5.772  -2.553  18.725
  408    H    PHE  55           H        PHE  55   3.977   1.395  15.657
  409    HA   PHE  55           HA       PHE  55   2.907   3.183  17.654
  410    HB2  PHE  55           HB2      PHE  55   5.116   3.500  16.603
  411    HB3  PHE  55           HB3      PHE  55   4.343   3.808  15.051
  412    HD1  PHE  55           HD2      PHE  55   4.536   5.038  18.590
  413    HD2  PHE  55           HD1      PHE  55   3.591   6.010  14.485
  414    HE1  PHE  55           HE2      PHE  55   4.311   7.441  19.202
  415    HE2  PHE  55           HE1      PHE  55   3.379   8.404  15.106
  416    HZ   PHE  55           HZ       PHE  55   3.735   9.121  17.458
  417    H    GLU  56           H        GLU  56   2.148   2.768  14.103
  418    HA   GLU  56           HA       GLU  56   0.311   4.883  14.156
  419    HB2  GLU  56           HB2      GLU  56   0.605   2.578  12.203
  420    HB3  GLU  56           HB3      GLU  56  -0.534   3.913  11.991
  421    HG2  GLU  56           HG2      GLU  56   1.457   5.510  12.246
  422    HG3  GLU  56           HG3      GLU  56   2.508   4.105  12.153
  423    H    GLU  57           H        GLU  57  -0.222   1.458  14.900
  424    HA   GLU  57           HA       GLU  57  -3.144   1.757  14.909
  425    HB2  GLU  57           HB2      GLU  57  -1.353  -0.592  15.650
  426    HB3  GLU  57           HB3      GLU  57  -3.092  -0.629  15.523
  427    HG2  GLU  57           HG2      GLU  57  -1.372  -0.003  13.115
  428    HG3  GLU  57           HG3      GLU  57  -1.750  -1.642  13.629
  429    H    VAL  58           H        VAL  58  -0.524   0.965  17.249
  430    HA   VAL  58           HA       VAL  58  -2.484   0.937  19.459
  431    HB   VAL  58           HB       VAL  58   0.445   0.190  19.641
  432   HG11  VAL  58          HG11      VAL  58  -2.017  -0.927  20.994
  433   HG12  VAL  58          HG12      VAL  58  -0.333  -1.451  21.254
  434   HG13  VAL  58          HG13      VAL  58  -0.807   0.193  21.698
  435   HG21  VAL  58          HG21      VAL  58  -1.731  -1.542  18.405
  436   HG22  VAL  58          HG22      VAL  58  -0.192  -1.012  17.665
  437   HG23  VAL  58          HG23      VAL  58  -0.177  -2.164  19.005
  438    H    GLY  59           H        GLY  59   0.327   2.683  18.318
  439    HA2  GLY  59           HA2      GLY  59   1.143   4.802  18.950
  440    HA3  GLY  59           HA3      GLY  59   0.007   4.850  20.309
  441    H    LEU  60           H        LEU  60   1.377   1.853  20.390
  442    HA   LEU  60           HA       LEU  60   3.210   2.368  22.570
  443    HB2  LEU  60           HB2      LEU  60   1.528   0.547  22.403
  444    HB3  LEU  60           HB3      LEU  60   2.339  -0.060  20.955
  445    HG   LEU  60           HG       LEU  60   4.315  -0.696  22.322
  446   HD11  LEU  60          HD11      LEU  60   4.184   0.946  24.137
  447   HD12  LEU  60          HD12      LEU  60   2.616   0.282  24.642
  448   HD13  LEU  60          HD13      LEU  60   4.087  -0.711  24.761
  449   HD21  LEU  60          HD21      LEU  60   2.303  -2.181  21.884
  450   HD22  LEU  60          HD22      LEU  60   3.038  -2.526  23.458
  451   HD23  LEU  60          HD23      LEU  60   1.537  -1.563  23.352
  452    H    SER  61           H        SER  61   5.475   1.673  22.430
  453    HA   SER  61           HA       SER  61   6.647   1.776  19.694
  454    HB2  SER  61           HB2      SER  61   8.309   3.385  20.684
  455    HB3  SER  61           HB3      SER  61   6.657   4.003  20.586
  456    HG   SER  61           HG       SER  61   7.545   4.457  22.642
  457    H    ARG  62           H        ARG  62   9.018   1.273  19.805
  458    HA   ARG  62           HA       ARG  62   9.616  -1.329  20.335
  459    HB2  ARG  62           HB2      ARG  62  11.483   1.073  20.329
  460    HB3  ARG  62           HB3      ARG  62  12.007  -0.611  20.374
  461    HG2  ARG  62           HG2      ARG  62  10.292  -0.832  18.321
  462    HG3  ARG  62           HG3      ARG  62  10.606   0.883  18.160
  463    HD2  ARG  62           HD2      ARG  62  12.080  -0.396  16.744
  464    HD3  ARG  62           HD3      ARG  62  13.018   0.417  18.039
  465    HE   ARG  62           HE       ARG  62  12.253  -2.313  18.674
  466   HH11  ARG  62          HH11      ARG  62  14.736  -0.404  17.000
  467   HH12  ARG  62          HH12      ARG  62  15.871  -1.705  16.904
  468   HH21  ARG  62          HH21      ARG  62  13.693  -4.073  18.429
  469   HH22  ARG  62          HH22      ARG  62  15.286  -3.827  17.801
  470    H    LYS  63           H        LYS  63   9.947   1.420  22.584
  471    HA   LYS  63           HA       LYS  63  11.708   0.117  24.384
  472    HB2  LYS  63           HB2      LYS  63   9.856   2.432  25.085
  473    HB3  LYS  63           HB3      LYS  63  11.451   2.063  25.762
  474    HG2  LYS  63           HG2      LYS  63  10.838   3.189  23.017
  475    HG3  LYS  63           HG3      LYS  63  11.597   4.022  24.368
  476    HD2  LYS  63           HD2      LYS  63  12.761   1.526  23.146
  477    HD3  LYS  63           HD3      LYS  63  13.120   3.110  22.474
  478    HE2  LYS  63           HE2      LYS  63  13.626   2.376  25.401
  479    HE3  LYS  63           HE3      LYS  63  14.836   2.134  24.132
  480    HZ1  LYS  63           HZ1      LYS  63  13.704   4.768  24.905
  481    HZ2  LYS  63           HZ2      LYS  63  15.199   4.218  25.251
  482    HZ3  LYS  63           HZ3      LYS  63  14.796   4.522  23.702
  483    H    ASP  64           H        ASP  64   8.224   0.000  24.148
  484    HA   ASP  64           HA       ASP  64   8.213  -1.331  26.831
  485    HB2  ASP  64           HB2      ASP  64   7.049   0.911  26.634
  486    HB3  ASP  64           HB3      ASP  64   5.810   0.074  25.727
  487    H    VAL  65           H        VAL  65   8.676  -2.469  24.076
  488    HA   VAL  65           HA       VAL  65   6.926  -4.817  24.576
  489    HB   VAL  65           HB       VAL  65   6.637  -5.160  22.172
  490   HG11  VAL  65          HG11      VAL  65   5.590  -2.439  22.993
  491   HG12  VAL  65          HG12      VAL  65   4.874  -3.564  21.806
  492   HG13  VAL  65          HG13      VAL  65   4.901  -3.985  23.528
  493   HG21  VAL  65          HG21      VAL  65   8.588  -3.910  21.307
  494   HG22  VAL  65          HG22      VAL  65   7.100  -3.348  20.540
  495   HG23  VAL  65          HG23      VAL  65   7.854  -2.384  21.813
  496    H    ARG  66           H        ARG  66   7.682  -6.808  23.561
  497    HA   ARG  66           HA       ARG  66  10.453  -6.824  22.558
  498    HB2  ARG  66           HB2      ARG  66  11.106  -8.740  23.857
  499    HB3  ARG  66           HB3      ARG  66  10.779  -7.345  24.873
  500    HG2  ARG  66           HG2      ARG  66   8.580  -9.416  24.562
  501    HG3  ARG  66           HG3      ARG  66  10.007  -9.842  25.483
  502    HD2  ARG  66           HD2      ARG  66   8.353  -7.360  26.094
  503    HD3  ARG  66           HD3      ARG  66   8.155  -8.943  26.873
  504    HE   ARG  66           HE       ARG  66  10.832  -7.639  26.891
  505   HH11  ARG  66          HH21      ARG  66   7.976  -8.492  28.883
  506   HH12  ARG  66          HH22      ARG  66   8.914  -8.537  30.354
  507   HH21  ARG  66          HH11      ARG  66  11.950  -7.550  28.905
  508   HH22  ARG  66          HH12      ARG  66  11.081  -7.870  30.380
  509    H    ILE  67           H        ILE  67  10.545  -8.183  20.705
  510    HA   ILE  67           HA       ILE  67   8.085  -9.473  19.861
  511    HB   ILE  67           HB       ILE  67  10.861  -9.713  18.664
  512   HG12  ILE  67          HG12      ILE  67   8.803  -7.625  17.867
  513   HG13  ILE  67          HG13      ILE  67  10.247  -7.294  18.813
  514   HG21  ILE  67          HG21      ILE  67   9.721 -10.391  16.623
  515   HG22  ILE  67          HG22      ILE  67   9.150 -11.392  17.938
  516   HG23  ILE  67          HG23      ILE  67   8.135 -10.069  17.342
  517   HD11  ILE  67          HD11      ILE  67  10.208  -8.308  15.955
  518   HD12  ILE  67          HD12      ILE  67  10.707  -6.714  16.541
  519   HD13  ILE  67          HD13      ILE  67  11.665  -8.135  16.973
  520    H    LEU  68           H        LEU  68   7.506 -11.327  20.730
  521    HA   LEU  68           HA       LEU  68   9.506 -13.135  21.978
  522    HB2  LEU  68           HB2      LEU  68   6.477 -13.261  21.732
  523    HB3  LEU  68           HB3      LEU  68   7.480 -14.382  22.638
  524    HG   LEU  68           HG       LEU  68   7.191 -11.408  23.337
  525   HD11  LEU  68          HD11      LEU  68   5.774 -13.946  24.170
  526   HD12  LEU  68          HD12      LEU  68   5.997 -12.616  25.302
  527   HD13  LEU  68          HD13      LEU  68   5.132 -12.323  23.772
  528   HD21  LEU  68          HD21      LEU  68   8.563 -13.707  24.797
  529   HD22  LEU  68          HD22      LEU  68   9.357 -12.287  24.064
  530   HD23  LEU  68          HD23      LEU  68   8.279 -12.072  25.441
  531    H    ALA  69           H        ALA  69   7.349 -12.881  19.112
  532    HA   ALA  69           HA       ALA  69   8.548 -15.200  17.842
  533    HB1  ALA  69           HB1      ALA  69   6.904 -16.212  19.489
  534    HB2  ALA  69           HB2      ALA  69   5.610 -15.402  18.596
  535    HB3  ALA  69           HB3      ALA  69   6.630 -16.617  17.794
  536    H    SER  70           H        SER  70   7.524 -15.592  15.785
  537    HA   SER  70           HA       SER  70   5.809 -13.682  14.607
  538    HB2  SER  70           HB2      SER  70   7.499 -12.806  12.897
  539    HB3  SER  70           HB3      SER  70   7.614 -12.161  14.539
  540    HG   SER  70           HG       SER  70   9.690 -12.761  13.674
  541    H    THR  71           H        THR  71   5.280 -14.254  12.271
  542    HA   THR  71           HA       THR  71   5.333 -17.155  12.085
  543    HB   THR  71           HB       THR  71   4.196 -16.599   9.805
  544    HG1  THR  71           HG1      THR  71   4.520 -14.541   9.480
  545   HG21  THR  71          HG21      THR  71   3.126 -16.382  12.556
  546   HG22  THR  71          HG22      THR  71   2.105 -15.748  11.236
  547   HG23  THR  71          HG23      THR  71   2.699 -17.418  11.185
  548    H    ARG  72           H        ARG  72   6.447 -18.456  10.801
  549    HA   ARG  72           HA       ARG  72   8.869 -17.383   9.493
  550    HB2  ARG  72           HB2      ARG  72   7.800 -20.239   9.604
  551    HB3  ARG  72           HB3      ARG  72   9.380 -19.731   9.003
  552    HG2  ARG  72           HG2      ARG  72  10.191 -19.980  11.091
  553    HG3  ARG  72           HG3      ARG  72   9.242 -18.574  11.572
  554    HD2  ARG  72           HD2      ARG  72   7.296 -20.191  12.009
  555    HD3  ARG  72           HD3      ARG  72   8.437 -21.508  11.780
  556    HE   ARG  72           HE       ARG  72   8.247 -19.578  13.996
  557   HH11  ARG  72          HH11      ARG  72  10.266 -22.127  12.538
  558   HH12  ARG  72          HH12      ARG  72  11.172 -22.422  13.979
  559   HH21  ARG  72          HH21      ARG  72   9.460 -19.988  15.916
  560   HH22  ARG  72          HH22      ARG  72  10.702 -21.183  15.933
  561    H    ASN  73           H        ASN  73   5.950 -19.118   8.540
  562    HA   ASN  73           HA       ASN  73   6.160 -18.604   5.713
  563    HB2  ASN  73           HB2      ASN  73   3.896 -19.563   5.616
  564    HB3  ASN  73           HB3      ASN  73   4.938 -20.561   6.608
  565   HD21  ASN  73          HD22      ASN  73   4.182 -21.056   8.723
  566   HD22  ASN  73          HD21      ASN  73   2.876 -20.219   9.530
  567    H    TRP  74           H        TRP  74   4.227 -17.489   4.609
  568    HA   TRP  74           HA       TRP  74   3.371 -14.990   6.023
  569    HB2  TRP  74           HB2      TRP  74   3.769 -15.514   3.037
  570    HB3  TRP  74           HB3      TRP  74   2.984 -14.111   3.725
  571    HD1  TRP  74           HD1      TRP  74   6.450 -15.720   3.396
  572    HE1  TRP  74           HE1      TRP  74   8.258 -13.919   3.619
  573    HE3  TRP  74           HE3      TRP  74   3.493 -11.735   4.664
  574    HZ2  TRP  74           HZ2      TRP  74   8.423 -11.178   4.414
  575    HZ3  TRP  74           HZ3      TRP  74   4.509  -9.543   5.187
  576    HH2  TRP  74           HH2      TRP  74   6.984  -9.312   5.244
  577    H    LEU  75           H        LEU  75   1.198 -15.170   6.530
  578    HA   LEU  75           HA       LEU  75  -0.451 -17.227   5.218
  579    HB2  LEU  75           HB2      LEU  75  -1.226 -15.075   7.226
  580    HB3  LEU  75           HB3      LEU  75  -2.263 -16.354   6.622
  581    HG   LEU  75           HG       LEU  75   0.030 -17.735   7.481
  582   HD11  LEU  75          HD11      LEU  75   0.898 -15.789   8.618
  583   HD12  LEU  75          HD12      LEU  75  -0.627 -15.672   9.548
  584   HD13  LEU  75          HD13      LEU  75   0.447 -17.067   9.752
  585   HD21  LEU  75          HD21      LEU  75  -2.504 -17.296   9.123
  586   HD22  LEU  75          HD22      LEU  75  -2.356 -18.447   7.769
  587   HD23  LEU  75          HD23      LEU  75  -1.340 -18.642   9.193
  588    H    ARG  76           H        ARG  76  -2.037 -16.845   3.622
  589    HA   ARG  76           HA       ARG  76  -2.468 -14.056   2.704
  590    HB2  ARG  76           HB2      ARG  76  -0.725 -14.787   1.298
  591    HB3  ARG  76           HB3      ARG  76  -1.321 -16.451   1.261
  592    HG2  ARG  76           HG2      ARG  76  -3.197 -15.779  -0.192
  593    HG3  ARG  76           HG3      ARG  76  -2.603 -14.109  -0.215
  594    HD2  ARG  76           HD2      ARG  76  -0.892 -16.507  -0.946
  595    HD3  ARG  76           HD3      ARG  76  -1.963 -15.737  -2.141
  596    HE   ARG  76           HE       ARG  76  -0.386 -13.707  -0.937
  597   HH11  ARG  76          HH11      ARG  76   0.129 -16.549  -3.031
  598   HH12  ARG  76          HH12      ARG  76   1.392 -15.826  -3.957
  599   HH21  ARG  76          HH21      ARG  76   1.298 -12.725  -2.239
  600   HH22  ARG  76          HH22      ARG  76   2.083 -13.632  -3.477
  601    H    TYR  77           H        TYR  77  -4.446 -13.785   1.622
  602    HA   TYR  77           HA       TYR  77  -6.209 -16.102   1.198
  603    HB2  TYR  77           HB2      TYR  77  -8.158 -14.961   2.127
  604    HB3  TYR  77           HB3      TYR  77  -6.974 -15.389   3.348
  605    HD1  TYR  77           HD1      TYR  77  -5.527 -13.638   4.388
  606    HD2  TYR  77           HD2      TYR  77  -8.749 -12.648   1.696
  607    HE1  TYR  77           HE1      TYR  77  -5.449 -11.304   5.172
  608    HE2  TYR  77           HE2      TYR  77  -8.680 -10.314   2.465
  609    HH   TYR  77           HH       TYR  77  -7.659  -8.746   3.908
  610    H    LYS  78           H        LYS  78  -7.439 -15.836  -0.705
  611    HA   LYS  78           HA       LYS  78  -6.842 -13.443  -2.358
  612    HB2  LYS  78           HB2      LYS  78  -8.185 -16.104  -2.820
  613    HB3  LYS  78           HB3      LYS  78  -8.798 -14.733  -3.731
  614    HG2  LYS  78           HG2      LYS  78  -7.152 -15.923  -5.014
  615    HG3  LYS  78           HG3      LYS  78  -6.636 -14.264  -4.696
  616    HD2  LYS  78           HD2      LYS  78  -5.055 -14.986  -3.013
  617    HD3  LYS  78           HD3      LYS  78  -5.647 -16.656  -3.064
  618    HE2  LYS  78           HE2      LYS  78  -4.364 -15.190  -5.424
  619    HE3  LYS  78           HE3      LYS  78  -3.455 -16.189  -4.284
  620    HZ1  LYS  78           HZ1      LYS  78  -5.616 -17.194  -6.067
  621    HZ2  LYS  78           HZ2      LYS  78  -4.021 -17.472  -6.233
  622    HZ3  LYS  78           HZ3      LYS  78  -4.818 -18.104  -4.961
  623    H    LEU  79           H        LEU  79  -8.238 -11.770  -2.646
  624    HA   LEU  79           HA       LEU  79 -10.391 -11.313  -0.802
  625    HB2  LEU  79           HB2      LEU  79  -9.857 -10.054  -3.536
  626    HB3  LEU  79           HB3      LEU  79 -10.949  -9.431  -2.306
  627    HG   LEU  79           HG       LEU  79  -7.919  -9.481  -2.271
  628   HD11  LEU  79          HD11      LEU  79  -8.230  -7.035  -2.137
  629   HD12  LEU  79          HD12      LEU  79  -9.010  -7.720  -3.572
  630   HD13  LEU  79          HD13      LEU  79 -10.000  -7.252  -2.175
  631   HD21  LEU  79          HD21      LEU  79  -8.096  -8.389  -0.022
  632   HD22  LEU  79          HD22      LEU  79  -9.814  -8.873   0.017
  633   HD23  LEU  79          HD23      LEU  79  -8.522 -10.110  -0.074
  634    HA   PRO  80           HA       PRO  80 -13.590 -13.283  -3.386
  635    HB2  PRO  80           HB2      PRO  80 -15.824 -12.225  -2.140
  636    HB3  PRO  80           HB3      PRO  80 -14.865 -13.558  -1.411
  637    HG2  PRO  80           HG2      PRO  80 -14.675 -10.605  -0.883
  638    HG3  PRO  80           HG3      PRO  80 -14.817 -11.921   0.325
  639    HD2  PRO  80           HD2      PRO  80 -12.391 -10.851  -0.325
  640    HD3  PRO  80           HD3      PRO  80 -12.563 -12.611  -0.047
  641    H    LYS  81           H        LYS  81 -14.736 -12.255  -5.293
  642    HA   LYS  81           HA       LYS  81 -13.360  -9.857  -5.891
  643    HB2  LYS  81           HB2      LYS  81 -15.541 -11.030  -7.569
  644    HB3  LYS  81           HB3      LYS  81 -14.283  -9.817  -8.009
  645    HG2  LYS  81           HG2      LYS  81 -12.524 -11.388  -7.864
  646    HG3  LYS  81           HG3      LYS  81 -13.561 -12.619  -7.137
  647    HD2  LYS  81           HD2      LYS  81 -13.154 -13.136  -9.470
  648    HD3  LYS  81           HD3      LYS  81 -14.869 -12.840  -9.168
  649    HE2  LYS  81           HE2      LYS  81 -14.663 -10.573 -10.166
  650    HE3  LYS  81           HE3      LYS  81 -12.934 -10.864 -10.453
  651    HZ1  LYS  81           HZ1      LYS  81 -15.151 -12.415 -11.677
  652    HZ2  LYS  81           HZ2      LYS  81 -14.243 -11.291 -12.436
  653    HZ3  LYS  81           HZ3      LYS  81 -13.557 -12.685 -11.938
  654    H    ARG  82           H        ARG  82 -16.409 -10.158  -4.327
  655    HA   ARG  82           HA       ARG  82 -17.438  -7.606  -4.948
  656    HB2  ARG  82           HB2      ARG  82 -18.647  -7.692  -2.855
  657    HB3  ARG  82           HB3      ARG  82 -18.737  -9.225  -3.727
  658    HG2  ARG  82           HG2      ARG  82 -16.836 -10.011  -2.131
  659    HG3  ARG  82           HG3      ARG  82 -17.201  -8.564  -1.182
  660    HD2  ARG  82           HD2      ARG  82 -19.193 -10.724  -1.960
  661    HD3  ARG  82           HD3      ARG  82 -18.373 -10.630  -0.389
  662    HE   ARG  82           HE       ARG  82 -19.586  -8.151  -0.704
  663   HH11  ARG  82          HH11      ARG  82 -20.730 -11.514  -0.540
  664   HH12  ARG  82          HH12      ARG  82 -22.271 -11.103   0.121
  665   HH21  ARG  82          HH21      ARG  82 -21.652  -7.597   0.151
  666   HH22  ARG  82          HH22      ARG  82 -22.806  -8.830   0.518
  667    H    LEU  83           H        LEU  83 -14.704  -8.434  -2.901
  668    HA   LEU  83           HA       LEU  83 -14.555  -5.708  -1.827
  669    HB2  LEU  83           HB2      LEU  83 -12.753  -8.096  -1.347
  670    HB3  LEU  83           HB3      LEU  83 -12.709  -6.567  -0.475
  671    HG   LEU  83           HG       LEU  83 -14.990  -8.574  -0.457
  672   HD11  LEU  83          HD11      LEU  83 -13.172  -7.761   1.833
  673   HD12  LEU  83          HD12      LEU  83 -14.404  -9.053   1.811
  674   HD13  LEU  83          HD13      LEU  83 -12.945  -9.210   0.835
  675   HD21  LEU  83          HD21      LEU  83 -16.008  -7.200   1.338
  676   HD22  LEU  83          HD22      LEU  83 -14.836  -5.911   0.973
  677   HD23  LEU  83          HD23      LEU  83 -16.030  -6.432  -0.251
  678    H    VAL  84           H        VAL  84 -13.223  -7.527  -4.453
  679    HA   VAL  84           HA       VAL  84 -10.723  -6.150  -4.713
  680    HB   VAL  84           HB       VAL  84 -12.481  -7.481  -6.837
  681   HG11  VAL  84          HG11      VAL  84  -9.589  -6.588  -6.867
  682   HG12  VAL  84          HG12      VAL  84 -10.232  -7.763  -8.024
  683   HG13  VAL  84          HG13      VAL  84 -10.891  -6.123  -7.981
  684   HG21  VAL  84          HG21      VAL  84 -10.030  -8.770  -5.614
  685   HG22  VAL  84          HG22      VAL  84 -11.642  -9.033  -4.930
  686   HG23  VAL  84          HG23      VAL  84 -11.329  -9.484  -6.616
  687    H    ARG  85           H        ARG  85 -10.293  -4.140  -5.555
  688    HA   ARG  85           HA       ARG  85 -12.495  -2.663  -6.850
  689    HB2  ARG  85           HB2      ARG  85 -10.340  -1.950  -4.991
  690    HB3  ARG  85           HB3      ARG  85 -10.295  -0.916  -6.427
  691    HG2  ARG  85           HG2      ARG  85 -12.798  -1.483  -4.849
  692    HG3  ARG  85           HG3      ARG  85 -11.743  -0.060  -4.600
  693    HD2  ARG  85           HD2      ARG  85 -12.063   0.442  -7.097
  694    HD3  ARG  85           HD3      ARG  85 -13.374  -0.729  -7.109
  695    HE   ARG  85           HE       ARG  85 -13.275   1.944  -5.895
  696   HH11  ARG  85          HH21      ARG  85 -15.153  -1.100  -5.932
  697   HH12  ARG  85          HH22      ARG  85 -16.599  -0.354  -5.361
  698   HH21  ARG  85          HH11      ARG  85 -15.201   2.900  -5.135
  699   HH22  ARG  85          HH12      ARG  85 -16.624   1.958  -4.890
  700    H    TRP  86           H        TRP  86 -12.494  -3.661  -8.744
  701    HA   TRP  86           HA       TRP  86 -10.240  -3.882 -10.483
  702    HB2  TRP  86           HB2      TRP  86 -13.236  -3.804 -10.942
  703    HB3  TRP  86           HB3      TRP  86 -12.067  -4.204 -12.209
  704    HD1  TRP  86           HD1      TRP  86 -14.140  -5.827  -9.660
  705    HE1  TRP  86           HE1      TRP  86 -13.464  -8.251  -9.256
  706    HE3  TRP  86           HE3      TRP  86  -9.649  -5.832 -12.123
  707    HZ2  TRP  86           HZ2      TRP  86 -11.143  -9.942  -9.734
  708    HZ3  TRP  86           HZ3      TRP  86  -8.226  -7.867 -12.123
  709    HH2  TRP  86           HH2      TRP  86  -8.961  -9.918 -10.934
  710    H    ASP  87           H        ASP  87 -12.352  -1.210  -9.638
  711    HA   ASP  87           HA       ASP  87 -12.233   0.211 -12.108
  712    HB2  ASP  87           HB2      ASP  87 -14.037   0.430 -10.438
  713    HB3  ASP  87           HB3      ASP  87 -12.900   1.154  -9.299
  714    H    THR  88           H        THR  88  -9.876  -0.049  -9.579
  715    HA   THR  88           HA       THR  88  -8.504   2.389 -10.529
  716    HB   THR  88           HB       THR  88  -9.543   2.480  -8.195
  717    HG1  THR  88           HG1      THR  88  -7.900   3.789  -7.571
  718   HG21  THR  88          HG21      THR  88  -8.380   1.498  -6.355
  719   HG22  THR  88          HG22      THR  88  -8.672   0.184  -7.498
  720   HG23  THR  88          HG23      THR  88  -7.058   0.916  -7.398
  721    H    LYS  89           H        LYS  89  -6.109   2.271 -10.227
  722    HA   LYS  89           HA       LYS  89  -5.095  -0.423 -10.867
  723    HB2  LYS  89           HB2      LYS  89  -4.382   2.151 -12.309
  724    HB3  LYS  89           HB3      LYS  89  -3.750   0.552 -12.676
  725    HG2  LYS  89           HG2      LYS  89  -6.666   1.394 -12.955
  726    HG3  LYS  89           HG3      LYS  89  -5.479   1.365 -14.262
  727    HD2  LYS  89           HD2      LYS  89  -5.226  -1.085 -14.031
  728    HD3  LYS  89           HD3      LYS  89  -6.343  -1.095 -12.671
  729    HE2  LYS  89           HE2      LYS  89  -7.567  -1.837 -14.567
  730    HE3  LYS  89           HE3      LYS  89  -8.163  -0.232 -14.137
  731    HZ1  LYS  89           HZ1      LYS  89  -7.845  -0.501 -16.531
  732    HZ2  LYS  89           HZ2      LYS  89  -6.853   0.671 -15.984
  733    HZ3  LYS  89           HZ3      LYS  89  -6.258  -0.815 -16.348
  734    HA   PRO  90           HA       PRO  90  -3.439  -1.618 -10.824
  735    HB2  PRO  90           HB2      PRO  90  -1.860  -3.078  -9.233
  736    HB3  PRO  90           HB3      PRO  90  -1.220  -1.975 -10.498
  737    HG2  PRO  90           HG2      PRO  90  -1.522  -1.407  -7.524
  738    HG3  PRO  90           HG3      PRO  90  -0.062  -1.166  -8.539
  739    HD2  PRO  90           HD2      PRO  90  -1.825   0.856  -7.986
  740    HD3  PRO  90           HD3      PRO  90  -0.992   0.742  -9.566
  741    H    VAL  91           H        VAL  91  -4.803  -3.327 -10.221
  742    HA   VAL  91           HA       VAL  91  -6.422  -2.931  -7.835
  743    HB   VAL  91           HB       VAL  91  -7.595  -3.433  -9.836
  744   HG11  VAL  91          HG11      VAL  91  -5.897  -4.360 -11.302
  745   HG12  VAL  91          HG12      VAL  91  -5.778  -5.829 -10.302
  746   HG13  VAL  91          HG13      VAL  91  -7.254  -5.471 -11.219
  747   HG21  VAL  91          HG21      VAL  91  -8.365  -4.707  -7.799
  748   HG22  VAL  91          HG22      VAL  91  -8.824  -5.438  -9.349
  749   HG23  VAL  91          HG23      VAL  91  -7.490  -6.125  -8.417
  750    H    CYS  92           H        CYS  92  -6.483  -4.169  -6.036
  751    HA   CYS  92           HA       CYS  92  -4.307  -6.111  -5.622
  752    HB2  CYS  92           HB2      CYS  92  -5.135  -6.007  -3.239
  753    HB3  CYS  92           HB3      CYS  92  -4.510  -4.488  -3.894
  754    HG   CYS  92           HG       CYS  92  -6.526  -3.934  -2.332
  755    H    ILE  93           H        ILE  93  -4.720  -8.327  -5.498
  756    HA   ILE  93           HA       ILE  93  -7.570  -9.129  -5.106
  757    HB   ILE  93           HB       ILE  93  -7.539 -10.835  -6.600
  758   HG12  ILE  93          HG12      ILE  93  -5.431 -11.914  -6.308
  759   HG13  ILE  93          HG13      ILE  93  -5.687 -11.598  -8.018
  760   HG21  ILE  93          HG21      ILE  93  -6.167  -8.571  -8.107
  761   HG22  ILE  93          HG22      ILE  93  -7.216  -9.823  -8.778
  762   HG23  ILE  93          HG23      ILE  93  -7.880  -8.643  -7.639
  763   HD11  ILE  93          HD11      ILE  93  -4.111  -9.597  -7.789
  764   HD12  ILE  93          HD12      ILE  93  -3.754 -10.200  -6.149
  765   HD13  ILE  93          HD13      ILE  93  -3.387 -11.197  -7.555
  766    H    GLY  94           H        GLY  94  -4.350  -9.360  -3.961
  767    HA2  GLY  94           HA2      GLY  94  -5.165 -11.102  -1.806
  768    HA3  GLY  94           HA3      GLY  94  -3.990 -11.846  -2.915
  769    H    GLN  95           H        GLN  95  -2.791 -11.652  -0.726
  770    HA   GLN  95           HA       GLN  95  -0.955  -9.389  -0.732
  771    HB2  GLN  95           HB2      GLN  95  -1.572  -8.442   1.366
  772    HB3  GLN  95           HB3      GLN  95  -3.029  -8.497   0.403
  773    HG2  GLN  95           HG2      GLN  95  -2.262 -10.251   2.739
  774    HG3  GLN  95           HG3      GLN  95  -3.575  -9.086   2.660
  775   HE21  GLN  95          HE22      GLN  95  -5.487  -9.683   1.154
  776   HE22  GLN  95          HE21      GLN  95  -5.754 -11.403   0.869
  777    H    LYS  96           H        LYS  96   0.411  -9.668   1.480
  778    HA   LYS  96           HA       LYS  96   0.624 -12.573   2.198
  779    HB2  LYS  96           HB2      LYS  96   2.941 -10.591   1.839
  780    HB3  LYS  96           HB3      LYS  96   3.060 -12.233   2.474
  781    HG2  LYS  96           HG2      LYS  96   2.527 -13.218   0.368
  782    HG3  LYS  96           HG3      LYS  96   2.099 -11.647  -0.327
  783    HD2  LYS  96           HD2      LYS  96   4.313 -12.390  -1.080
  784    HD3  LYS  96           HD3      LYS  96   4.359 -10.855  -0.216
  785    HE2  LYS  96           HE2      LYS  96   5.304 -11.911   1.783
  786    HE3  LYS  96           HE3      LYS  96   5.024 -13.528   1.126
  787    HZ1  LYS  96           HZ1      LYS  96   6.940 -11.543   0.002
  788    HZ2  LYS  96           HZ2      LYS  96   7.336 -12.865   0.873
  789    HZ3  LYS  96           HZ3      LYS  96   6.680 -13.044  -0.606
  790    H    GLN  97           H        GLN  97   0.522 -12.724   4.528
  791    HA   GLN  97           HA       GLN  97   0.773 -10.134   6.038
  792    HB2  GLN  97           HB2      GLN  97  -0.949 -12.548   6.658
  793    HB3  GLN  97           HB3      GLN  97  -0.846 -11.062   7.601
  794    HG2  GLN  97           HG2      GLN  97  -1.855 -11.060   4.743
  795    HG3  GLN  97           HG3      GLN  97  -2.889 -11.548   6.068
  796   HE21  GLN  97          HE22      GLN  97  -2.571  -9.750   8.112
  797   HE22  GLN  97          HE21      GLN  97  -3.110  -8.206   7.513
  798    H    LYS  98           H        LYS  98   2.559 -10.166   7.344
  799    HA   LYS  98           HA       LYS  98   3.461 -12.792   8.484
  800    HB2  LYS  98           HB2      LYS  98   5.068 -11.690   7.028
  801    HB3  LYS  98           HB3      LYS  98   5.011 -10.204   8.010
  802    HG2  LYS  98           HG2      LYS  98   6.196 -11.204   9.732
  803    HG3  LYS  98           HG3      LYS  98   5.838 -12.867   9.193
  804    HD2  LYS  98           HD2      LYS  98   7.523 -10.951   7.556
  805    HD3  LYS  98           HD3      LYS  98   8.249 -11.902   8.843
  806    HE2  LYS  98           HE2      LYS  98   6.597 -13.303   6.700
  807    HE3  LYS  98           HE3      LYS  98   8.217 -12.745   6.308
  808    HZ1  LYS  98           HZ1      LYS  98   7.681 -14.567   8.599
  809    HZ2  LYS  98           HZ2      LYS  98   8.172 -15.061   7.118
  810    HZ3  LYS  98           HZ3      LYS  98   9.146 -14.108   8.025
  811    H    TRP  99           H        TRP  99   3.347 -12.981  10.746
  812    HA   TRP  99           HA       TRP  99   2.157 -10.606  12.102
  813    HB2  TRP  99           HB2      TRP  99   1.568 -13.518  12.625
  814    HB3  TRP  99           HB3      TRP  99   0.783 -12.119  13.358
  815    HD1  TRP  99           HD1      TRP  99   1.182 -13.921  10.005
  816    HE1  TRP  99           HE1      TRP  99  -0.863 -13.532   8.545
  817    HE3  TRP  99           HE3      TRP  99  -1.211 -10.424  12.886
  818    HZ2  TRP  99           HZ2      TRP  99  -3.300 -12.002   8.653
  819    HZ3  TRP  99           HZ3      TRP  99  -3.311  -9.389  12.075
  820    HH2  TRP  99           HH2      TRP  99  -4.413 -10.217  10.008
  821    H    PHE 100           H        PHE 100   2.720 -10.276  14.293
  822    HA   PHE 100           HA       PHE 100   5.221 -11.639  15.208
  823    HB2  PHE 100           HB2      PHE 100   4.537  -8.664  15.056
  824    HB3  PHE 100           HB3      PHE 100   5.931  -9.333  15.894
  825    HD1  PHE 100           HD1      PHE 100   4.385  -8.882  12.484
  826    HD2  PHE 100           HD2      PHE 100   7.966  -9.757  14.761
  827    HE1  PHE 100           HE1      PHE 100   5.755  -8.741  10.431
  828    HE2  PHE 100           HE2      PHE 100   9.315  -9.584  12.695
  829    HZ   PHE 100           HZ       PHE 100   8.218  -9.098  10.535
  830    H    LEU 101           H        LEU 101   4.900 -12.419  17.264
  831    HA   LEU 101           HA       LEU 101   2.705 -11.281  18.923
  832    HB2  LEU 101           HB2      LEU 101   2.574 -13.633  19.063
  833    HB3  LEU 101           HB3      LEU 101   4.328 -13.812  19.143
  834    HG   LEU 101           HG       LEU 101   4.337 -12.811  21.409
  835   HD11  LEU 101          HD11      LEU 101   2.415 -12.313  22.658
  836   HD12  LEU 101          HD12      LEU 101   2.207 -11.431  21.169
  837   HD13  LEU 101          HD13      LEU 101   1.308 -12.949  21.407
  838   HD21  LEU 101          HD21      LEU 101   2.426 -15.166  21.298
  839   HD22  LEU 101          HD22      LEU 101   4.192 -15.293  21.132
  840   HD23  LEU 101          HD23      LEU 101   3.484 -14.684  22.635
  841    H    LEU 102           H        LEU 102   3.298  -9.623  20.166
  842    HA   LEU 102           HA       LEU 102   6.088  -9.484  21.167
  843    HB2  LEU 102           HB2      LEU 102   4.079  -7.410  20.239
  844    HB3  LEU 102           HB3      LEU 102   5.208  -6.988  21.526
  845    HG   LEU 102           HG       LEU 102   7.073  -7.418  20.082
  846   HD11  LEU 102          HD11      LEU 102   6.425  -9.150  18.588
  847   HD12  LEU 102          HD12      LEU 102   5.019  -8.214  18.004
  848   HD13  LEU 102          HD13      LEU 102   6.676  -7.728  17.578
  849   HD21  LEU 102          HD21      LEU 102   5.102  -5.716  18.510
  850   HD22  LEU 102          HD22      LEU 102   5.752  -5.195  20.070
  851   HD23  LEU 102          HD23      LEU 102   6.862  -5.479  18.714
  852    H    GLN 103           H        GLN 103   6.246  -9.188  23.460
  853    HA   GLN 103           HA       GLN 103   3.602  -9.314  24.891
  854    HB2  GLN 103           HB2      GLN 103   4.713 -10.995  25.686
  855    HB3  GLN 103           HB3      GLN 103   6.298 -10.189  25.775
  856    HG2  GLN 103           HG2      GLN 103   5.694  -9.117  27.817
  857    HG3  GLN 103           HG3      GLN 103   3.974  -9.087  27.414
  858   HE21  GLN 103          HE22      GLN 103   2.709 -11.088  27.509
  859   HE22  GLN 103          HE21      GLN 103   3.187 -12.319  28.678
  860    H    LEU 104           H        LEU 104   2.890  -7.465  25.865
  861    HA   LEU 104           HA       LEU 104   4.231  -4.935  25.628
  862    HB2  LEU 104           HB2      LEU 104   1.635  -6.029  26.436
  863    HB3  LEU 104           HB3      LEU 104   2.195  -4.962  27.699
  864    HG   LEU 104           HG       LEU 104   2.125  -4.180  24.764
  865   HD11  LEU 104          HD11      LEU 104   0.052  -2.989  25.215
  866   HD12  LEU 104          HD12      LEU 104  -0.166  -4.713  25.508
  867   HD13  LEU 104          HD13      LEU 104   0.014  -3.613  26.883
  868   HD21  LEU 104          HD21      LEU 104   2.614  -2.656  27.348
  869   HD22  LEU 104          HD22      LEU 104   3.619  -2.761  25.893
  870   HD23  LEU 104          HD23      LEU 104   2.108  -1.846  25.860
  871    H    VAL 105           H        VAL 105   5.416  -3.779  27.242
  872    HA   VAL 105           HA       VAL 105   6.645  -5.563  29.215
  873    HB   VAL 105           HB       VAL 105   7.338  -2.808  28.200
  874   HG11  VAL 105          HG11      VAL 105   9.537  -3.084  29.309
  875   HG12  VAL 105          HG12      VAL 105   8.215  -2.961  30.473
  876   HG13  VAL 105          HG13      VAL 105   8.933  -4.550  30.118
  877   HG21  VAL 105          HG21      VAL 105   8.928  -5.365  27.778
  878   HG22  VAL 105          HG22      VAL 105   7.668  -4.857  26.654
  879   HG23  VAL 105          HG23      VAL 105   9.060  -3.814  26.906
  880    H    SER 106           H        SER 106   4.982  -2.365  29.242
  881    HA   SER 106           HA       SER 106   4.790  -2.483  32.193
  882    HB2  SER 106           HB2      SER 106   3.838  -0.431  30.170
  883    HB3  SER 106           HB3      SER 106   3.734  -0.265  31.928
  884    HG   SER 106           HG       SER 106   5.998  -0.288  30.254
  885    H    GLY 107           H        GLY 107   2.828  -3.253  29.414
  886    HA2  GLY 107           HA2      GLY 107   0.953  -4.794  29.685
  887    HA3  GLY 107           HA3      GLY 107   0.570  -4.017  31.218
  888    H    ASP 108           H        ASP 108  -1.557  -3.942  30.102
  889    HA   ASP 108           HA       ASP 108  -2.171  -2.644  27.775
  890    HB2  ASP 108           HB2      ASP 108  -3.706  -4.108  28.768
  891    HB3  ASP 108           HB3      ASP 108  -3.690  -3.238  30.303
  892    H    ALA 109           H        ALA 109  -1.426  -1.193  30.844
  893    HA   ALA 109           HA       ALA 109  -2.628   1.327  30.666
  894    HB1  ALA 109           HB1      ALA 109  -1.412   0.488  32.656
  895    HB2  ALA 109           HB2      ALA 109   0.127   0.582  31.761
  896    HB3  ALA 109           HB3      ALA 109  -0.776   2.064  32.139
  897    H    GLU 110           H        GLU 110   0.163   0.116  28.839
  898    HA   GLU 110           HA       GLU 110   0.863   2.830  28.076
  899    HB2  GLU 110           HB2      GLU 110   2.349   0.217  27.998
  900    HB3  GLU 110           HB3      GLU 110   2.894   1.526  26.949
  901    HG2  GLU 110           HG2      GLU 110   2.501   1.795  29.943
  902    HG3  GLU 110           HG3      GLU 110   4.047   1.475  29.144
  903    H    ILE 111           H        ILE 111  -1.476   1.471  27.049
  904    HA   ILE 111           HA       ILE 111  -0.980   1.554  24.106
  905    HB   ILE 111           HB       ILE 111  -3.403   0.557  25.656
  906   HG12  ILE 111          HG12      ILE 111  -1.379  -1.029  23.990
  907   HG13  ILE 111          HG13      ILE 111  -1.293  -0.910  25.747
  908   HG21  ILE 111          HG21      ILE 111  -4.227  -0.220  23.463
  909   HG22  ILE 111          HG22      ILE 111  -4.052   1.515  23.507
  910   HG23  ILE 111          HG23      ILE 111  -2.818   0.534  22.669
  911   HD11  ILE 111          HD11      ILE 111  -3.620  -2.148  24.224
  912   HD12  ILE 111          HD12      ILE 111  -2.367  -2.999  25.132
  913   HD13  ILE 111          HD13      ILE 111  -3.504  -1.937  25.973
  914    H    ASN 112           H        ASN 112  -1.879   3.174  22.838
  915    HA   ASN 112           HA       ASN 112  -3.360   5.364  24.278
  916    HB2  ASN 112           HB2      ASN 112  -1.065   6.049  23.797
  917    HB3  ASN 112           HB3      ASN 112  -1.245   5.584  22.104
  918   HD21  ASN 112          HD22      ASN 112  -0.802   7.759  21.334
  919   HD22  ASN 112          HD21      ASN 112  -2.027   8.995  21.466
  920    H    MET 113           H        MET 113  -2.790   4.001  21.005
  921    HA   MET 113           HA       MET 113  -4.067   3.511  19.285
  922    HB2  MET 113           HB2      MET 113  -6.609   3.977  20.836
  923    HB3  MET 113           HB3      MET 113  -6.335   2.980  19.408
  924    HG2  MET 113           HG2      MET 113  -4.555   1.813  21.046
  925    HG3  MET 113           HG3      MET 113  -5.650   2.465  22.267
  926    HE1  MET 113           HE1      MET 113  -5.954  -1.411  20.148
  927    HE2  MET 113           HE2      MET 113  -4.829  -0.106  19.690
  928    HE3  MET 113           HE3      MET 113  -4.820  -0.757  21.351
  929    H    GLN 114           H        GLN 114  -3.540   6.541  20.118
  930    HA   GLN 114           HA       GLN 114  -4.825   7.623  17.782
  931    HB2  GLN 114           HB2      GLN 114  -5.851   9.509  19.015
  932    HB3  GLN 114           HB3      GLN 114  -6.704   7.965  19.016
  933    HG2  GLN 114           HG2      GLN 114  -6.029   7.469  21.297
  934    HG3  GLN 114           HG3      GLN 114  -5.033   8.920  21.375
  935   HE21  GLN 114          HE22      GLN 114  -6.171  11.075  21.234
  936   HE22  GLN 114          HE21      GLN 114  -7.822  11.185  21.807
  937    H    THR 115           H        THR 115  -2.722   7.604  17.356
  938    HA   THR 115           HA       THR 115  -0.796   9.491  18.460
  939    HB   THR 115           HB       THR 115   0.262   8.705  16.173
  940    HG1  THR 115           HG1      THR 115  -0.554   6.659  15.541
  941   HG21  THR 115          HG21      THR 115   1.029   7.982  18.467
  942   HG22  THR 115          HG22      THR 115  -0.252   6.748  18.491
  943   HG23  THR 115          HG23      THR 115   1.100   6.636  17.327
  944    H    SER 116           H        SER 116  -2.403   8.939  15.388
  945    HA   SER 116           HA       SER 116  -2.460  11.657  14.439
  946    HB2  SER 116           HB2      SER 116  -4.279   9.318  13.715
  947    HB3  SER 116           HB3      SER 116  -3.999  10.780  12.754
  948    HG   SER 116           HG       SER 116  -2.712   9.000  12.034
  949    H    SER 117           H        SER 117  -4.516  12.950  14.129
  950    HA   SER 117           HA       SER 117  -5.801  13.431  16.593
  951    HB2  SER 117           HB2      SER 117  -6.764  14.234  13.819
  952    HB3  SER 117           HB3      SER 117  -7.080  15.060  15.360
  953    HG   SER 117           HG       SER 117  -5.386  16.073  14.146
  954    H    THR 118           H        THR 118  -6.721  11.463  13.773
  955    HA   THR 118           HA       THR 118  -9.234  10.610  14.962
  956    HB   THR 118           HB       THR 118  -8.674   8.985  12.845
  957    HG1  THR 118           HG1      THR 118  -8.146  10.392  11.148
  958   HG21  THR 118          HG21      THR 118 -10.814   9.815  13.529
  959   HG22  THR 118          HG22      THR 118 -10.379  11.473  13.026
  960   HG23  THR 118          HG23      THR 118 -10.554  10.170  11.808
  961    HA   PRO 119           HA       PRO 119  -7.118   7.105  16.868
  962    HB2  PRO 119           HB2      PRO 119  -9.936   6.140  17.226
  963    HB3  PRO 119           HB3      PRO 119  -8.640   6.278  18.450
  964    HG2  PRO 119           HG2      PRO 119 -10.743   8.035  18.356
  965    HG3  PRO 119           HG3      PRO 119  -9.078   8.599  18.750
  966    HD2  PRO 119           HD2      PRO 119 -10.542   8.750  16.104
  967    HD3  PRO 119           HD3      PRO 119  -9.535   9.981  16.930
  968    H    GLU 120           H        GLU 120  -6.493   5.235  15.730
  969    HA   GLU 120           HA       GLU 120  -7.939   4.496  13.290
  970    HB2  GLU 120           HB2      GLU 120  -5.436   3.428  14.630
  971    HB3  GLU 120           HB3      GLU 120  -6.216   2.544  13.324
  972    HG2  GLU 120           HG2      GLU 120  -5.237   5.414  13.141
  973    HG3  GLU 120           HG3      GLU 120  -4.394   3.998  12.512
  974    H    PHE 121           H        PHE 121  -8.323   3.669  16.611
  975    HA   PHE 121           HA       PHE 121 -10.051   1.394  15.791
  976    HB2  PHE 121           HB2      PHE 121  -8.489   1.663  18.375
  977    HB3  PHE 121           HB3      PHE 121  -9.658   0.407  18.008
  978    HD1  PHE 121           HD2      PHE 121  -9.196  -0.867  15.654
  979    HD2  PHE 121           HD1      PHE 121  -6.233   1.067  18.092
  980    HE1  PHE 121           HE2      PHE 121  -7.447  -2.250  14.595
  981    HE2  PHE 121           HE1      PHE 121  -4.510  -0.437  17.165
  982    HZ   PHE 121           HZ       PHE 121  -5.091  -2.035  15.349
  983    H    ASP 122           H        ASP 122 -12.070   1.321  16.526
  984    HA   ASP 122           HA       ASP 122 -13.292   3.686  17.807
  985    HB2  ASP 122           HB2      ASP 122 -14.478   2.606  15.970
  986    HB3  ASP 122           HB3      ASP 122 -14.376   1.039  16.770
  987    H    GLY 123           H        GLY 123 -12.103   0.464  18.656
  988    HA2  GLY 123           HA2      GLY 123 -12.611   0.860  21.486
  989    HA3  GLY 123           HA3      GLY 123 -13.625  -0.395  20.726
  990    H    TRP 124           H        TRP 124 -11.758  -1.029  22.728
  991    HA   TRP 124           HA       TRP 124 -10.030  -2.870  21.250
  992    HB2  TRP 124           HB2      TRP 124  -8.049  -2.173  21.966
  993    HB3  TRP 124           HB3      TRP 124  -8.838  -0.610  22.102
  994    HD1  TRP 124           HD1      TRP 124  -6.710  -2.849  23.964
  995    HE1  TRP 124           HE1      TRP 124  -6.639  -2.327  26.473
  996    HE3  TRP 124           HE3      TRP 124 -10.723   0.337  24.275
  997    HZ2  TRP 124           HZ2      TRP 124  -8.345  -1.097  28.411
  998    HZ3  TRP 124           HZ3      TRP 124 -11.472   1.174  26.480
  999    HH2  TRP 124           HH2      TRP 124 -10.316   0.457  28.562
 1000    H    ARG 125           H        ARG 125  -9.498  -4.768  22.561
 1001    HA   ARG 125           HA       ARG 125 -10.577  -4.920  25.254
 1002    HB2  ARG 125           HB2      ARG 125 -12.110  -6.766  24.879
 1003    HB3  ARG 125           HB3      ARG 125 -12.604  -5.379  23.920
 1004    HG2  ARG 125           HG2      ARG 125 -11.360  -6.518  21.942
 1005    HG3  ARG 125           HG3      ARG 125 -11.332  -7.969  22.939
 1006    HD2  ARG 125           HD2      ARG 125 -13.833  -6.386  22.189
 1007    HD3  ARG 125           HD3      ARG 125 -13.283  -7.821  21.335
 1008    HE   ARG 125           HE       ARG 125 -13.551  -8.505  24.071
 1009   HH11  ARG 125          HH11      ARG 125 -15.660  -7.483  21.393
 1010   HH12  ARG 125          HH12      ARG 125 -17.069  -8.258  22.022
 1011   HH21  ARG 125          HH21      ARG 125 -15.423  -9.581  24.888
 1012   HH22  ARG 125          HH22      ARG 125 -16.914  -9.518  24.026
 1013    H    TRP 126           H        TRP 126  -9.963  -6.940  26.289
 1014    HA   TRP 126           HA       TRP 126  -7.711  -8.351  24.934
 1015    HB2  TRP 126           HB2      TRP 126  -8.137  -7.602  27.834
 1016    HB3  TRP 126           HB3      TRP 126  -7.092  -8.928  27.356
 1017    HD1  TRP 126           HD1      TRP 126  -7.314  -5.052  26.863
 1018    HE1  TRP 126           HE1      TRP 126  -5.031  -4.113  26.864
 1019    HE3  TRP 126           HE3      TRP 126  -4.689  -9.452  26.635
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.298  -5.082  26.753
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.230  -9.386  26.577
 1022    HH2  TRP 126           HH2      TRP 126  -1.004  -7.209  26.709
 1023    H    VAL 127           H        VAL 127  -8.047 -10.498  24.630
 1024    HA   VAL 127           HA       VAL 127 -10.493 -11.829  25.677
 1025    HB   VAL 127           HB       VAL 127 -10.639 -12.629  23.149
 1026   HG11  VAL 127          HG11      VAL 127 -12.442 -11.566  24.299
 1027   HG12  VAL 127          HG12      VAL 127 -11.681  -9.965  24.146
 1028   HG13  VAL 127          HG13      VAL 127 -12.281 -10.817  22.699
 1029   HG21  VAL 127          HG21      VAL 127 -10.124 -11.026  21.456
 1030   HG22  VAL 127          HG22      VAL 127  -9.454  -9.883  22.640
 1031   HG23  VAL 127          HG23      VAL 127  -8.653 -11.450  22.335
 1032    H    SER 128           H        SER 128 -10.451 -14.253  24.864
 1033    HA   SER 128           HA       SER 128  -7.859 -15.407  25.446
 1034    HB2  SER 128           HB2      SER 128  -9.016 -17.493  25.007
 1035    HB3  SER 128           HB3      SER 128 -10.075 -16.413  25.951
 1036    HG   SER 128           HG       SER 128 -11.293 -17.294  24.312
 1037    H    TYR 129           H        TYR 129  -6.746 -16.864  23.746
 1038    HA   TYR 129           HA       TYR 129  -6.405 -15.449  21.256
 1039    HB2  TYR 129           HB2      TYR 129  -5.292 -17.924  20.803
 1040    HB3  TYR 129           HB3      TYR 129  -4.485 -16.515  21.442
 1041    HD1  TYR 129           HD1      TYR 129  -6.600 -19.367  22.704
 1042    HD2  TYR 129           HD2      TYR 129  -3.159 -16.834  23.382
 1043    HE1  TYR 129           HE1      TYR 129  -6.124 -20.583  24.808
 1044    HE2  TYR 129           HE2      TYR 129  -2.672 -18.074  25.469
 1045    HH   TYR 129           HH       TYR 129  -3.362 -19.760  26.959
 1046    H    TRP 130           H        TRP 130  -8.834 -17.797  22.235
 1047    HA   TRP 130           HA       TRP 130  -9.305 -18.506  19.393
 1048    HB2  TRP 130           HB2      TRP 130 -10.547 -19.666  21.881
 1049    HB3  TRP 130           HB3      TRP 130 -10.704 -20.274  20.235
 1050    HD1  TRP 130           HD1      TRP 130  -9.155 -21.381  23.119
 1051    HE1  TRP 130           HE1      TRP 130  -6.900 -22.554  22.816
 1052    HE3  TRP 130           HE3      TRP 130  -8.052 -19.884  18.319
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.807 -22.652  20.879
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.906 -20.547  17.283
 1055    HH2  TRP 130           HH2      TRP 130  -4.253 -21.882  18.559
 1056    H    TYR 131           H        TYR 131 -10.927 -16.643  21.990
 1057    HA   TYR 131           HA       TYR 131 -13.443 -16.441  20.805
 1058    HB2  TYR 131           HB2      TYR 131 -12.860 -15.625  23.025
 1059    HB3  TYR 131           HB3      TYR 131 -11.951 -14.291  22.320
 1060    HD1  TYR 131           HD2      TYR 131 -13.196 -12.429  21.121
 1061    HD2  TYR 131           HD1      TYR 131 -15.272 -15.669  23.085
 1062    HE1  TYR 131           HE2      TYR 131 -15.305 -11.144  21.003
 1063    HE2  TYR 131           HE1      TYR 131 -17.387 -14.383  22.971
 1064    HH   TYR 131           HH       TYR 131 -17.621 -11.130  21.451
 1065    HA   PRO 132           HA       PRO 132 -12.052 -12.636  18.196
 1066    HB2  PRO 132           HB2      PRO 132  -9.516 -12.683  17.071
 1067    HB3  PRO 132           HB3      PRO 132  -9.929 -11.845  18.602
 1068    HG2  PRO 132           HG2      PRO 132  -8.766 -14.615  18.302
 1069    HG3  PRO 132           HG3      PRO 132  -8.204 -13.271  19.360
 1070    HD2  PRO 132           HD2      PRO 132  -9.742 -15.156  20.358
 1071    HD3  PRO 132           HD3      PRO 132 -10.126 -13.461  20.758
 1072    H    VAL 133           H        VAL 133 -11.046 -15.953  17.623
 1073    HA   VAL 133           HA       VAL 133 -11.138 -15.862  14.729
 1074    HB   VAL 133           HB       VAL 133 -11.476 -18.240  16.594
 1075   HG11  VAL 133          HG11      VAL 133 -10.411 -18.144  13.743
 1076   HG12  VAL 133          HG12      VAL 133 -10.677 -19.586  14.762
 1077   HG13  VAL 133          HG13      VAL 133 -12.054 -18.651  14.209
 1078   HG21  VAL 133          HG21      VAL 133  -9.030 -18.630  16.345
 1079   HG22  VAL 133          HG22      VAL 133  -8.864 -17.094  15.481
 1080   HG23  VAL 133          HG23      VAL 133  -9.328 -17.114  17.185
 1081    H    ARG 134           H        ARG 134 -13.450 -16.528  17.401
 1082    HA   ARG 134           HA       ARG 134 -15.480 -17.777  15.898
 1083    HB2  ARG 134           HB2      ARG 134 -15.951 -15.855  18.228
 1084    HB3  ARG 134           HB3      ARG 134 -16.977 -17.199  17.716
 1085    HG2  ARG 134           HG2      ARG 134 -14.214 -17.524  18.928
 1086    HG3  ARG 134           HG3      ARG 134 -15.712 -17.544  19.844
 1087    HD2  ARG 134           HD2      ARG 134 -15.132 -19.412  17.529
 1088    HD3  ARG 134           HD3      ARG 134 -14.752 -19.795  19.230
 1089    HE   ARG 134           HE       ARG 134 -17.452 -19.058  19.174
 1090   HH11  ARG 134          HH11      ARG 134 -15.465 -21.703  17.860
 1091   HH12  ARG 134          HH12      ARG 134 -16.761 -22.844  17.838
 1092   HH21  ARG 134          HH21      ARG 134 -19.174 -20.581  19.135
 1093   HH22  ARG 134          HH22      ARG 134 -18.906 -22.194  18.595
 1094    H    GLN 135           H        GLN 135 -14.776 -14.306  16.269
 1095    HA   GLN 135           HA       GLN 135 -17.430 -13.565  15.435
 1096    HB2  GLN 135           HB2      GLN 135 -14.995 -11.866  15.909
 1097    HB3  GLN 135           HB3      GLN 135 -16.584 -11.213  15.551
 1098    HG2  GLN 135           HG2      GLN 135 -15.950 -13.091  17.861
 1099    HG3  GLN 135           HG3      GLN 135 -16.178 -11.352  18.029
 1100   HE21  GLN 135          HE22      GLN 135 -17.659 -13.751  19.221
 1101   HE22  GLN 135          HE21      GLN 135 -19.332 -13.447  18.829
 1102    H    VAL 136           H        VAL 136 -14.427 -14.075  13.636
 1103    HA   VAL 136           HA       VAL 136 -15.375 -12.412  11.417
 1104    HB   VAL 136           HB       VAL 136 -13.140 -12.892  10.502
 1105   HG11  VAL 136          HG11      VAL 136 -13.715 -10.892  11.912
 1106   HG12  VAL 136          HG12      VAL 136 -13.074 -11.763  13.323
 1107   HG13  VAL 136          HG13      VAL 136 -12.015 -11.356  11.954
 1108   HG21  VAL 136          HG21      VAL 136 -12.664 -15.060  11.693
 1109   HG22  VAL 136          HG22      VAL 136 -11.372 -13.856  11.782
 1110   HG23  VAL 136          HG23      VAL 136 -12.427 -14.123  13.181
 1111    H    VAL 137           H        VAL 137 -14.932 -13.316   9.133
 1112    HA   VAL 137           HA       VAL 137 -16.770 -15.545   8.765
 1113    HB   VAL 137           HB       VAL 137 -16.875 -14.889   6.512
 1114   HG11  VAL 137          HG11      VAL 137 -17.371 -12.555   6.499
 1115   HG12  VAL 137          HG12      VAL 137 -17.805 -13.184   8.093
 1116   HG13  VAL 137          HG13      VAL 137 -16.316 -12.229   7.884
 1117   HG21  VAL 137          HG21      VAL 137 -14.107 -13.683   6.905
 1118   HG22  VAL 137          HG22      VAL 137 -14.680 -14.894   5.736
 1119   HG23  VAL 137          HG23      VAL 137 -15.158 -13.206   5.535
 1120    H    SER 138           H        SER 138 -16.084 -17.093   6.800
 1121    HA   SER 138           HA       SER 138 -14.411 -18.974   7.867
 1122    HB2  SER 138           HB2      SER 138 -15.057 -18.581   4.927
 1123    HB3  SER 138           HB3      SER 138 -14.718 -20.126   5.757
 1124    HG   SER 138           HG       SER 138 -16.981 -19.776   5.505
 1125    H    PHE 139           H        PHE 139 -13.435 -16.762   5.119
 1126    HA   PHE 139           HA       PHE 139 -10.867 -18.032   4.978
 1127    HB2  PHE 139           HB2      PHE 139 -10.280 -16.420   3.333
 1128    HB3  PHE 139           HB3      PHE 139 -11.906 -16.995   3.048
 1129    HD1  PHE 139           HD1      PHE 139  -9.835 -14.082   4.046
 1130    HD2  PHE 139           HD2      PHE 139 -13.837 -15.452   3.153
 1131    HE1  PHE 139           HE1      PHE 139 -10.589 -11.739   3.778
 1132    HE2  PHE 139           HE2      PHE 139 -14.570 -13.105   2.875
 1133    HZ   PHE 139           HZ       PHE 139 -12.956 -11.241   3.190
 1134    H    LYS 140           H        LYS 140 -12.017 -15.228   6.809
 1135    HA   LYS 140           HA       LYS 140  -9.283 -14.486   7.623
 1136    HB2  LYS 140           HB2      LYS 140 -11.978 -13.532   8.656
 1137    HB3  LYS 140           HB3      LYS 140 -10.393 -12.860   9.099
 1138    HG2  LYS 140           HG2      LYS 140  -9.984 -12.429   6.621
 1139    HG3  LYS 140           HG3      LYS 140 -11.667 -12.881   6.331
 1140    HD2  LYS 140           HD2      LYS 140 -10.697 -10.535   8.005
 1141    HD3  LYS 140           HD3      LYS 140 -11.409 -10.478   6.382
 1142    HE2  LYS 140           HE2      LYS 140 -13.513 -11.489   7.302
 1143    HE3  LYS 140           HE3      LYS 140 -12.803 -11.420   8.926
 1144    HZ1  LYS 140           HZ1      LYS 140 -13.336  -9.050   7.177
 1145    HZ2  LYS 140           HZ2      LYS 140 -14.232  -9.467   8.472
 1146    HZ3  LYS 140           HZ3      LYS 140 -12.684  -8.969   8.676
 1147    H    ARG 141           H        ARG 141 -12.069 -16.167   9.102
 1148    HA   ARG 141           HA       ARG 141 -11.012 -16.935  11.589
 1149    HB2  ARG 141           HB2      ARG 141 -12.632 -18.545   9.559
 1150    HB3  ARG 141           HB3      ARG 141 -12.070 -19.287  11.056
 1151    HG2  ARG 141           HG2      ARG 141 -13.252 -17.697  12.384
 1152    HG3  ARG 141           HG3      ARG 141 -13.802 -16.815  10.953
 1153    HD2  ARG 141           HD2      ARG 141 -15.064 -18.814  10.212
 1154    HD3  ARG 141           HD3      ARG 141 -14.490 -19.696  11.653
 1155    HE   ARG 141           HE       ARG 141 -15.840 -17.153  12.188
 1156   HH11  ARG 141          HH11      ARG 141 -16.551 -20.555  11.454
 1157   HH12  ARG 141          HH12      ARG 141 -18.008 -20.598  12.378
 1158   HH21  ARG 141          HH21      ARG 141 -17.654 -17.275  13.615
 1159   HH22  ARG 141          HH22      ARG 141 -18.701 -18.654  13.549
 1160    H    ASP 142           H        ASP 142 -10.278 -18.505   8.423
 1161    HA   ASP 142           HA       ASP 142  -8.616 -20.517   9.491
 1162    HB2  ASP 142           HB2      ASP 142  -9.499 -20.499   7.182
 1163    HB3  ASP 142           HB3      ASP 142  -8.402 -19.174   6.769
 1164    H    VAL 143           H        VAL 143  -7.747 -17.243   8.271
 1165    HA   VAL 143           HA       VAL 143  -4.957 -17.578   8.860
 1166    HB   VAL 143           HB       VAL 143  -6.709 -15.119   8.406
 1167   HG11  VAL 143          HG11      VAL 143  -4.894 -14.280   9.792
 1168   HG12  VAL 143          HG12      VAL 143  -3.698 -15.226   8.866
 1169   HG13  VAL 143          HG13      VAL 143  -4.552 -13.858   8.107
 1170   HG21  VAL 143          HG21      VAL 143  -5.437 -15.079   6.244
 1171   HG22  VAL 143          HG22      VAL 143  -4.630 -16.588   6.726
 1172   HG23  VAL 143          HG23      VAL 143  -6.378 -16.556   6.447
 1173    H    TYR 144           H        TYR 144  -7.669 -16.143  10.756
 1174    HA   TYR 144           HA       TYR 144  -6.030 -15.141  12.838
 1175    HB2  TYR 144           HB2      TYR 144  -8.964 -15.953  12.729
 1176    HB3  TYR 144           HB3      TYR 144  -8.206 -15.352  14.194
 1177    HD1  TYR 144           HD1      TYR 144  -7.310 -13.820  10.873
 1178    HD2  TYR 144           HD2      TYR 144  -9.716 -13.550  14.456
 1179    HE1  TYR 144           HE1      TYR 144  -7.895 -11.502  10.310
 1180    HE2  TYR 144           HE2      TYR 144 -10.319 -11.240  13.878
 1181    HH   TYR 144           HH       TYR 144 -10.185  -9.533  12.265
 1182    H    ARG 145           H        ARG 145  -7.762 -18.339  12.580
 1183    HA   ARG 145           HA       ARG 145  -6.757 -19.180  15.129
 1184    HB2  ARG 145           HB2      ARG 145  -7.596 -21.341  14.675
 1185    HB3  ARG 145           HB3      ARG 145  -8.718 -20.199  13.940
 1186    HG2  ARG 145           HG2      ARG 145  -7.509 -20.597  11.745
 1187    HG3  ARG 145           HG3      ARG 145  -6.674 -21.950  12.515
 1188    HD2  ARG 145           HD2      ARG 145  -9.666 -21.600  12.159
 1189    HD3  ARG 145           HD3      ARG 145  -8.594 -22.607  11.165
 1190    HE   ARG 145           HE       ARG 145  -8.214 -23.465  13.806
 1191   HH11  ARG 145          HH21      ARG 145 -10.867 -23.480  11.431
 1192   HH12  ARG 145          HH22      ARG 145 -11.638 -24.873  12.102
 1193   HH21  ARG 145          HH11      ARG 145  -9.266 -25.298  14.717
 1194   HH22  ARG 145          HH12      ARG 145 -10.699 -25.932  13.993
 1195    H    ARG 146           H        ARG 146  -5.388 -19.654  11.763
 1196    HA   ARG 146           HA       ARG 146  -3.194 -21.203  12.667
 1197    HB2  ARG 146           HB2      ARG 146  -3.646 -19.393  10.247
 1198    HB3  ARG 146           HB3      ARG 146  -2.024 -19.946  10.680
 1199    HG2  ARG 146           HG2      ARG 146  -2.637 -21.533   9.176
 1200    HG3  ARG 146           HG3      ARG 146  -2.853 -22.306  10.743
 1201    HD2  ARG 146           HD2      ARG 146  -5.333 -21.824  10.524
 1202    HD3  ARG 146           HD3      ARG 146  -5.006 -21.237   8.892
 1203    HE   ARG 146           HE       ARG 146  -4.740 -24.026   9.925
 1204   HH11  ARG 146          HH11      ARG 146  -5.111 -21.993   7.045
 1205   HH12  ARG 146          HH12      ARG 146  -4.489 -23.180   5.951
 1206   HH21  ARG 146          HH21      ARG 146  -4.216 -25.702   8.446
 1207   HH22  ARG 146          HH22      ARG 146  -4.176 -25.390   6.750
 1208    H    VAL 147           H        VAL 147  -3.388 -17.597  12.312
 1209    HA   VAL 147           HA       VAL 147  -0.792 -17.010  13.050
 1210    HB   VAL 147           HB       VAL 147  -3.429 -15.531  13.410
 1211   HG11  VAL 147          HG11      VAL 147  -1.996 -14.516  15.122
 1212   HG12  VAL 147          HG12      VAL 147  -0.656 -14.393  13.957
 1213   HG13  VAL 147          HG13      VAL 147  -2.136 -13.424  13.740
 1214   HG21  VAL 147          HG21      VAL 147  -2.448 -15.938  11.093
 1215   HG22  VAL 147          HG22      VAL 147  -2.664 -14.239  11.515
 1216   HG23  VAL 147          HG23      VAL 147  -1.053 -14.981  11.610
 1217    H    MET 148           H        MET 148  -3.654 -17.619  15.068
 1218    HA   MET 148           HA       MET 148  -2.524 -16.805  17.555
 1219    HB2  MET 148           HB2      MET 148  -4.973 -18.463  16.855
 1220    HB3  MET 148           HB3      MET 148  -4.531 -18.053  18.520
 1221    HG2  MET 148           HG2      MET 148  -4.984 -15.932  16.397
 1222    HG3  MET 148           HG3      MET 148  -6.274 -16.599  17.368
 1223    HE1  MET 148           HE1      MET 148  -2.685 -14.589  17.767
 1224    HE2  MET 148           HE2      MET 148  -4.015 -13.861  16.825
 1225    HE3  MET 148           HE3      MET 148  -3.579 -13.186  18.400
 1226    H    LYS 149           H        LYS 149  -3.155 -20.036  16.082
 1227    HA   LYS 149           HA       LYS 149  -1.840 -21.606  18.061
 1228    HB2  LYS 149           HB2      LYS 149  -3.273 -22.626  16.595
 1229    HB3  LYS 149           HB3      LYS 149  -2.531 -21.953  15.147
 1230    HG2  LYS 149           HG2      LYS 149  -1.214 -24.070  16.902
 1231    HG3  LYS 149           HG3      LYS 149  -2.250 -24.412  15.515
 1232    HD2  LYS 149           HD2      LYS 149  -0.578 -22.808  14.220
 1233    HD3  LYS 149           HD3      LYS 149   0.532 -23.240  15.520
 1234    HE2  LYS 149           HE2      LYS 149  -0.891 -25.188  13.662
 1235    HE3  LYS 149           HE3      LYS 149   0.773 -24.634  13.487
 1236    HZ1  LYS 149           HZ1      LYS 149   0.704 -26.783  14.566
 1237    HZ2  LYS 149           HZ2      LYS 149   1.296 -25.693  15.623
 1238    HZ3  LYS 149           HZ3      LYS 149  -0.246 -26.246  15.775
 1239    H    GLU 150           H        GLU 150  -0.472 -19.838  15.228
 1240    HA   GLU 150           HA       GLU 150   1.954 -21.022  15.228
 1241    HB2  GLU 150           HB2      GLU 150   0.739 -18.998  13.788
 1242    HB3  GLU 150           HB3      GLU 150   1.916 -18.071  14.690
 1243    HG2  GLU 150           HG2      GLU 150   3.198 -18.705  12.863
 1244    HG3  GLU 150           HG3      GLU 150   3.612 -19.966  13.986
 1245    H    PHE 151           H        PHE 151   0.834 -18.410  17.313
 1246    HA   PHE 151           HA       PHE 151   3.479 -18.358  18.717
 1247    HB2  PHE 151           HB2      PHE 151   1.280 -16.341  19.056
 1248    HB3  PHE 151           HB3      PHE 151   3.000 -16.237  19.451
 1249    HD1  PHE 151           HD2      PHE 151   4.472 -17.006  17.047
 1250    HD2  PHE 151           HD1      PHE 151   0.835 -14.670  17.430
 1251    HE1  PHE 151           HE2      PHE 151   4.722 -16.204  14.780
 1252    HE2  PHE 151           HE1      PHE 151   1.269 -13.672  15.223
 1253    HZ   PHE 151           HZ       PHE 151   3.198 -14.468  13.855
 1254    H    ALA 152           H        ALA 152   0.298 -19.622  19.118
 1255    HA   ALA 152           HA       ALA 152  -0.275 -19.302  21.794
 1256    HB1  ALA 152           HB1      ALA 152  -1.491 -21.487  21.579
 1257    HB2  ALA 152           HB2      ALA 152  -1.799 -20.433  20.192
 1258    HB3  ALA 152           HB3      ALA 152  -0.658 -21.785  20.042
 1259    H    SER 153           H        SER 153   1.954 -21.634  20.315
 1260    HA   SER 153           HA       SER 153   2.434 -23.171  22.659
 1261    HB2  SER 153           HB2      SER 153   4.303 -22.735  20.296
 1262    HB3  SER 153           HB3      SER 153   4.260 -24.140  21.382
 1263    HG   SER 153           HG       SER 153   3.152 -24.590  19.426
 1264    H    VAL 154           H        VAL 154   3.826 -20.121  21.489
 1265    HA   VAL 154           HA       VAL 154   5.970 -20.083  23.482
 1266    HB   VAL 154           HB       VAL 154   4.793 -17.845  21.791
 1267   HG11  VAL 154          HG11      VAL 154   5.941 -16.976  23.828
 1268   HG12  VAL 154          HG12      VAL 154   7.388 -17.909  23.384
 1269   HG13  VAL 154          HG13      VAL 154   6.822 -16.592  22.337
 1270   HG21  VAL 154          HG21      VAL 154   5.810 -19.513  20.330
 1271   HG22  VAL 154          HG22      VAL 154   6.928 -18.152  20.458
 1272   HG23  VAL 154          HG23      VAL 154   7.243 -19.624  21.384
 1273    H    VAL 155           H        VAL 155   2.658 -18.738  23.072
 1274    HA   VAL 155           HA       VAL 155   2.713 -17.187  25.404
 1275    HB   VAL 155           HB       VAL 155   0.260 -18.546  24.219
 1276   HG11  VAL 155          HG11      VAL 155  -0.250 -17.699  26.435
 1277   HG12  VAL 155          HG12      VAL 155   0.684 -16.213  26.150
 1278   HG13  VAL 155          HG13      VAL 155  -0.866 -16.494  25.284
 1279   HG21  VAL 155          HG21      VAL 155  -0.100 -16.288  23.137
 1280   HG22  VAL 155          HG22      VAL 155   1.569 -15.864  23.621
 1281   HG23  VAL 155          HG23      VAL 155   1.265 -17.175  22.478
 1282    H    MET 156           H        MET 156   1.821 -20.720  25.123
 1283    HA   MET 156           HA       MET 156   0.865 -20.993  27.691
 1284    HB2  MET 156           HB2      MET 156   2.722 -22.932  26.194
 1285    HB3  MET 156           HB3      MET 156   1.696 -23.376  27.566
 1286    HG2  MET 156           HG2      MET 156   0.807 -22.560  24.796
 1287    HG3  MET 156           HG3      MET 156   0.611 -24.129  25.549
 1288    HE1  MET 156           HE1      MET 156  -1.723 -23.027  24.039
 1289    HE2  MET 156           HE2      MET 156  -2.873 -21.955  24.868
 1290    HE3  MET 156           HE3      MET 156  -1.330 -21.305  24.283
 1291    H    SER 157           H        SER 157   4.204 -21.367  26.572
 1292    HA   SER 157           HA       SER 157   5.320 -21.816  29.151
 1293    HB2  SER 157           HB2      SER 157   6.266 -21.274  26.339
 1294    HB3  SER 157           HB3      SER 157   7.455 -21.446  27.677
 1295    HG   SER 157           HG       SER 157   7.027 -23.452  26.608
 1296    H    LEU 158           H        LEU 158   4.722 -18.912  27.238
 1297    HA   LEU 158           HA       LEU 158   6.291 -17.076  28.715
 1298    HB2  LEU 158           HB2      LEU 158   5.132 -16.738  26.442
 1299    HB3  LEU 158           HB3      LEU 158   3.597 -16.667  27.317
 1300    HG   LEU 158           HG       LEU 158   4.528 -14.692  28.616
 1301   HD11  LEU 158          HD11      LEU 158   6.347 -13.448  27.510
 1302   HD12  LEU 158          HD12      LEU 158   6.921 -15.047  28.018
 1303   HD13  LEU 158          HD13      LEU 158   6.535 -14.769  26.317
 1304   HD21  LEU 158          HD21      LEU 158   3.988 -13.232  26.531
 1305   HD22  LEU 158          HD22      LEU 158   3.853 -14.766  25.665
 1306   HD23  LEU 158          HD23      LEU 158   2.804 -14.470  27.076
 1307    H    GLN 159           H        GLN 159   2.953 -18.263  29.151
 1308    HA   GLN 159           HA       GLN 159   2.354 -16.716  31.494
 1309    HB2  GLN 159           HB2      GLN 159   1.310 -19.533  30.953
 1310    HB3  GLN 159           HB3      GLN 159   0.639 -18.316  32.009
 1311    HG2  GLN 159           HG2      GLN 159   0.268 -16.888  29.843
 1312    HG3  GLN 159           HG3      GLN 159   0.621 -18.390  28.988
 1313   HE21  GLN 159          HE22      GLN 159  -1.428 -17.531  31.850
 1314   HE22  GLN 159          HE21      GLN 159  -2.789 -18.522  31.332
 1315    H    GLU 160           H        GLU 160   3.839 -19.938  31.084
 1316    HA   GLU 160           HA       GLU 160   3.843 -20.608  33.806
 1317    HB2  GLU 160           HB2      GLU 160   5.453 -21.649  31.445
 1318    HB3  GLU 160           HB3      GLU 160   5.562 -22.361  33.056
 1319    HG2  GLU 160           HG2      GLU 160   3.138 -22.766  33.098
 1320    HG3  GLU 160           HG3      GLU 160   2.978 -22.066  31.496
 1321    H    ASN 161           H        ASN 161   6.195 -18.759  31.974
 1322    HA   ASN 161           HA       ASN 161   8.383 -19.354  33.844
 1323    HB2  ASN 161           HB2      ASN 161   8.067 -17.861  31.239
 1324    HB3  ASN 161           HB3      ASN 161   9.452 -17.509  32.267
 1325   HD21  ASN 161          HD22      ASN 161   7.803 -20.260  30.620
 1326   HD22  ASN 161          HD21      ASN 161   9.248 -21.262  30.523
 1327    H    THR 162           H        THR 162   5.804 -17.087  33.789
 1328    HA   THR 162           HA       THR 162   5.515 -14.936  34.304
 1329    HB   THR 162           HB       THR 162   5.534 -14.775  36.626
 1330    HG1  THR 162           HG1      THR 162   7.686 -15.611  37.083
 1331   HG21  THR 162          HG21      THR 162   4.001 -16.368  35.549
 1332   HG22  THR 162          HG22      THR 162   5.141 -17.683  35.892
 1333   HG23  THR 162          HG23      THR 162   4.359 -16.812  37.232
 1334    HA   PRO 163           HA       PRO 163   9.819 -14.082  33.326
 1335    HB2  PRO 163           HB2      PRO 163   8.803 -12.404  31.035
 1336    HB3  PRO 163           HB3      PRO 163  10.131 -13.599  31.066
 1337    HG2  PRO 163           HG2      PRO 163   7.696 -14.223  30.008
 1338    HG3  PRO 163           HG3      PRO 163   8.598 -15.419  31.003
 1339    HD2  PRO 163           HD2      PRO 163   6.394 -13.528  31.883
 1340    HD3  PRO 163           HD3      PRO 163   6.523 -15.284  32.135
 1341    H    LYS 164           H        LYS 164  10.974 -11.758  32.584
 1342    HA   LYS 164           HA       LYS 164   9.970  -9.722  34.499
 1343    HB2  LYS 164           HB2      LYS 164  12.690  -9.822  33.148
 1344    HB3  LYS 164           HB3      LYS 164  12.214  -8.889  34.566
 1345    HG2  LYS 164           HG2      LYS 164  12.542 -11.921  34.381
 1346    HG3  LYS 164           HG3      LYS 164  13.633 -10.798  35.177
 1347    HD2  LYS 164           HD2      LYS 164  12.034 -10.305  36.918
 1348    HD3  LYS 164           HD3      LYS 164  10.734 -11.163  36.071
 1349    HE2  LYS 164           HE2      LYS 164  11.952 -13.290  36.254
 1350    HE3  LYS 164           HE3      LYS 164  13.289 -12.474  37.085
 1351    HZ1  LYS 164           HZ1      LYS 164  11.756 -11.933  38.892
 1352    HZ2  LYS 164           HZ2      LYS 164  10.518 -12.685  38.122
 1353    HZ3  LYS 164           HZ3      LYS 164  11.797 -13.548  38.652
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1   0.237  -0.115  -2.292
    2    H2   MET   1           H2       MET   1   0.795   1.418  -2.395
    3    H3   MET   1           H3       MET   1  -0.202   0.840  -3.549
    4    HA   MET   1           HA       MET   1   2.007   0.997  -4.367
    5    HB2  MET   1           HB2      MET   1   3.832  -0.359  -3.606
    6    HB3  MET   1           HB3      MET   1   3.323   0.788  -2.394
    7    HG2  MET   1           HG2      MET   1   2.549  -0.851  -0.926
    8    HG3  MET   1           HG3      MET   1   2.397  -2.090  -2.166
    9    HE1  MET   1           HE1      MET   1   4.221  -3.683  -3.006
   10    HE2  MET   1           HE2      MET   1   5.112  -2.323  -3.731
   11    HE3  MET   1           HE3      MET   1   5.954  -3.476  -2.686
   12    H    ILE   2           H        ILE   2   1.069  -2.353  -3.269
   13    HA   ILE   2           HA       ILE   2   0.697  -4.239  -4.341
   14    HB   ILE   2           HB       ILE   2   0.029  -2.772  -6.880
   15   HG12  ILE   2          HG12      ILE   2  -1.347  -2.969  -4.290
   16   HG13  ILE   2          HG13      ILE   2  -1.677  -1.932  -5.682
   17   HG21  ILE   2          HG21      ILE   2  -1.173  -4.825  -7.435
   18   HG22  ILE   2          HG22      ILE   2   0.523  -5.190  -7.156
   19   HG23  ILE   2          HG23      ILE   2  -0.685  -5.556  -5.893
   20   HD11  ILE   2          HD11      ILE   2  -3.613  -3.221  -5.095
   21   HD12  ILE   2          HD12      ILE   2  -3.053  -3.844  -6.645
   22   HD13  ILE   2          HD13      ILE   2  -2.687  -4.733  -5.118
   23    H    ASP   3           H        ASP   3   2.052  -5.803  -5.100
   24    HA   ASP   3           HA       ASP   3   4.761  -5.006  -5.368
   25    HB2  ASP   3           HB2      ASP   3   4.112  -7.048  -4.203
   26    HB3  ASP   3           HB3      ASP   3   3.498  -7.721  -5.722
   27    H    ASP   4           H        ASP   4   2.896  -7.104  -7.556
   28    HA   ASP   4           HA       ASP   4   3.523  -5.570  -9.887
   29    HB2  ASP   4           HB2      ASP   4   5.682  -6.712  -9.677
   30    HB3  ASP   4           HB3      ASP   4   4.865  -8.264  -9.491
   31    H    ASP   5           H        ASP   5   2.712  -8.872  -8.849
   32    HA   ASP   5           HA       ASP   5   0.961  -9.235 -11.126
   33    HB2  ASP   5           HB2      ASP   5   2.717 -10.870 -10.484
   34    HB3  ASP   5           HB3      ASP   5   1.785 -11.256  -9.035
   35    H    GLY   6           H        GLY   6   0.195  -7.567  -8.718
   36    HA2  GLY   6           HA2      GLY   6  -1.942  -6.942  -8.018
   37    HA3  GLY   6           HA3      GLY   6  -2.593  -8.506  -8.507
   38    H    TYR   7           H        TYR   7   0.210  -8.927  -6.623
   39    HA   TYR   7           HA       TYR   7  -1.362  -9.330  -4.132
   40    HB2  TYR   7           HB2      TYR   7   1.411 -10.332  -4.890
   41    HB3  TYR   7           HB3      TYR   7   0.607 -10.615  -3.350
   42    HD1  TYR   7           HD2      TYR   7  -1.375 -12.099  -3.186
   43    HD2  TYR   7           HD1      TYR   7   0.723 -11.548  -6.910
   44    HE1  TYR   7           HE2      TYR   7  -2.598 -14.027  -4.160
   45    HE2  TYR   7           HE1      TYR   7  -0.470 -13.474  -7.883
   46    HH   TYR   7           HH       TYR   7  -2.064 -15.145  -7.548
   47    H    ARG   8           H        ARG   8  -0.419  -8.387  -2.124
   48    HA   ARG   8           HA       ARG   8   1.676  -6.361  -2.568
   49    HB2  ARG   8           HB2      ARG   8   0.428  -4.574  -1.456
   50    HB3  ARG   8           HB3      ARG   8  -0.414  -5.107  -2.917
   51    HG2  ARG   8           HG2      ARG   8  -1.312  -6.372  -0.355
   52    HG3  ARG   8           HG3      ARG   8  -1.662  -4.665  -0.582
   53    HD2  ARG   8           HD2      ARG   8  -2.748  -5.102  -2.739
   54    HD3  ARG   8           HD3      ARG   8  -2.340  -6.802  -2.648
   55    HE   ARG   8           HE       ARG   8  -3.973  -7.225  -1.086
   56   HH11  ARG   8          HH21      ARG   8  -3.874  -3.668  -1.542
   57   HH12  ARG   8          HH22      ARG   8  -5.254  -3.394  -0.554
   58   HH21  ARG   8          HH11      ARG   8  -5.678  -6.811   0.319
   59   HH22  ARG   8          HH12      ARG   8  -6.356  -5.220   0.474
   60    HA   PRO   9           HA       PRO   9   2.808  -8.100   1.332
   61    HB2  PRO   9           HB2      PRO   9   4.927  -6.591   2.055
   62    HB3  PRO   9           HB3      PRO   9   4.919  -7.535   0.554
   63    HG2  PRO   9           HG2      PRO   9   4.338  -4.566   0.872
   64    HG3  PRO   9           HG3      PRO   9   5.426  -5.363  -0.298
   65    HD2  PRO   9           HD2      PRO   9   2.816  -4.633  -0.831
   66    HD3  PRO   9           HD3      PRO   9   3.659  -5.988  -1.643
   67    H    ASN  10           H        ASN  10   2.050  -8.058   3.437
   68    HA   ASN  10           HA       ASN  10   1.237  -5.458   4.662
   69    HB2  ASN  10           HB2      ASN  10  -0.392  -7.985   4.225
   70    HB3  ASN  10           HB3      ASN  10  -0.716  -6.949   5.612
   71   HD21  ASN  10          HD22      ASN  10  -1.411  -4.702   5.288
   72   HD22  ASN  10          HD21      ASN  10  -2.191  -4.289   3.777
   73    H    VAL  11           H        VAL  11   0.897  -5.708   7.051
   74    HA   VAL  11           HA       VAL  11   2.450  -7.894   8.277
   75    HB   VAL  11           HB       VAL  11   3.452  -6.196   9.878
   76   HG11  VAL  11          HG11      VAL  11   5.269  -5.536   8.178
   77   HG12  VAL  11          HG12      VAL  11   5.007  -7.189   8.694
   78   HG13  VAL  11          HG13      VAL  11   4.374  -6.669   7.123
   79   HG21  VAL  11          HG21      VAL  11   3.793  -3.920   9.133
   80   HG22  VAL  11          HG22      VAL  11   2.894  -4.200   7.636
   81   HG23  VAL  11          HG23      VAL  11   2.054  -4.219   9.212
   82    H    GLY  12           H        GLY  12   1.906  -8.011  10.687
   83    HA2  GLY  12           HA2      GLY  12  -0.237  -6.344  11.670
   84    HA3  GLY  12           HA3      GLY  12  -0.718  -8.034  11.431
   85    H    ILE  13           H        ILE  13  -0.682  -6.896  14.019
   86    HA   ILE  13           HA       ILE  13   1.746  -8.077  15.238
   87    HB   ILE  13           HB       ILE  13   0.459  -5.499  16.220
   88   HG12  ILE  13          HG12      ILE  13   2.790  -4.571  15.269
   89   HG13  ILE  13          HG13      ILE  13   2.569  -5.854  14.088
   90   HG21  ILE  13          HG21      ILE  13   3.107  -6.927  16.653
   91   HG22  ILE  13          HG22      ILE  13   2.679  -5.354  17.369
   92   HG23  ILE  13          HG23      ILE  13   1.766  -6.776  17.825
   93   HD11  ILE  13          HD11      ILE  13   1.767  -3.694  13.263
   94   HD12  ILE  13          HD12      ILE  13   0.376  -4.784  13.427
   95   HD13  ILE  13          HD13      ILE  13   0.664  -3.532  14.648
   96    H    VAL  14           H        VAL  14   1.446  -9.115  17.161
   97    HA   VAL  14           HA       VAL  14  -1.288  -9.217  18.344
   98    HB   VAL  14           HB       VAL  14   0.820 -11.411  18.546
   99   HG11  VAL  14          HG11      VAL  14  -0.960 -11.410  20.274
  100   HG12  VAL  14          HG12      VAL  14  -2.202 -11.403  19.008
  101   HG13  VAL  14          HG13      VAL  14  -1.116 -12.802  19.220
  102   HG21  VAL  14          HG21      VAL  14  -0.417 -12.701  16.852
  103   HG22  VAL  14          HG22      VAL  14  -1.385 -11.250  16.462
  104   HG23  VAL  14          HG23      VAL  14   0.374 -11.282  16.167
  105    H    ILE  15           H        ILE  15  -1.272  -8.753  20.594
  106    HA   ILE  15           HA       ILE  15   1.399  -8.562  21.851
  107    HB   ILE  15           HB       ILE  15  -0.935  -6.823  22.709
  108   HG12  ILE  15          HG12      ILE  15  -0.162  -6.065  20.455
  109   HG13  ILE  15          HG13      ILE  15   0.103  -4.899  21.745
  110   HG21  ILE  15          HG21      ILE  15   0.582  -7.316  24.506
  111   HG22  ILE  15          HG22      ILE  15   1.997  -6.968  23.490
  112   HG23  ILE  15          HG23      ILE  15   0.882  -5.661  23.946
  113   HD11  ILE  15          HD11      ILE  15   2.033  -5.094  20.167
  114   HD12  ILE  15          HD12      ILE  15   2.466  -5.420  21.854
  115   HD13  ILE  15          HD13      ILE  15   2.266  -6.774  20.703
  116    H    CYS  16           H        CYS  16   1.611  -9.890  23.630
  117    HA   CYS  16           HA       CYS  16  -0.917 -11.012  24.739
  118    HB2  CYS  16           HB2      CYS  16   1.670 -12.584  24.368
  119    HB3  CYS  16           HB3      CYS  16   0.166 -13.177  25.096
  120    HG   CYS  16           HG       CYS  16   0.421 -14.179  22.679
  121    H    ASN  17           H        ASN  17  -0.990 -11.381  26.931
  122    HA   ASN  17           HA       ASN  17   1.134 -10.066  28.561
  123    HB2  ASN  17           HB2      ASN  17  -0.496  -9.707  30.256
  124    HB3  ASN  17           HB3      ASN  17  -1.169  -9.139  28.742
  125   HD21  ASN  17          HD22      ASN  17  -3.138  -9.316  30.359
  126   HD22  ASN  17          HD21      ASN  17  -3.996 -10.843  30.333
  127    H    ARG  18           H        ARG  18   1.376 -11.357  30.855
  128    HA   ARG  18           HA       ARG  18   2.093 -14.085  30.032
  129    HB2  ARG  18           HB2      ARG  18   2.402 -12.762  32.755
  130    HB3  ARG  18           HB3      ARG  18   2.969 -14.374  32.302
  131    HG2  ARG  18           HG2      ARG  18   4.888 -13.359  31.932
  132    HG3  ARG  18           HG3      ARG  18   4.173 -13.089  30.341
  133    HD2  ARG  18           HD2      ARG  18   3.672 -10.799  30.877
  134    HD3  ARG  18           HD3      ARG  18   3.901 -11.071  32.603
  135    HE   ARG  18           HE       ARG  18   6.031 -10.927  30.520
  136   HH11  ARG  18          HH21      ARG  18   5.160 -10.608  34.002
  137   HH12  ARG  18          HH22      ARG  18   6.808 -10.445  34.497
  138   HH21  ARG  18          HH11      ARG  18   8.178 -10.623  31.224
  139   HH22  ARG  18          HH12      ARG  18   8.537 -10.359  32.892
  140    H    GLN  19           H        GLN  19  -0.847 -13.008  30.633
  141    HA   GLN  19           HA       GLN  19  -1.744 -15.342  32.178
  142    HB2  GLN  19           HB2      GLN  19  -3.590 -13.268  31.023
  143    HB3  GLN  19           HB3      GLN  19  -3.866 -14.342  32.379
  144    HG2  GLN  19           HG2      GLN  19  -2.095 -11.878  32.283
  145    HG3  GLN  19           HG3      GLN  19  -3.627 -12.037  33.116
  146   HE21  GLN  19          HE22      GLN  19  -1.197 -11.171  34.404
  147   HE22  GLN  19          HE21      GLN  19  -0.681 -12.398  35.541
  148    H    GLY  20           H        GLY  20  -0.913 -14.627  28.965
  149    HA2  GLY  20           HA2      GLY  20  -1.246 -15.858  27.063
  150    HA3  GLY  20           HA3      GLY  20  -2.345 -16.947  27.920
  151    H    GLN  21           H        GLN  21  -2.937 -13.440  28.104
  152    HA   GLN  21           HA       GLN  21  -5.314 -13.794  26.360
  153    HB2  GLN  21           HB2      GLN  21  -4.568 -11.416  28.094
  154    HB3  GLN  21           HB3      GLN  21  -6.055 -11.643  27.179
  155    HG2  GLN  21           HG2      GLN  21  -6.743 -13.494  28.622
  156    HG3  GLN  21           HG3      GLN  21  -5.202 -13.412  29.492
  157   HE21  GLN  21          HE22      GLN  21  -8.354 -11.748  29.073
  158   HE22  GLN  21          HE21      GLN  21  -8.111 -10.663  30.416
  159    H    VAL  22           H        VAL  22  -5.428 -12.653  24.466
  160    HA   VAL  22           HA       VAL  22  -3.006 -11.246  23.541
  161    HB   VAL  22           HB       VAL  22  -3.476 -11.949  21.353
  162   HG11  VAL  22          HG11      VAL  22  -4.129 -14.471  22.902
  163   HG12  VAL  22          HG12      VAL  22  -3.023 -14.226  21.510
  164   HG13  VAL  22          HG13      VAL  22  -2.591 -13.670  23.145
  165   HG21  VAL  22          HG21      VAL  22  -5.383 -13.358  20.676
  166   HG22  VAL  22          HG22      VAL  22  -6.116 -13.180  22.288
  167   HG23  VAL  22          HG23      VAL  22  -5.933 -11.772  21.230
  168    H    MET  23           H        MET  23  -3.264  -9.253  22.507
  169    HA   MET  23           HA       MET  23  -5.536  -7.601  23.191
  170    HB2  MET  23           HB2      MET  23  -3.396  -6.586  22.903
  171    HB3  MET  23           HB3      MET  23  -3.161  -7.310  21.311
  172    HG2  MET  23           HG2      MET  23  -4.846  -5.898  20.315
  173    HG3  MET  23           HG3      MET  23  -5.315  -5.241  21.884
  174    HE1  MET  23           HE1      MET  23  -3.074  -4.342  23.493
  175    HE2  MET  23           HE2      MET  23  -2.615  -2.767  22.825
  176    HE3  MET  23           HE3      MET  23  -4.338  -3.213  22.944
  177    H    TRP  24           H        TRP  24  -7.380  -7.165  22.060
  178    HA   TRP  24           HA       TRP  24  -7.688  -7.991  19.223
  179    HB2  TRP  24           HB2      TRP  24  -8.504  -9.789  20.737
  180    HB3  TRP  24           HB3      TRP  24  -9.510  -8.623  21.586
  181    HD1  TRP  24           HD1      TRP  24 -11.924  -9.013  21.003
  182    HE1  TRP  24           HE1      TRP  24 -13.279  -9.851  19.024
  183    HE3  TRP  24           HE3      TRP  24  -8.105  -9.660  17.669
  184    HZ2  TRP  24           HZ2      TRP  24 -12.723 -11.011  16.405
  185    HZ3  TRP  24           HZ3      TRP  24  -8.520 -10.731  15.493
  186    HH2  TRP  24           HH2      TRP  24 -10.845 -11.429  14.858
  187    H    ALA  25           H        ALA  25  -9.055  -6.422  18.092
  188    HA   ALA  25           HA       ALA  25 -10.038  -4.172  19.761
  189    HB1  ALA  25           HB1      ALA  25  -8.083  -3.900  17.452
  190    HB2  ALA  25           HB2      ALA  25  -8.845  -2.574  18.362
  191    HB3  ALA  25           HB3      ALA  25  -7.699  -3.650  19.173
  192    H    ARG  26           H        ARG  26 -11.326  -2.621  18.592
  193    HA   ARG  26           HA       ARG  26 -12.882  -3.795  16.330
  194    HB2  ARG  26           HB2      ARG  26 -14.109  -3.809  18.456
  195    HB3  ARG  26           HB3      ARG  26 -13.839  -2.079  18.661
  196    HG2  ARG  26           HG2      ARG  26 -15.255  -1.541  16.781
  197    HG3  ARG  26           HG3      ARG  26 -15.255  -3.220  16.223
  198    HD2  ARG  26           HD2      ARG  26 -17.387  -2.781  17.239
  199    HD3  ARG  26           HD3      ARG  26 -16.483  -3.913  18.252
  200    HE   ARG  26           HE       ARG  26 -16.234  -1.073  19.008
  201   HH11  ARG  26          HH11      ARG  26 -18.284  -3.964  19.489
  202   HH12  ARG  26          HH12      ARG  26 -18.902  -3.397  21.001
  203   HH21  ARG  26          HH21      ARG  26 -17.059  -0.347  20.837
  204   HH22  ARG  26          HH22      ARG  26 -18.176  -1.260  21.838
  205    H    ARG  27           H        ARG  27 -12.508  -2.542  14.460
  206    HA   ARG  27           HA       ARG  27 -11.039  -0.098  14.763
  207    HB2  ARG  27           HB2      ARG  27 -11.030  -1.654  12.691
  208    HB3  ARG  27           HB3      ARG  27 -12.489  -0.770  12.193
  209    HG2  ARG  27           HG2      ARG  27 -11.240   1.370  12.313
  210    HG3  ARG  27           HG3      ARG  27  -9.803   0.494  12.871
  211    HD2  ARG  27           HD2      ARG  27  -9.670  -0.654  10.689
  212    HD3  ARG  27           HD3      ARG  27 -11.100   0.259  10.141
  213    HE   ARG  27           HE       ARG  27  -9.115   2.040  11.205
  214   HH11  ARG  27          HH11      ARG  27  -9.694   0.117   8.268
  215   HH12  ARG  27          HH12      ARG  27  -8.766   1.167   7.251
  216   HH21  ARG  27          HH21      ARG  27  -7.914   3.401   9.919
  217   HH22  ARG  27          HH22      ARG  27  -7.720   3.093   8.216
  218    H    PHE  28           H        PHE  28 -11.720   2.111  14.207
  219    HA   PHE  28           HA       PHE  28 -14.257   2.767  15.409
  220    HB2  PHE  28           HB2      PHE  28 -12.230   4.170  15.593
  221    HB3  PHE  28           HB3      PHE  28 -12.265   4.450  13.855
  222    HD1  PHE  28           HD2      PHE  28 -14.270   4.938  17.006
  223    HD2  PHE  28           HD1      PHE  28 -13.477   6.299  12.985
  224    HE1  PHE  28           HE2      PHE  28 -15.674   6.946  17.403
  225    HE2  PHE  28           HE1      PHE  28 -14.880   8.302  13.388
  226    HZ   PHE  28           HZ       PHE  28 -15.984   8.627  15.594
  227    H    GLY  29           H        GLY  29 -16.141   3.488  14.399
  228    HA2  GLY  29           HA2      GLY  29 -17.688   3.781  12.752
  229    HA3  GLY  29           HA3      GLY  29 -16.382   3.818  11.560
  230    H    GLN  30           H        GLN  30 -16.180   0.868  13.344
  231    HA   GLN  30           HA       GLN  30 -18.114  -0.532  11.605
  232    HB2  GLN  30           HB2      GLN  30 -16.611  -1.915  10.637
  233    HB3  GLN  30           HB3      GLN  30 -15.578  -0.492  10.817
  234    HG2  GLN  30           HG2      GLN  30 -14.609  -1.492  12.883
  235    HG3  GLN  30           HG3      GLN  30 -15.609  -2.911  12.653
  236   HE21  GLN  30          HE22      GLN  30 -13.466  -4.038  12.728
  237   HE22  GLN  30          HE21      GLN  30 -12.552  -4.161  11.241
  238    H    HIS  31           H        HIS  31 -18.801  -2.606  12.485
  239    HA   HIS  31           HA       HIS  31 -18.570  -2.688  15.444
  240    HB2  HIS  31           HB2      HIS  31 -20.495  -4.121  13.595
  241    HB3  HIS  31           HB3      HIS  31 -20.535  -4.112  15.358
  242    HD1  HIS  31           HD1      HIS  31 -22.674  -2.737  13.065
  243    HD2  HIS  31           HD2      HIS  31 -20.103  -0.956  15.895
  244    HE1  HIS  31           HE1      HIS  31 -23.610  -0.414  13.523
  245    H    SER  32           H        SER  32 -17.200  -4.266  12.697
  246    HA   SER  32           HA       SER  32 -16.864  -6.879  13.885
  247    HB2  SER  32           HB2      SER  32 -15.286  -6.972  11.755
  248    HB3  SER  32           HB3      SER  32 -17.052  -6.999  11.610
  249    HG   SER  32           HG       SER  32 -16.169  -5.486  10.157
  250    H    TRP  33           H        TRP  33 -14.827  -7.838  14.412
  251    HA   TRP  33           HA       TRP  33 -12.824  -5.914  15.526
  252    HB2  TRP  33           HB2      TRP  33 -13.623  -8.703  16.436
  253    HB3  TRP  33           HB3      TRP  33 -12.356  -7.706  17.140
  254    HD1  TRP  33           HD1      TRP  33 -16.213  -7.549  16.733
  255    HE1  TRP  33           HE1      TRP  33 -17.208  -6.531  18.839
  256    HE3  TRP  33           HE3      TRP  33 -11.884  -6.575  19.246
  257    HZ2  TRP  33           HZ2      TRP  33 -16.228  -5.231  21.265
  258    HZ3  TRP  33           HZ3      TRP  33 -11.925  -5.403  21.430
  259    HH2  TRP  33           HH2      TRP  33 -14.092  -4.712  22.437
  260    H    GLN  34           H        GLN  34 -10.679  -6.611  15.699
  261    HA   GLN  34           HA       GLN  34  -9.669  -8.498  13.719
  262    HB2  GLN  34           HB2      GLN  34  -8.738  -6.863  12.261
  263    HB3  GLN  34           HB3      GLN  34 -10.437  -6.475  12.400
  264    HG2  GLN  34           HG2      GLN  34  -8.140  -5.050  13.797
  265    HG3  GLN  34           HG3      GLN  34  -8.974  -4.498  12.352
  266   HE21  GLN  34          HE22      GLN  34  -8.519  -3.201  15.000
  267   HE22  GLN  34          HE21      GLN  34 -10.109  -2.728  15.522
  268    H    PHE  35           H        PHE  35  -7.301  -8.552  13.729
  269    HA   PHE  35           HA       PHE  35  -6.090  -7.768  16.312
  270    HB2  PHE  35           HB2      PHE  35  -4.998  -9.210  13.863
  271    HB3  PHE  35           HB3      PHE  35  -4.037  -8.820  15.290
  272    HD1  PHE  35           HD2      PHE  35  -5.470  -9.564  17.600
  273    HD2  PHE  35           HD1      PHE  35  -5.347 -11.552  13.753
  274    HE1  PHE  35           HE2      PHE  35  -6.088 -11.693  18.683
  275    HE2  PHE  35           HE1      PHE  35  -5.920 -13.681  14.874
  276    HZ   PHE  35           HZ       PHE  35  -6.357 -13.757  17.306
  277    HA   PRO  36           HA       PRO  36  -4.305  -3.952  14.609
  278    HB2  PRO  36           HB2      PRO  36  -1.691  -5.002  15.694
  279    HB3  PRO  36           HB3      PRO  36  -2.370  -3.349  15.820
  280    HG2  PRO  36           HG2      PRO  36  -2.523  -5.058  17.921
  281    HG3  PRO  36           HG3      PRO  36  -3.940  -4.050  17.485
  282    HD2  PRO  36           HD2      PRO  36  -3.459  -6.974  16.890
  283    HD3  PRO  36           HD3      PRO  36  -4.960  -6.144  17.372
  284    H    GLN  37           H        GLN  37  -3.545  -3.429  12.569
  285    HA   GLN  37           HA       GLN  37  -1.960  -5.462  11.067
  286    HB2  GLN  37           HB2      GLN  37  -4.533  -4.034  10.263
  287    HB3  GLN  37           HB3      GLN  37  -3.445  -4.788   9.094
  288    HG2  GLN  37           HG2      GLN  37  -3.601  -6.930  10.393
  289    HG3  GLN  37           HG3      GLN  37  -4.878  -6.170  11.360
  290   HE21  GLN  37          HE22      GLN  37  -6.982  -5.809  10.392
  291   HE22  GLN  37          HE21      GLN  37  -7.390  -6.474   8.825
  292    H    GLY  38           H        GLY  38  -1.107  -4.617   8.995
  293    HA2  GLY  38           HA2      GLY  38  -1.025  -1.748   8.579
  294    HA3  GLY  38           HA3      GLY  38   0.530  -2.414   9.095
  295    H    GLY  39           H        GLY  39   0.450  -1.210   6.682
  296    HA2  GLY  39           HA2      GLY  39   0.615  -3.396   4.661
  297    HA3  GLY  39           HA3      GLY  39   0.363  -1.683   4.297
  298    H    ILE  40           H        ILE  40   2.659  -3.699   3.821
  299    HA   ILE  40           HA       ILE  40   4.942  -2.303   5.096
  300    HB   ILE  40           HB       ILE  40   4.785  -4.514   3.034
  301   HG12  ILE  40          HG12      ILE  40   6.055  -4.707   5.775
  302   HG13  ILE  40          HG13      ILE  40   4.330  -4.975   5.583
  303   HG21  ILE  40          HG21      ILE  40   6.791  -3.175   2.543
  304   HG22  ILE  40          HG22      ILE  40   7.262  -3.205   4.259
  305   HG23  ILE  40          HG23      ILE  40   7.291  -4.681   3.288
  306   HD11  ILE  40          HD11      ILE  40   4.644  -6.895   4.243
  307   HD12  ILE  40          HD12      ILE  40   6.372  -6.560   3.964
  308   HD13  ILE  40          HD13      ILE  40   5.817  -7.063   5.551
  309    H    ASN  41           H        ASN  41   5.785  -0.484   4.190
  310    HA   ASN  41           HA       ASN  41   4.714   0.470   1.588
  311    HB2  ASN  41           HB2      ASN  41   6.056   1.794   3.935
  312    HB3  ASN  41           HB3      ASN  41   6.398   2.431   2.338
  313   HD21  ASN  41          HD22      ASN  41   3.524   1.423   4.337
  314   HD22  ASN  41          HD21      ASN  41   2.479   2.662   3.681
  315    HA   PRO  42           HA       PRO  42   7.901  -1.288  -0.590
  316    HB2  PRO  42           HB2      PRO  42   8.664   0.525  -2.541
  317    HB3  PRO  42           HB3      PRO  42   7.136  -0.408  -2.540
  318    HG2  PRO  42           HG2      PRO  42   7.592   2.434  -1.586
  319    HG3  PRO  42           HG3      PRO  42   6.266   1.812  -2.618
  320    HD2  PRO  42           HD2      PRO  42   5.940   2.209   0.047
  321    HD3  PRO  42           HD3      PRO  42   5.176   0.819  -0.769
  322    H    GLY  43           H        GLY  43   9.880  -1.734   0.216
  323    HA2  GLY  43           HA2      GLY  43  12.216  -1.303   0.312
  324    HA3  GLY  43           HA3      GLY  43  11.906   0.409   0.602
  325    H    GLU  44           H        GLU  44   9.674  -0.479   2.708
  326    HA   GLU  44           HA       GLU  44  11.425  -0.721   4.986
  327    HB2  GLU  44           HB2      GLU  44   8.428  -0.729   4.534
  328    HB3  GLU  44           HB3      GLU  44   9.092  -1.242   6.075
  329    HG2  GLU  44           HG2      GLU  44   8.441   1.102   6.096
  330    HG3  GLU  44           HG3      GLU  44  10.136   0.838   6.487
  331    H    SER  45           H        SER  45  11.484  -2.551   6.446
  332    HA   SER  45           HA       SER  45  11.170  -5.193   5.160
  333    HB2  SER  45           HB2      SER  45  12.236  -5.988   7.256
  334    HB3  SER  45           HB3      SER  45  13.228  -4.793   6.406
  335    HG   SER  45           HG       SER  45  12.950  -4.489   8.754
  336    H    ALA  46           H        ALA  46  10.026  -6.865   6.571
  337    HA   ALA  46           HA       ALA  46   7.378  -6.111   7.182
  338    HB1  ALA  46           HB1      ALA  46   7.211  -8.359   8.157
  339    HB2  ALA  46           HB2      ALA  46   8.151  -8.449   6.669
  340    HB3  ALA  46           HB3      ALA  46   8.982  -8.494   8.243
  341    H    GLU  47           H        GLU  47  10.264  -6.362   9.252
  342    HA   GLU  47           HA       GLU  47   8.870  -5.956  11.729
  343    HB2  GLU  47           HB2      GLU  47  10.965  -7.171  11.432
  344    HB3  GLU  47           HB3      GLU  47  11.793  -5.667  10.962
  345    HG2  GLU  47           HG2      GLU  47  11.213  -4.746  13.251
  346    HG3  GLU  47           HG3      GLU  47  10.559  -6.339  13.652
  347    H    GLN  48           H        GLN  48  10.593  -3.716   9.475
  348    HA   GLN  48           HA       GLN  48  10.275  -1.426  11.222
  349    HB2  GLN  48           HB2      GLN  48  10.771  -1.704   8.230
  350    HB3  GLN  48           HB3      GLN  48  10.623  -0.132   9.036
  351    HG2  GLN  48           HG2      GLN  48  12.473  -0.634  10.534
  352    HG3  GLN  48           HG3      GLN  48  12.605  -2.271   9.885
  353   HE21  GLN  48          HE22      GLN  48  13.337  -2.543   7.662
  354   HE22  GLN  48          HE21      GLN  48  14.284  -1.290   6.862
  355    H    ALA  49           H        ALA  49   8.254  -2.835   8.571
  356    HA   ALA  49           HA       ALA  49   6.318  -0.700   8.702
  357    HB1  ALA  49           HB1      ALA  49   6.027  -3.565   7.752
  358    HB2  ALA  49           HB2      ALA  49   4.896  -2.234   7.430
  359    HB3  ALA  49           HB3      ALA  49   6.545  -2.176   6.753
  360    H    MET  50           H        MET  50   6.689  -3.852  10.422
  361    HA   MET  50           HA       MET  50   4.222  -3.852  11.798
  362    HB2  MET  50           HB2      MET  50   5.544  -5.790  11.893
  363    HB3  MET  50           HB3      MET  50   6.988  -4.959  12.427
  364    HG2  MET  50           HG2      MET  50   4.508  -5.086  14.106
  365    HG3  MET  50           HG3      MET  50   5.671  -6.391  14.095
  366    HE1  MET  50           HE1      MET  50   8.014  -6.358  14.951
  367    HE2  MET  50           HE2      MET  50   8.589  -4.860  14.174
  368    HE3  MET  50           HE3      MET  50   8.737  -5.062  15.923
  369    H    TYR  51           H        TYR  51   7.378  -2.378  12.932
  370    HA   TYR  51           HA       TYR  51   6.087  -1.232  15.194
  371    HB2  TYR  51           HB2      TYR  51   8.655  -0.479  13.747
  372    HB3  TYR  51           HB3      TYR  51   8.115   0.290  15.238
  373    HD1  TYR  51           HD2      TYR  51   7.266  -1.606  17.095
  374    HD2  TYR  51           HD1      TYR  51  10.435  -1.917  14.187
  375    HE1  TYR  51           HE2      TYR  51   8.575  -2.995  18.671
  376    HE2  TYR  51           HE1      TYR  51  11.759  -3.275  15.760
  377    HH   TYR  51           HH       TYR  51  11.866  -4.225  17.919
  378    H    ARG  52           H        ARG  52   6.748   0.170  11.951
  379    HA   ARG  52           HA       ARG  52   5.943   2.828  12.544
  380    HB2  ARG  52           HB2      ARG  52   7.209   2.209  10.579
  381    HB3  ARG  52           HB3      ARG  52   5.920   1.179   9.978
  382    HG2  ARG  52           HG2      ARG  52   5.131   4.032  10.425
  383    HG3  ARG  52           HG3      ARG  52   6.414   3.767   9.233
  384    HD2  ARG  52           HD2      ARG  52   4.764   1.962   8.248
  385    HD3  ARG  52           HD3      ARG  52   3.552   2.842   9.198
  386    HE   ARG  52           HE       ARG  52   5.381   4.107   7.191
  387   HH11  ARG  52          HH21      ARG  52   1.974   3.542   8.139
  388   HH12  ARG  52          HH22      ARG  52   1.397   4.959   7.331
  389   HH21  ARG  52          HH11      ARG  52   4.561   5.912   6.036
  390   HH22  ARG  52          HH12      ARG  52   2.873   6.250   6.022
  391    H    GLU  53           H        GLU  53   4.056   0.014  11.358
  392    HA   GLU  53           HA       GLU  53   1.684   1.631  11.115
  393    HB2  GLU  53           HB2      GLU  53   2.149  -1.365  10.892
  394    HB3  GLU  53           HB3      GLU  53   0.598  -0.583  10.589
  395    HG2  GLU  53           HG2      GLU  53   3.098   0.326   9.129
  396    HG3  GLU  53           HG3      GLU  53   2.168  -1.049   8.557
  397    H    LEU  54           H        LEU  54   3.010  -0.618  13.578
  398    HA   LEU  54           HA       LEU  54   0.759  -1.081  15.134
  399    HB2  LEU  54           HB2      LEU  54   3.012  -2.057  15.548
  400    HB3  LEU  54           HB3      LEU  54   3.606  -0.467  16.044
  401    HG   LEU  54           HG       LEU  54   1.927  -0.558  17.941
  402   HD11  LEU  54          HD11      LEU  54   0.408  -2.327  17.011
  403   HD12  LEU  54          HD12      LEU  54   1.750  -3.457  17.006
  404   HD13  LEU  54          HD13      LEU  54   1.117  -2.876  18.546
  405   HD21  LEU  54          HD21      LEU  54   4.098  -2.690  17.791
  406   HD22  LEU  54          HD22      LEU  54   4.299  -0.996  18.300
  407   HD23  LEU  54          HD23      LEU  54   3.339  -2.094  19.294
  408    H    PHE  55           H        PHE  55   2.903   1.854  15.181
  409    HA   PHE  55           HA       PHE  55   1.624   3.134  17.326
  410    HB2  PHE  55           HB2      PHE  55   3.734   3.886  16.182
  411    HB3  PHE  55           HB3      PHE  55   2.755   4.490  14.847
  412    HD1  PHE  55           HD1      PHE  55   1.251   6.467  15.176
  413    HD2  PHE  55           HD2      PHE  55   3.738   4.983  18.376
  414    HE1  PHE  55           HE1      PHE  55   0.863   8.559  16.456
  415    HE2  PHE  55           HE2      PHE  55   3.345   7.078  19.650
  416    HZ   PHE  55           HZ       PHE  55   1.907   8.870  18.695
  417    H    GLU  56           H        GLU  56   0.550   2.959  13.889
  418    HA   GLU  56           HA       GLU  56  -1.394   5.005  14.216
  419    HB2  GLU  56           HB2      GLU  56  -1.002   2.891  12.083
  420    HB3  GLU  56           HB3      GLU  56  -2.279   4.099  12.017
  421    HG2  GLU  56           HG2      GLU  56   0.645   4.865  12.342
  422    HG3  GLU  56           HG3      GLU  56  -0.112   4.637  10.764
  423    H    GLU  57           H        GLU  57  -1.317   1.666  15.108
  424    HA   GLU  57           HA       GLU  57  -4.249   1.296  15.018
  425    HB2  GLU  57           HB2      GLU  57  -1.988  -0.584  15.805
  426    HB3  GLU  57           HB3      GLU  57  -3.675  -1.032  15.688
  427    HG2  GLU  57           HG2      GLU  57  -2.016  -0.062  13.328
  428    HG3  GLU  57           HG3      GLU  57  -2.221  -1.741  13.785
  429    H    VAL  58           H        VAL  58  -1.572   1.181  17.399
  430    HA   VAL  58           HA       VAL  58  -3.558   1.180  19.638
  431    HB   VAL  58           HB       VAL  58  -2.411  -0.897  19.248
  432   HG11  VAL  58          HG11      VAL  58   0.075  -1.097  19.639
  433   HG12  VAL  58          HG12      VAL  58  -0.612  -0.681  18.076
  434   HG13  VAL  58          HG13      VAL  58   0.082   0.601  19.057
  435   HG21  VAL  58          HG21      VAL  58  -1.357   0.191  21.823
  436   HG22  VAL  58          HG22      VAL  58  -2.931  -0.597  21.499
  437   HG23  VAL  58          HG23      VAL  58  -1.438  -1.509  21.318
  438    H    GLY  59           H        GLY  59  -1.374   3.286  18.183
  439    HA2  GLY  59           HA2      GLY  59  -0.232   5.146  18.896
  440    HA3  GLY  59           HA3      GLY  59  -1.054   5.000  20.456
  441    H    LEU  60           H        LEU  60   0.383   2.048  19.943
  442    HA   LEU  60           HA       LEU  60   2.454   2.539  21.882
  443    HB2  LEU  60           HB2      LEU  60   0.913   0.561  21.494
  444    HB3  LEU  60           HB3      LEU  60   1.969   0.138  20.127
  445    HG   LEU  60           HG       LEU  60   3.769  -0.487  21.548
  446   HD11  LEU  60          HD11      LEU  60   2.076   0.489  23.884
  447   HD12  LEU  60          HD12      LEU  60   3.628  -0.392  23.973
  448   HD13  LEU  60          HD13      LEU  60   3.589   1.235  23.311
  449   HD21  LEU  60          HD21      LEU  60   0.958  -1.362  22.570
  450   HD22  LEU  60          HD22      LEU  60   1.763  -2.022  21.145
  451   HD23  LEU  60          HD23      LEU  60   2.452  -2.314  22.749
  452    H    SER  61           H        SER  61   4.697   2.450  21.588
  453    HA   SER  61           HA       SER  61   5.721   2.613  18.792
  454    HB2  SER  61           HB2      SER  61   7.332   4.306  19.766
  455    HB3  SER  61           HB3      SER  61   5.642   4.820  19.742
  456    HG   SER  61           HG       SER  61   6.582   5.281  21.763
  457    H    ARG  62           H        ARG  62   8.045   2.074  18.645
  458    HA   ARG  62           HA       ARG  62   8.880  -0.413  19.335
  459    HB2  ARG  62           HB2      ARG  62  10.399   2.190  18.884
  460    HB3  ARG  62           HB3      ARG  62  11.293   0.750  19.395
  461    HG2  ARG  62           HG2      ARG  62  10.308  -0.551  17.597
  462    HG3  ARG  62           HG3      ARG  62   9.412   0.868  17.029
  463    HD2  ARG  62           HD2      ARG  62  11.341   0.404  15.637
  464    HD3  ARG  62           HD3      ARG  62  11.556   1.959  16.495
  465    HE   ARG  62           HE       ARG  62  12.719  -0.347  17.859
  466   HH11  ARG  62          HH11      ARG  62  13.369   2.002  15.264
  467   HH12  ARG  62          HH12      ARG  62  15.087   1.855  15.369
  468   HH21  ARG  62          HH21      ARG  62  15.003  -0.516  18.016
  469   HH22  ARG  62          HH22      ARG  62  16.033   0.385  16.963
  470    H    LYS  63           H        LYS  63   9.173   2.479  21.366
  471    HA   LYS  63           HA       LYS  63  11.086   1.383  23.125
  472    HB2  LYS  63           HB2      LYS  63   9.137   3.627  23.812
  473    HB3  LYS  63           HB3      LYS  63  10.782   3.387  24.432
  474    HG2  LYS  63           HG2      LYS  63   9.986   4.292  21.651
  475    HG3  LYS  63           HG3      LYS  63  10.731   5.277  22.909
  476    HD2  LYS  63           HD2      LYS  63  12.011   2.774  21.787
  477    HD3  LYS  63           HD3      LYS  63  12.253   4.372  21.057
  478    HE2  LYS  63           HE2      LYS  63  13.122   5.216  23.263
  479    HE3  LYS  63           HE3      LYS  63  12.972   3.584  23.926
  480    HZ1  LYS  63           HZ1      LYS  63  15.226   4.030  23.196
  481    HZ2  LYS  63           HZ2      LYS  63  14.609   2.836  22.272
  482    HZ3  LYS  63           HZ3      LYS  63  14.749   4.358  21.673
  483    H    ASP  64           H        ASP  64   7.673   0.837  23.073
  484    HA   ASP  64           HA       ASP  64   7.969  -0.371  25.781
  485    HB2  ASP  64           HB2      ASP  64   6.520   1.785  25.613
  486    HB3  ASP  64           HB3      ASP  64   5.289   0.690  25.001
  487    H    VAL  65           H        VAL  65   8.258  -1.483  22.996
  488    HA   VAL  65           HA       VAL  65   6.762  -3.931  23.693
  489    HB   VAL  65           HB       VAL  65   6.582  -4.306  21.126
  490   HG11  VAL  65          HG11      VAL  65   4.698  -2.537  22.718
  491   HG12  VAL  65          HG12      VAL  65   4.270  -3.371  21.199
  492   HG13  VAL  65          HG13      VAL  65   4.687  -4.309  22.645
  493   HG21  VAL  65          HG21      VAL  65   7.706  -2.018  20.615
  494   HG22  VAL  65          HG22      VAL  65   6.222  -2.436  19.716
  495   HG23  VAL  65          HG23      VAL  65   6.146  -1.326  21.087
  496    H    ARG  66           H        ARG  66   7.693  -5.886  22.780
  497    HA   ARG  66           HA       ARG  66  10.527  -5.679  21.926
  498    HB2  ARG  66           HB2      ARG  66  11.267  -7.293  23.548
  499    HB3  ARG  66           HB3      ARG  66  10.483  -5.964  24.405
  500    HG2  ARG  66           HG2      ARG  66   8.331  -7.575  24.239
  501    HG3  ARG  66           HG3      ARG  66   9.538  -8.835  24.026
  502    HD2  ARG  66           HD2      ARG  66   9.264  -6.843  26.292
  503    HD3  ARG  66           HD3      ARG  66   8.827  -8.575  26.330
  504    HE   ARG  66           HE       ARG  66  11.580  -8.282  25.626
  505   HH11  ARG  66          HH21      ARG  66   9.536  -7.844  28.518
  506   HH12  ARG  66          HH22      ARG  66  10.819  -8.159  29.625
  507   HH21  ARG  66          HH11      ARG  66  13.266  -8.737  27.113
  508   HH22  ARG  66          HH12      ARG  66  12.977  -8.685  28.810
  509    H    ILE  67           H        ILE  67  10.972  -7.407  20.385
  510    HA   ILE  67           HA       ILE  67   8.540  -8.774  19.438
  511    HB   ILE  67           HB       ILE  67  11.361  -8.824  18.335
  512   HG12  ILE  67          HG12      ILE  67   9.061  -7.386  16.998
  513   HG13  ILE  67          HG13      ILE  67  10.089  -6.570  18.175
  514   HG21  ILE  67          HG21      ILE  67  10.283  -9.825  16.295
  515   HG22  ILE  67          HG22      ILE  67  10.112 -10.846  17.709
  516   HG23  ILE  67          HG23      ILE  67   8.733  -9.870  17.163
  517   HD11  ILE  67          HD11      ILE  67  10.982  -7.810  15.548
  518   HD12  ILE  67          HD12      ILE  67  10.921  -6.093  15.980
  519   HD13  ILE  67          HD13      ILE  67  12.088  -7.156  16.786
  520    H    LEU  68           H        LEU  68   7.995 -10.619  20.231
  521    HA   LEU  68           HA       LEU  68   9.973 -12.311  21.717
  522    HB2  LEU  68           HB2      LEU  68   6.977 -12.470  21.413
  523    HB3  LEU  68           HB3      LEU  68   7.976 -13.567  22.351
  524    HG   LEU  68           HG       LEU  68   7.600 -10.589  23.002
  525   HD11  LEU  68          HD11      LEU  68   6.480 -11.801  24.986
  526   HD12  LEU  68          HD12      LEU  68   5.587 -11.645  23.456
  527   HD13  LEU  68          HD13      LEU  68   6.355 -13.190  23.915
  528   HD21  LEU  68          HD21      LEU  68   9.094 -12.806  24.483
  529   HD22  LEU  68          HD22      LEU  68   9.821 -11.367  23.726
  530   HD23  LEU  68          HD23      LEU  68   8.743 -11.179  25.111
  531    H    ALA  69           H        ALA  69   7.858 -12.161  18.817
  532    HA   ALA  69           HA       ALA  69   9.150 -14.422  17.553
  533    HB1  ALA  69           HB1      ALA  69   7.325 -15.950  17.514
  534    HB2  ALA  69           HB2      ALA  69   7.517 -15.504  19.215
  535    HB3  ALA  69           HB3      ALA  69   6.217 -14.787  18.268
  536    H    SER  70           H        SER  70   8.164 -14.845  15.490
  537    HA   SER  70           HA       SER  70   6.401 -12.945  14.289
  538    HB2  SER  70           HB2      SER  70   8.100 -12.063  12.625
  539    HB3  SER  70           HB3      SER  70   8.259 -11.475  14.290
  540    HG   SER  70           HG       SER  70  10.302 -12.085  13.397
  541    H    THR  71           H        THR  71   5.807 -13.584  12.038
  542    HA   THR  71           HA       THR  71   5.842 -16.452  11.924
  543    HB   THR  71           HB       THR  71   4.797 -15.937   9.562
  544    HG1  THR  71           HG1      THR  71   5.588 -13.765   9.643
  545   HG21  THR  71          HG21      THR  71   3.316 -16.740  11.151
  546   HG22  THR  71          HG22      THR  71   3.392 -15.268  12.143
  547   HG23  THR  71          HG23      THR  71   2.600 -15.236  10.555
  548    H    ARG  72           H        ARG  72   6.935 -17.831  10.892
  549    HA   ARG  72           HA       ARG  72   9.528 -17.008   9.727
  550    HB2  ARG  72           HB2      ARG  72   8.324 -19.787  10.090
  551    HB3  ARG  72           HB3      ARG  72  10.013 -19.428   9.783
  552    HG2  ARG  72           HG2      ARG  72  10.449 -18.753  11.949
  553    HG3  ARG  72           HG3      ARG  72   8.878 -18.061  12.221
  554    HD2  ARG  72           HD2      ARG  72   9.677 -20.926  12.491
  555    HD3  ARG  72           HD3      ARG  72   8.962 -19.800  13.677
  556    HE   ARG  72           HE       ARG  72   6.893 -19.870  12.166
  557   HH11  ARG  72          HH11      ARG  72   8.961 -22.702  12.806
  558   HH12  ARG  72          HH12      ARG  72   7.680 -23.848  12.628
  559   HH21  ARG  72          HH21      ARG  72   5.177 -21.377  12.013
  560   HH22  ARG  72          HH22      ARG  72   5.499 -23.083  12.130
  561    H    ASN  73           H        ASN  73   6.628 -18.732   8.833
  562    HA   ASN  73           HA       ASN  73   6.963 -18.675   5.944
  563    HB2  ASN  73           HB2      ASN  73   4.574 -19.576   6.070
  564    HB3  ASN  73           HB3      ASN  73   5.757 -20.535   6.931
  565   HD21  ASN  73          HD22      ASN  73   5.137 -21.156   9.016
  566   HD22  ASN  73          HD21      ASN  73   4.162 -20.173  10.090
  567    H    TRP  74           H        TRP  74   4.814 -17.660   4.825
  568    HA   TRP  74           HA       TRP  74   4.090 -15.069   6.136
  569    HB2  TRP  74           HB2      TRP  74   4.328 -15.818   3.171
  570    HB3  TRP  74           HB3      TRP  74   3.466 -14.399   3.735
  571    HD1  TRP  74           HD1      TRP  74   7.030 -15.793   3.485
  572    HE1  TRP  74           HE1      TRP  74   8.699 -13.854   3.576
  573    HE3  TRP  74           HE3      TRP  74   3.783 -11.973   4.474
  574    HZ2  TRP  74           HZ2      TRP  74   8.655 -11.033   4.117
  575    HZ3  TRP  74           HZ3      TRP  74   4.609  -9.646   4.750
  576    HH2  TRP  74           HH2      TRP  74   7.047  -9.189   4.728
  577    H    LEU  75           H        LEU  75   1.947 -14.587   6.319
  578    HA   LEU  75           HA       LEU  75   0.108 -16.873   5.750
  579    HB2  LEU  75           HB2      LEU  75  -0.501 -14.274   7.200
  580    HB3  LEU  75           HB3      LEU  75  -1.515 -15.710   7.060
  581    HG   LEU  75           HG       LEU  75   0.995 -15.301   8.693
  582   HD11  LEU  75          HD11      LEU  75  -1.741 -16.464   9.399
  583   HD12  LEU  75          HD12      LEU  75  -0.416 -16.086  10.527
  584   HD13  LEU  75          HD13      LEU  75  -1.230 -14.785   9.650
  585   HD21  LEU  75          HD21      LEU  75  -0.178 -18.020   7.998
  586   HD22  LEU  75          HD22      LEU  75   1.468 -17.411   7.651
  587   HD23  LEU  75          HD23      LEU  75   0.981 -17.697   9.315
  588    H    ARG  76           H        ARG  76   0.187 -16.789   3.475
  589    HA   ARG  76           HA       ARG  76  -0.735 -14.320   2.160
  590    HB2  ARG  76           HB2      ARG  76   0.996 -16.006   1.195
  591    HB3  ARG  76           HB3      ARG  76  -0.398 -17.054   0.887
  592    HG2  ARG  76           HG2      ARG  76  -1.379 -15.096  -0.492
  593    HG3  ARG  76           HG3      ARG  76   0.203 -14.314  -0.296
  594    HD2  ARG  76           HD2      ARG  76   1.174 -16.557  -1.194
  595    HD3  ARG  76           HD3      ARG  76  -0.496 -16.915  -1.701
  596    HE   ARG  76           HE       ARG  76   0.006 -14.403  -2.745
  597   HH11  ARG  76          HH11      ARG  76   1.573 -17.579  -3.060
  598   HH12  ARG  76          HH12      ARG  76   2.259 -17.250  -4.609
  599   HH21  ARG  76          HH21      ARG  76   0.899 -13.977  -4.852
  600   HH22  ARG  76          HH22      ARG  76   1.865 -15.171  -5.634
  601    H    TYR  77           H        TYR  77  -2.800 -14.082   1.279
  602    HA   TYR  77           HA       TYR  77  -4.611 -16.345   1.208
  603    HB2  TYR  77           HB2      TYR  77  -6.468 -15.260   2.399
  604    HB3  TYR  77           HB3      TYR  77  -5.149 -15.781   3.422
  605    HD1  TYR  77           HD2      TYR  77  -3.426 -14.050   4.222
  606    HD2  TYR  77           HD1      TYR  77  -7.257 -13.011   2.521
  607    HE1  TYR  77           HE2      TYR  77  -3.300 -11.879   5.314
  608    HE2  TYR  77           HE1      TYR  77  -7.138 -10.805   3.624
  609    HH   TYR  77           HH       TYR  77  -4.418  -9.899   5.822
  610    H    LYS  78           H        LYS  78  -6.342 -16.015  -0.236
  611    HA   LYS  78           HA       LYS  78  -6.067 -13.637  -2.015
  612    HB2  LYS  78           HB2      LYS  78  -7.252 -16.409  -2.412
  613    HB3  LYS  78           HB3      LYS  78  -7.803 -15.047  -3.373
  614    HG2  LYS  78           HG2      LYS  78  -6.164 -16.192  -4.619
  615    HG3  LYS  78           HG3      LYS  78  -5.543 -14.604  -4.179
  616    HD2  LYS  78           HD2      LYS  78  -3.958 -15.496  -2.670
  617    HD3  LYS  78           HD3      LYS  78  -4.815 -17.029  -2.478
  618    HE2  LYS  78           HE2      LYS  78  -3.528 -16.167  -5.104
  619    HE3  LYS  78           HE3      LYS  78  -2.650 -17.060  -3.859
  620    HZ1  LYS  78           HZ1      LYS  78  -4.273 -18.864  -4.087
  621    HZ2  LYS  78           HZ2      LYS  78  -5.065 -18.059  -5.277
  622    HZ3  LYS  78           HZ3      LYS  78  -3.538 -18.558  -5.512
  623    H    LEU  79           H        LEU  79  -7.772 -12.314  -2.335
  624    HA   LEU  79           HA       LEU  79  -9.855 -12.052  -0.346
  625    HB2  LEU  79           HB2      LEU  79  -9.540 -10.786  -3.108
  626    HB3  LEU  79           HB3      LEU  79 -10.612 -10.230  -1.831
  627    HG   LEU  79           HG       LEU  79  -7.574 -10.106  -1.894
  628   HD11  LEU  79          HD11      LEU  79  -7.987  -7.678  -1.890
  629   HD12  LEU  79          HD12      LEU  79  -8.755  -8.483  -3.274
  630   HD13  LEU  79          HD13      LEU  79  -9.751  -7.973  -1.895
  631   HD21  LEU  79          HD21      LEU  79  -7.764  -8.943   0.302
  632   HD22  LEU  79          HD22      LEU  79  -9.472  -9.439   0.374
  633   HD23  LEU  79          HD23      LEU  79  -8.183 -10.676   0.334
  634    HA   PRO  80           HA       PRO  80 -12.998 -14.275  -2.802
  635    HB2  PRO  80           HB2      PRO  80 -15.261 -13.250  -1.580
  636    HB3  PRO  80           HB3      PRO  80 -14.239 -14.509  -0.812
  637    HG2  PRO  80           HG2      PRO  80 -14.166 -11.529  -0.410
  638    HG3  PRO  80           HG3      PRO  80 -14.232 -12.800   0.856
  639    HD2  PRO  80           HD2      PRO  80 -11.873 -11.659   0.135
  640    HD3  PRO  80           HD3      PRO  80 -11.963 -13.411   0.466
  641    H    LYS  81           H        LYS  81 -14.351 -13.410  -4.688
  642    HA   LYS  81           HA       LYS  81 -13.104 -11.004  -5.534
  643    HB2  LYS  81           HB2      LYS  81 -15.343 -12.407  -6.959
  644    HB3  LYS  81           HB3      LYS  81 -14.239 -11.133  -7.580
  645    HG2  LYS  81           HG2      LYS  81 -12.344 -12.526  -7.516
  646    HG3  LYS  81           HG3      LYS  81 -13.186 -13.798  -6.629
  647    HD2  LYS  81           HD2      LYS  81 -12.899 -14.357  -9.007
  648    HD3  LYS  81           HD3      LYS  81 -14.595 -14.312  -8.508
  649    HE2  LYS  81           HE2      LYS  81 -14.873 -12.097  -9.585
  650    HE3  LYS  81           HE3      LYS  81 -13.170 -12.113 -10.074
  651    HZ1  LYS  81           HZ1      LYS  81 -14.610 -12.841 -11.871
  652    HZ2  LYS  81           HZ2      LYS  81 -13.658 -14.088 -11.423
  653    HZ3  LYS  81           HZ3      LYS  81 -15.233 -14.052 -10.978
  654    H    ARG  82           H        ARG  82 -16.043 -11.312  -3.760
  655    HA   ARG  82           HA       ARG  82 -17.157  -8.819  -4.492
  656    HB2  ARG  82           HB2      ARG  82 -18.315  -8.823  -2.375
  657    HB3  ARG  82           HB3      ARG  82 -18.374 -10.407  -3.153
  658    HG2  ARG  82           HG2      ARG  82 -16.417 -11.049  -1.562
  659    HG3  ARG  82           HG3      ARG  82 -16.795  -9.550  -0.692
  660    HD2  ARG  82           HD2      ARG  82 -18.752 -11.802  -1.285
  661    HD3  ARG  82           HD3      ARG  82 -17.884 -11.603   0.251
  662    HE   ARG  82           HE       ARG  82 -19.161  -9.174  -0.142
  663   HH11  ARG  82          HH21      ARG  82 -20.224 -12.549   0.229
  664   HH12  ARG  82          HH22      ARG  82 -21.765 -12.141   0.891
  665   HH21  ARG  82          HH11      ARG  82 -21.222  -8.627   0.728
  666   HH22  ARG  82          HH12      ARG  82 -22.340  -9.859   1.183
  667    H    LEU  83           H        LEU  83 -14.345  -9.501  -2.508
  668    HA   LEU  83           HA       LEU  83 -14.176  -6.708  -1.615
  669    HB2  LEU  83           HB2      LEU  83 -12.371  -9.054  -0.992
  670    HB3  LEU  83           HB3      LEU  83 -12.317  -7.471  -0.223
  671    HG   LEU  83           HG       LEU  83 -14.581  -9.490  -0.033
  672   HD11  LEU  83          HD11      LEU  83 -13.946  -9.795   2.253
  673   HD12  LEU  83          HD12      LEU  83 -12.507 -10.029   1.252
  674   HD13  LEU  83          HD13      LEU  83 -12.709  -8.509   2.141
  675   HD21  LEU  83          HD21      LEU  83 -15.633  -7.346   0.035
  676   HD22  LEU  83          HD22      LEU  83 -15.590  -8.006   1.669
  677   HD23  LEU  83          HD23      LEU  83 -14.431  -6.734   1.205
  678    H    VAL  84           H        VAL  84 -12.934  -8.700  -4.149
  679    HA   VAL  84           HA       VAL  84 -10.425  -7.378  -4.603
  680    HB   VAL  84           HB       VAL  84 -12.351  -8.813  -6.504
  681   HG11  VAL  84          HG11      VAL  84  -9.519  -7.857  -6.971
  682   HG12  VAL  84          HG12      VAL  84 -10.288  -9.117  -7.953
  683   HG13  VAL  84          HG13      VAL  84 -10.964  -7.482  -7.918
  684   HG21  VAL  84          HG21      VAL  84 -11.053 -10.756  -6.325
  685   HG22  VAL  84          HG22      VAL  84  -9.739  -9.921  -5.434
  686   HG23  VAL  84          HG23      VAL  84 -11.298 -10.233  -4.654
  687    H    ARG  85           H        ARG  85 -10.000  -5.427  -5.546
  688    HA   ARG  85           HA       ARG  85 -12.261  -3.885  -6.639
  689    HB2  ARG  85           HB2      ARG  85  -9.914  -3.267  -5.020
  690    HB3  ARG  85           HB3      ARG  85  -9.914  -2.266  -6.478
  691    HG2  ARG  85           HG2      ARG  85 -12.299  -2.628  -4.664
  692    HG3  ARG  85           HG3      ARG  85 -11.138  -1.278  -4.554
  693    HD2  ARG  85           HD2      ARG  85 -11.671  -0.800  -7.020
  694    HD3  ARG  85           HD3      ARG  85 -13.049  -1.881  -6.878
  695    HE   ARG  85           HE       ARG  85 -12.659   0.801  -5.743
  696   HH11  ARG  85          HH21      ARG  85 -14.728  -2.107  -5.521
  697   HH12  ARG  85          HH22      ARG  85 -16.061  -1.258  -4.832
  698   HH21  ARG  85          HH11      ARG  85 -14.436   1.902  -4.823
  699   HH22  ARG  85          HH12      ARG  85 -15.888   1.061  -4.417
  700    H    TRP  86           H        TRP  86 -12.523  -4.894  -8.500
  701    HA   TRP  86           HA       TRP  86 -10.497  -5.276 -10.478
  702    HB2  TRP  86           HB2      TRP  86 -13.532  -5.107 -10.554
  703    HB3  TRP  86           HB3      TRP  86 -12.555  -5.535 -11.959
  704    HD1  TRP  86           HD1      TRP  86 -14.260  -7.130  -9.098
  705    HE1  TRP  86           HE1      TRP  86 -13.566  -9.569  -8.809
  706    HE3  TRP  86           HE3      TRP  86 -10.268  -7.190 -12.285
  707    HZ2  TRP  86           HZ2      TRP  86 -11.304 -11.240  -9.579
  708    HZ3  TRP  86           HZ3      TRP  86  -8.859  -9.229 -12.505
  709    HH2  TRP  86           HH2      TRP  86  -9.359 -11.248 -11.146
  710    H    ASP  87           H        ASP  87 -12.323  -2.450  -9.475
  711    HA   ASP  87           HA       ASP  87 -12.441  -1.165 -12.039
  712    HB2  ASP  87           HB2      ASP  87 -14.068  -0.736 -10.274
  713    HB3  ASP  87           HB3      ASP  87 -12.800  -0.087  -9.225
  714    H    THR  88           H        THR  88 -10.009  -1.175  -9.503
  715    HA   THR  88           HA       THR  88  -8.620   1.110 -10.720
  716    HB   THR  88           HB       THR  88  -9.235   1.112  -8.250
  717    HG1  THR  88           HG1      THR  88  -7.798   2.610  -8.853
  718   HG21  THR  88          HG21      THR  88  -7.853  -0.040  -6.678
  719   HG22  THR  88          HG22      THR  88  -8.448  -1.268  -7.808
  720   HG23  THR  88          HG23      THR  88  -6.788  -0.670  -7.958
  721    H    LYS  89           H        LYS  89  -6.174   0.842 -10.787
  722    HA   LYS  89           HA       LYS  89  -5.404  -1.849 -11.667
  723    HB2  LYS  89           HB2      LYS  89  -4.831   0.719 -13.189
  724    HB3  LYS  89           HB3      LYS  89  -4.302  -0.902 -13.640
  725    HG2  LYS  89           HG2      LYS  89  -7.197   0.010 -13.435
  726    HG3  LYS  89           HG3      LYS  89  -6.251  -0.002 -14.931
  727    HD2  LYS  89           HD2      LYS  89  -6.026  -2.449 -14.840
  728    HD3  LYS  89           HD3      LYS  89  -6.858  -2.501 -13.285
  729    HE2  LYS  89           HE2      LYS  89  -8.440  -3.154 -14.940
  730    HE3  LYS  89           HE3      LYS  89  -8.913  -1.567 -14.328
  731    HZ1  LYS  89           HZ1      LYS  89  -9.078  -1.720 -16.755
  732    HZ2  LYS  89           HZ2      LYS  89  -7.985  -0.581 -16.358
  733    HZ3  LYS  89           HZ3      LYS  89  -7.490  -2.050 -16.901
  734    HA   PRO  90           HA       PRO  90  -3.782  -3.091 -11.784
  735    HB2  PRO  90           HB2      PRO  90  -2.207  -4.603 -10.191
  736    HB3  PRO  90           HB3      PRO  90  -1.556  -3.596 -11.529
  737    HG2  PRO  90           HG2      PRO  90  -1.778  -2.825  -8.584
  738    HG3  PRO  90           HG3      PRO  90  -0.291  -2.799  -9.597
  739    HD2  PRO  90           HD2      PRO  90  -1.809  -0.583  -9.222
  740    HD3  PRO  90           HD3      PRO  90  -1.111  -0.933 -10.836
  741    H    VAL  91           H        VAL  91  -5.004  -4.903 -10.935
  742    HA   VAL  91           HA       VAL  91  -6.733  -4.268  -8.707
  743    HB   VAL  91           HB       VAL  91  -6.368  -6.724 -10.508
  744   HG11  VAL  91          HG11      VAL  91  -7.484  -7.453  -8.472
  745   HG12  VAL  91          HG12      VAL  91  -8.668  -6.148  -8.615
  746   HG13  VAL  91          HG13      VAL  91  -8.616  -7.449  -9.815
  747   HG21  VAL  91          HG21      VAL  91  -7.072  -4.777 -11.817
  748   HG22  VAL  91          HG22      VAL  91  -8.406  -5.919 -11.679
  749   HG23  VAL  91          HG23      VAL  91  -8.379  -4.453 -10.669
  750    H    CYS  92           H        CYS  92  -6.764  -5.092  -6.685
  751    HA   CYS  92           HA       CYS  92  -4.464  -6.700  -5.778
  752    HB2  CYS  92           HB2      CYS  92  -5.541  -6.228  -3.528
  753    HB3  CYS  92           HB3      CYS  92  -4.922  -4.829  -4.419
  754    HG   CYS  92           HG       CYS  92  -7.085  -4.111  -3.156
  755    H    ILE  93           H        ILE  93  -4.712  -8.940  -5.801
  756    HA   ILE  93           HA       ILE  93  -7.476  -9.950  -5.262
  757    HB   ILE  93           HB       ILE  93  -7.277 -11.784  -6.557
  758   HG12  ILE  93          HG12      ILE  93  -5.091 -12.656  -6.103
  759   HG13  ILE  93          HG13      ILE  93  -5.362 -12.565  -7.836
  760   HG21  ILE  93          HG21      ILE  93  -7.776  -9.753  -7.799
  761   HG22  ILE  93          HG22      ILE  93  -6.060  -9.568  -8.243
  762   HG23  ILE  93          HG23      ILE  93  -6.987 -10.968  -8.815
  763   HD11  ILE  93          HD11      ILE  93  -3.120 -11.913  -7.483
  764   HD12  ILE  93          HD12      ILE  93  -3.972 -10.401  -7.817
  765   HD13  ILE  93          HD13      ILE  93  -3.539 -10.848  -6.142
  766    H    GLY  94           H        GLY  94  -4.296  -9.836  -3.961
  767    HA2  GLY  94           HA2      GLY  94  -5.180 -11.315  -1.665
  768    HA3  GLY  94           HA3      GLY  94  -4.023 -12.237  -2.641
  769    H    GLN  95           H        GLN  95  -2.966 -11.823  -0.401
  770    HA   GLN  95           HA       GLN  95  -0.859  -9.868  -0.821
  771    HB2  GLN  95           HB2      GLN  95  -1.170  -8.857   1.458
  772    HB3  GLN  95           HB3      GLN  95  -2.316  -8.338   0.232
  773    HG2  GLN  95           HG2      GLN  95  -2.993 -10.501   2.268
  774    HG3  GLN  95           HG3      GLN  95  -3.206  -8.784   2.600
  775   HE21  GLN  95          HE22      GLN  95  -4.867 -11.503   1.425
  776   HE22  GLN  95          HE21      GLN  95  -6.137 -10.633   0.608
  777    H    LYS  96           H        LYS  96   0.860 -10.113   0.731
  778    HA   LYS  96           HA       LYS  96   0.913 -12.811   2.087
  779    HB2  LYS  96           HB2      LYS  96   3.179 -10.916   1.233
  780    HB3  LYS  96           HB3      LYS  96   3.372 -12.387   2.199
  781    HG2  LYS  96           HG2      LYS  96   2.558 -13.770   0.354
  782    HG3  LYS  96           HG3      LYS  96   2.256 -12.318  -0.618
  783    HD2  LYS  96           HD2      LYS  96   4.364 -13.446  -1.260
  784    HD3  LYS  96           HD3      LYS  96   4.641 -11.798  -0.697
  785    HE2  LYS  96           HE2      LYS  96   5.450 -12.646   1.500
  786    HE3  LYS  96           HE3      LYS  96   5.038 -14.300   1.035
  787    HZ1  LYS  96           HZ1      LYS  96   6.721 -14.174  -0.718
  788    HZ2  LYS  96           HZ2      LYS  96   7.091 -12.628  -0.323
  789    HZ3  LYS  96           HZ3      LYS  96   7.402 -13.839   0.729
  790    H    GLN  97           H        GLN  97   0.529 -12.542   4.346
  791    HA   GLN  97           HA       GLN  97   1.210  -9.854   5.434
  792    HB2  GLN  97           HB2      GLN  97  -1.187 -10.500   5.294
  793    HB3  GLN  97           HB3      GLN  97  -0.888 -11.717   6.544
  794    HG2  GLN  97           HG2      GLN  97  -0.294  -9.983   8.163
  795    HG3  GLN  97           HG3      GLN  97  -0.099  -8.792   6.902
  796   HE21  GLN  97          HE22      GLN  97  -1.575  -7.403   8.224
  797   HE22  GLN  97          HE21      GLN  97  -3.307  -7.657   7.974
  798    H    LYS  98           H        LYS  98   2.860  -9.752   6.780
  799    HA   LYS  98           HA       LYS  98   3.896 -12.225   8.082
  800    HB2  LYS  98           HB2      LYS  98   5.368 -10.263   7.034
  801    HB3  LYS  98           HB3      LYS  98   4.841  -9.334   8.422
  802    HG2  LYS  98           HG2      LYS  98   6.668 -10.149   9.408
  803    HG3  LYS  98           HG3      LYS  98   5.753 -11.624   9.648
  804    HD2  LYS  98           HD2      LYS  98   7.885 -11.005   7.586
  805    HD3  LYS  98           HD3      LYS  98   7.957 -12.138   8.932
  806    HE2  LYS  98           HE2      LYS  98   5.878 -13.260   7.597
  807    HE3  LYS  98           HE3      LYS  98   6.587 -12.357   6.264
  808    HZ1  LYS  98           HZ1      LYS  98   8.023 -14.355   7.975
  809    HZ2  LYS  98           HZ2      LYS  98   7.498 -14.642   6.459
  810    HZ3  LYS  98           HZ3      LYS  98   8.708 -13.553   6.706
  811    H    TRP  99           H        TRP  99   3.802 -12.416  10.445
  812    HA   TRP  99           HA       TRP  99   2.311 -10.245  11.825
  813    HB2  TRP  99           HB2      TRP  99   1.850 -13.221  12.050
  814    HB3  TRP  99           HB3      TRP  99   1.245 -12.031  13.199
  815    HD1  TRP  99           HD1      TRP  99   0.822 -13.101   9.541
  816    HE1  TRP  99           HE1      TRP  99  -1.489 -12.333   8.716
  817    HE3  TRP  99           HE3      TRP  99  -0.550 -10.237  13.543
  818    HZ2  TRP  99           HZ2      TRP  99  -3.609 -10.610   9.633
  819    HZ3  TRP  99           HZ3      TRP  99  -2.653  -8.941  13.495
  820    HH2  TRP  99           HH2      TRP  99  -4.216  -9.144  11.563
  821    H    PHE 100           H        PHE 100   2.886  -9.938  14.009
  822    HA   PHE 100           HA       PHE 100   5.453 -11.178  14.903
  823    HB2  PHE 100           HB2      PHE 100   4.625  -8.239  14.852
  824    HB3  PHE 100           HB3      PHE 100   5.985  -8.862  15.778
  825    HD1  PHE 100           HD1      PHE 100   4.623  -8.452  12.317
  826    HD2  PHE 100           HD2      PHE 100   8.123  -9.134  14.769
  827    HE1  PHE 100           HE1      PHE 100   6.108  -8.109  10.359
  828    HE2  PHE 100           HE2      PHE 100   9.572  -8.883  12.788
  829    HZ   PHE 100           HZ       PHE 100   8.572  -8.416  10.575
  830    H    LEU 101           H        LEU 101   5.413 -11.741  17.062
  831    HA   LEU 101           HA       LEU 101   3.074 -10.870  18.714
  832    HB2  LEU 101           HB2      LEU 101   3.195 -13.236  18.861
  833    HB3  LEU 101           HB3      LEU 101   4.964 -13.223  18.926
  834    HG   LEU 101           HG       LEU 101   4.903 -12.277  21.187
  835   HD11  LEU 101          HD11      LEU 101   2.850 -10.933  21.135
  836   HD12  LEU 101          HD12      LEU 101   1.899 -12.413  20.946
  837   HD13  LEU 101          HD13      LEU 101   2.825 -12.083  22.457
  838   HD21  LEU 101          HD21      LEU 101   3.084 -14.716  21.034
  839   HD22  LEU 101          HD22      LEU 101   4.856 -14.771  20.880
  840   HD23  LEU 101          HD23      LEU 101   4.114 -14.223  22.388
  841    H    LEU 102           H        LEU 102   3.574  -9.153  19.962
  842    HA   LEU 102           HA       LEU 102   6.391  -8.892  20.864
  843    HB2  LEU 102           HB2      LEU 102   4.517  -6.535  20.812
  844    HB3  LEU 102           HB3      LEU 102   6.261  -6.534  20.845
  845    HG   LEU 102           HG       LEU 102   4.556  -7.271  18.436
  846   HD11  LEU 102          HD11      LEU 102   4.391  -4.865  19.186
  847   HD12  LEU 102          HD12      LEU 102   6.147  -4.725  18.871
  848   HD13  LEU 102          HD13      LEU 102   5.020  -5.110  17.555
  849   HD21  LEU 102          HD21      LEU 102   6.685  -6.975  17.170
  850   HD22  LEU 102          HD22      LEU 102   7.552  -6.803  18.714
  851   HD23  LEU 102          HD23      LEU 102   6.758  -8.338  18.300
  852    H    GLN 103           H        GLN 103   6.582  -8.451  23.211
  853    HA   GLN 103           HA       GLN 103   3.926  -8.647  24.595
  854    HB2  GLN 103           HB2      GLN 103   5.090 -10.279  25.404
  855    HB3  GLN 103           HB3      GLN 103   6.650  -9.435  25.478
  856    HG2  GLN 103           HG2      GLN 103   6.018  -8.329  27.511
  857    HG3  GLN 103           HG3      GLN 103   4.293  -8.459  27.165
  858   HE21  GLN 103          HE22      GLN 103   3.209 -10.580  27.338
  859   HE22  GLN 103          HE21      GLN 103   3.857 -11.765  28.467
  860    H    LEU 104           H        LEU 104   3.140  -6.867  25.633
  861    HA   LEU 104           HA       LEU 104   4.248  -4.271  25.157
  862    HB2  LEU 104           HB2      LEU 104   1.805  -5.488  26.128
  863    HB3  LEU 104           HB3      LEU 104   2.351  -4.386  27.383
  864    HG   LEU 104           HG       LEU 104   2.067  -3.650  24.450
  865   HD11  LEU 104          HD11      LEU 104   0.118  -3.127  26.715
  866   HD12  LEU 104          HD12      LEU 104  -0.007  -2.519  25.048
  867   HD13  LEU 104          HD13      LEU 104  -0.117  -4.257  25.356
  868   HD21  LEU 104          HD21      LEU 104   2.727  -2.080  26.960
  869   HD22  LEU 104          HD22      LEU 104   3.558  -2.140  25.403
  870   HD23  LEU 104          HD23      LEU 104   2.015  -1.295  25.534
  871    H    VAL 105           H        VAL 105   5.649  -3.081  26.467
  872    HA   VAL 105           HA       VAL 105   7.168  -4.721  28.305
  873    HB   VAL 105           HB       VAL 105   7.529  -1.911  27.250
  874   HG11  VAL 105          HG11      VAL 105   9.514  -3.558  28.871
  875   HG12  VAL 105          HG12      VAL 105   9.872  -2.034  28.016
  876   HG13  VAL 105          HG13      VAL 105   8.739  -2.036  29.374
  877   HG21  VAL 105          HG21      VAL 105   7.762  -3.955  25.653
  878   HG22  VAL 105          HG22      VAL 105   9.077  -2.782  25.689
  879   HG23  VAL 105          HG23      VAL 105   9.230  -4.340  26.553
  880    H    SER 106           H        SER 106   5.257  -1.685  28.612
  881    HA   SER 106           HA       SER 106   5.551  -1.727  31.537
  882    HB2  SER 106           HB2      SER 106   5.432   0.363  30.127
  883    HB3  SER 106           HB3      SER 106   3.723  -0.013  29.821
  884    HG   SER 106           HG       SER 106   4.124   1.457  31.624
  885    H    GLY 107           H        GLY 107   3.106  -2.531  29.074
  886    HA2  GLY 107           HA2      GLY 107   1.507  -4.412  29.642
  887    HA3  GLY 107           HA3      GLY 107   1.257  -3.564  31.174
  888    H    ASP 108           H        ASP 108  -0.995  -3.617  30.302
  889    HA   ASP 108           HA       ASP 108  -1.812  -2.358  28.008
  890    HB2  ASP 108           HB2      ASP 108  -3.943  -2.840  28.704
  891    HB3  ASP 108           HB3      ASP 108  -2.992  -3.976  29.649
  892    H    ALA 109           H        ALA 109  -0.867  -0.883  30.919
  893    HA   ALA 109           HA       ALA 109  -2.204   1.580  30.925
  894    HB1  ALA 109           HB1      ALA 109  -0.195   2.433  32.099
  895    HB2  ALA 109           HB2      ALA 109  -0.649   0.825  32.702
  896    HB3  ALA 109           HB3      ALA 109   0.724   1.009  31.580
  897    H    GLU 110           H        GLU 110   0.359   0.505  28.726
  898    HA   GLU 110           HA       GLU 110   0.757   3.234  27.796
  899    HB2  GLU 110           HB2      GLU 110   2.379   0.707  27.589
  900    HB3  GLU 110           HB3      GLU 110   2.726   2.040  26.490
  901    HG2  GLU 110           HG2      GLU 110   2.626   2.357  29.505
  902    HG3  GLU 110           HG3      GLU 110   4.099   2.041  28.584
  903    H    ILE 111           H        ILE 111  -1.667   1.974  27.142
  904    HA   ILE 111           HA       ILE 111  -1.530   1.667  24.177
  905    HB   ILE 111           HB       ILE 111  -3.729   0.864  26.130
  906   HG12  ILE 111          HG12      ILE 111  -1.913  -0.906  24.418
  907   HG13  ILE 111          HG13      ILE 111  -1.637  -0.607  26.127
  908   HG21  ILE 111          HG21      ILE 111  -4.693  -0.216  24.030
  909   HG22  ILE 111          HG22      ILE 111  -4.722   1.536  24.024
  910   HG23  ILE 111          HG23      ILE 111  -3.453   0.676  23.113
  911   HD11  ILE 111          HD11      ILE 111  -3.837  -1.644  26.684
  912   HD12  ILE 111          HD12      ILE 111  -4.076  -2.044  24.982
  913   HD13  ILE 111          HD13      ILE 111  -2.737  -2.762  25.863
  914    H    ASN 112           H        ASN 112  -2.589   3.156  22.828
  915    HA   ASN 112           HA       ASN 112  -4.395   5.173  24.043
  916    HB2  ASN 112           HB2      ASN 112  -2.267   6.358  23.936
  917    HB3  ASN 112           HB3      ASN 112  -1.991   5.794  22.287
  918   HD21  ASN 112          HD22      ASN 112  -1.794   8.135  21.658
  919   HD22  ASN 112          HD21      ASN 112  -3.300   8.981  21.324
  920    H    MET 113           H        MET 113  -6.285   4.966  22.918
  921    HA   MET 113           HA       MET 113  -6.260   3.685  20.260
  922    HB2  MET 113           HB2      MET 113  -8.484   4.402  22.192
  923    HB3  MET 113           HB3      MET 113  -8.742   3.604  20.634
  924    HG2  MET 113           HG2      MET 113  -6.772   2.423  22.620
  925    HG3  MET 113           HG3      MET 113  -8.508   2.164  22.823
  926    HE1  MET 113           HE1      MET 113  -5.355   0.698  21.454
  927    HE2  MET 113           HE2      MET 113  -6.410  -0.242  22.541
  928    HE3  MET 113           HE3      MET 113  -6.095  -0.812  20.891
  929    H    GLN 114           H        GLN 114  -5.883   6.850  21.194
  930    HA   GLN 114           HA       GLN 114  -7.294   7.968  18.871
  931    HB2  GLN 114           HB2      GLN 114  -7.115   9.169  21.637
  932    HB3  GLN 114           HB3      GLN 114  -7.414  10.093  20.152
  933    HG2  GLN 114           HG2      GLN 114  -9.418   8.751  19.674
  934    HG3  GLN 114           HG3      GLN 114  -9.187   7.830  21.171
  935   HE21  GLN 114          HE22      GLN 114  -9.888  11.144  19.853
  936   HE22  GLN 114          HE21      GLN 114 -10.644  11.722  21.321
  937    H    THR 115           H        THR 115  -5.478   7.334  17.960
  938    HA   THR 115           HA       THR 115  -2.822   8.349  18.369
  939    HB   THR 115           HB       THR 115  -2.802   7.396  15.919
  940    HG1  THR 115           HG1      THR 115  -4.552   6.016  15.483
  941   HG21  THR 115          HG21      THR 115  -2.921   5.029  16.922
  942   HG22  THR 115          HG22      THR 115  -1.929   6.161  17.859
  943   HG23  THR 115          HG23      THR 115  -3.564   5.744  18.423
  944    H    SER 116           H        SER 116  -5.205   8.775  15.823
  945    HA   SER 116           HA       SER 116  -4.567  11.600  15.318
  946    HB2  SER 116           HB2      SER 116  -6.823   9.827  14.283
  947    HB3  SER 116           HB3      SER 116  -6.393  11.434  13.672
  948    HG   SER 116           HG       SER 116  -5.461   9.757  12.396
  949    H    SER 117           H        SER 117  -6.583  13.205  15.420
  950    HA   SER 117           HA       SER 117  -7.638  13.346  18.041
  951    HB2  SER 117           HB2      SER 117  -8.899  14.482  15.513
  952    HB3  SER 117           HB3      SER 117  -9.058  15.090  17.170
  953    HG   SER 117           HG       SER 117  -7.520  16.301  15.957
  954    H    THR 118           H        THR 118  -8.924  11.924  15.030
  955    HA   THR 118           HA       THR 118 -11.316  10.816  16.133
  956    HB   THR 118           HB       THR 118 -10.568   9.376  13.927
  957    HG1  THR 118           HG1      THR 118 -10.013  10.931  12.372
  958   HG21  THR 118          HG21      THR 118 -12.409  10.548  12.825
  959   HG22  THR 118          HG22      THR 118 -12.787  10.012  14.467
  960   HG23  THR 118          HG23      THR 118 -12.428  11.738  14.162
  961    HA   PRO 119           HA       PRO 119  -9.124   7.238  17.831
  962    HB2  PRO 119           HB2      PRO 119 -11.734   5.838  17.632
  963    HB3  PRO 119           HB3      PRO 119 -10.715   6.122  19.074
  964    HG2  PRO 119           HG2      PRO 119 -13.105   7.446  18.600
  965    HG3  PRO 119           HG3      PRO 119 -11.749   8.158  19.522
  966    HD2  PRO 119           HD2      PRO 119 -12.557   8.690  16.668
  967    HD3  PRO 119           HD3      PRO 119 -11.843   9.804  17.877
  968    H    GLU 120           H        GLU 120  -8.078   5.702  16.538
  969    HA   GLU 120           HA       GLU 120  -9.235   5.049  13.889
  970    HB2  GLU 120           HB2      GLU 120  -6.563   4.535  15.215
  971    HB3  GLU 120           HB3      GLU 120  -7.080   3.494  13.896
  972    HG2  GLU 120           HG2      GLU 120  -6.843   6.522  13.737
  973    HG3  GLU 120           HG3      GLU 120  -5.687   5.358  13.086
  974    H    PHE 121           H        PHE 121  -8.785   3.608  17.077
  975    HA   PHE 121           HA       PHE 121 -10.487   1.324  16.217
  976    HB2  PHE 121           HB2      PHE 121  -8.412   1.557  18.386
  977    HB3  PHE 121           HB3      PHE 121  -9.626   0.284  18.368
  978    HD1  PHE 121           HD1      PHE 121  -8.830   0.504  14.949
  979    HD2  PHE 121           HD2      PHE 121  -7.054  -0.616  18.710
  980    HE1  PHE 121           HE1      PHE 121  -7.341  -1.101  13.783
  981    HE2  PHE 121           HE2      PHE 121  -5.570  -2.203  17.538
  982    HZ   PHE 121           HZ       PHE 121  -5.748  -2.466  15.066
  983    H    ASP 122           H        ASP 122 -12.398   1.118  17.274
  984    HA   ASP 122           HA       ASP 122 -13.398   3.378  18.885
  985    HB2  ASP 122           HB2      ASP 122 -14.992   2.486  17.343
  986    HB3  ASP 122           HB3      ASP 122 -14.582   0.819  17.746
  987    H    GLY 123           H        GLY 123 -12.268   0.007  19.274
  988    HA2  GLY 123           HA2      GLY 123 -12.377   0.228  22.212
  989    HA3  GLY 123           HA3      GLY 123 -13.466  -0.939  21.417
  990    H    TRP 124           H        TRP 124 -11.383  -1.629  23.266
  991    HA   TRP 124           HA       TRP 124 -10.330  -3.727  21.644
  992    HB2  TRP 124           HB2      TRP 124  -8.126  -3.354  21.631
  993    HB3  TRP 124           HB3      TRP 124  -8.536  -1.673  21.885
  994    HD1  TRP 124           HD1      TRP 124  -6.981  -4.690  23.523
  995    HE1  TRP 124           HE1      TRP 124  -6.022  -4.139  25.807
  996    HE3  TRP 124           HE3      TRP 124  -8.771   0.077  23.975
  997    HZ2  TRP 124           HZ2      TRP 124  -6.066  -1.882  27.673
  998    HZ3  TRP 124           HZ3      TRP 124  -8.282   1.418  26.015
  999    HH2  TRP 124           HH2      TRP 124  -6.937   0.442  27.859
 1000    H    ARG 125           H        ARG 125  -9.478  -5.492  22.970
 1001    HA   ARG 125           HA       ARG 125  -9.984  -5.394  25.837
 1002    HB2  ARG 125           HB2      ARG 125 -11.535  -7.266  25.900
 1003    HB3  ARG 125           HB3      ARG 125 -12.220  -5.961  24.942
 1004    HG2  ARG 125           HG2      ARG 125 -11.424  -7.205  22.852
 1005    HG3  ARG 125           HG3      ARG 125 -11.014  -8.562  23.891
 1006    HD2  ARG 125           HD2      ARG 125 -13.771  -7.302  23.566
 1007    HD3  ARG 125           HD3      ARG 125 -13.233  -8.819  22.826
 1008    HE   ARG 125           HE       ARG 125 -12.881  -9.074  25.620
 1009   HH11  ARG 125          HH11      ARG 125 -15.600  -8.675  23.361
 1010   HH12  ARG 125          HH12      ARG 125 -16.723  -9.537  24.349
 1011   HH21  ARG 125          HH21      ARG 125 -14.378 -10.240  26.927
 1012   HH22  ARG 125          HH22      ARG 125 -16.009 -10.444  26.409
 1013    H    TRP 126           H        TRP 126  -9.255  -7.538  26.822
 1014    HA   TRP 126           HA       TRP 126  -7.073  -8.782  25.205
 1015    HB2  TRP 126           HB2      TRP 126  -7.325  -8.365  28.202
 1016    HB3  TRP 126           HB3      TRP 126  -6.108  -9.362  27.438
 1017    HD1  TRP 126           HD1      TRP 126  -7.025  -5.649  27.907
 1018    HE1  TRP 126           HE1      TRP 126  -4.894  -4.310  27.865
 1019    HE3  TRP 126           HE3      TRP 126  -3.832  -9.262  26.132
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.123  -4.702  27.183
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.437  -8.723  25.813
 1022    HH2  TRP 126           HH2      TRP 126  -0.565  -6.459  26.422
 1023    H    VAL 127           H        VAL 127  -7.434 -10.969  24.765
 1024    HA   VAL 127           HA       VAL 127  -9.568 -12.458  26.242
 1025    HB   VAL 127           HB       VAL 127 -10.195 -13.236  23.798
 1026   HG11  VAL 127          HG11      VAL 127 -11.073 -10.587  25.004
 1027   HG12  VAL 127          HG12      VAL 127 -11.937 -11.427  23.698
 1028   HG13  VAL 127          HG13      VAL 127 -11.788 -12.188  25.286
 1029   HG21  VAL 127          HG21      VAL 127 -10.085 -11.554  22.066
 1030   HG22  VAL 127          HG22      VAL 127  -9.206 -10.438  23.128
 1031   HG23  VAL 127          HG23      VAL 127  -8.444 -11.957  22.605
 1032    H    SER 128           H        SER 128  -9.425 -14.810  26.015
 1033    HA   SER 128           HA       SER 128  -6.833 -15.919  25.806
 1034    HB2  SER 128           HB2      SER 128  -9.538 -17.238  25.333
 1035    HB3  SER 128           HB3      SER 128  -8.032 -18.053  25.823
 1036    HG   SER 128           HG       SER 128  -9.404 -17.629  27.630
 1037    H    TYR 129           H        TYR 129  -5.746 -16.964  24.066
 1038    HA   TYR 129           HA       TYR 129  -5.905 -15.666  21.655
 1039    HB2  TYR 129           HB2      TYR 129  -4.574 -17.937  20.901
 1040    HB3  TYR 129           HB3      TYR 129  -3.878 -16.547  21.680
 1041    HD1  TYR 129           HD2      TYR 129  -5.529 -19.811  22.583
 1042    HD2  TYR 129           HD1      TYR 129  -2.540 -16.861  23.588
 1043    HE1  TYR 129           HE2      TYR 129  -4.768 -21.234  24.448
 1044    HE2  TYR 129           HE1      TYR 129  -1.758 -18.299  25.446
 1045    HH   TYR 129           HH       TYR 129  -3.270 -21.458  26.245
 1046    H    TRP 130           H        TRP 130  -7.689 -18.722  22.326
 1047    HA   TRP 130           HA       TRP 130  -8.251 -18.992  19.467
 1048    HB2  TRP 130           HB2      TRP 130  -9.456 -20.525  21.779
 1049    HB3  TRP 130           HB3      TRP 130  -9.489 -20.962  20.072
 1050    HD1  TRP 130           HD1      TRP 130  -7.897 -22.116  22.968
 1051    HE1  TRP 130           HE1      TRP 130  -5.557 -23.089  22.619
 1052    HE3  TRP 130           HE3      TRP 130  -6.933 -20.315  18.248
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.460 -22.925  20.684
 1054    HZ3  TRP 130           HZ3      TRP 130  -4.750 -20.775  17.176
 1055    HH2  TRP 130           HH2      TRP 130  -2.974 -22.008  18.409
 1056    H    TYR 131           H        TYR 131  -9.789 -17.252  22.065
 1057    HA   TYR 131           HA       TYR 131 -12.478 -17.389  21.168
 1058    HB2  TYR 131           HB2      TYR 131 -11.972 -16.669  23.358
 1059    HB3  TYR 131           HB3      TYR 131 -11.025 -15.298  22.783
 1060    HD1  TYR 131           HD1      TYR 131 -14.467 -16.678  23.122
 1061    HD2  TYR 131           HD2      TYR 131 -12.098 -13.244  21.998
 1062    HE1  TYR 131           HE1      TYR 131 -16.509 -15.280  23.083
 1063    HE2  TYR 131           HE2      TYR 131 -14.132 -11.840  21.972
 1064    HH   TYR 131           HH       TYR 131 -16.462 -11.780  22.256
 1065    HA   PRO 132           HA       PRO 132 -11.842 -13.260  18.780
 1066    HB2  PRO 132           HB2      PRO 132  -9.376 -12.771  17.614
 1067    HB3  PRO 132           HB3      PRO 132  -9.914 -12.145  19.212
 1068    HG2  PRO 132           HG2      PRO 132  -8.236 -14.591  18.656
 1069    HG3  PRO 132           HG3      PRO 132  -7.913 -13.258  19.818
 1070    HD2  PRO 132           HD2      PRO 132  -9.039 -15.518  20.644
 1071    HD3  PRO 132           HD3      PRO 132  -9.690 -13.969  21.244
 1072    H    VAL 133           H        VAL 133 -10.201 -16.239  17.858
 1073    HA   VAL 133           HA       VAL 133 -10.457 -15.981  15.010
 1074    HB   VAL 133           HB       VAL 133 -10.382 -18.565  16.617
 1075   HG11  VAL 133          HG11      VAL 133  -9.248 -19.494  14.690
 1076   HG12  VAL 133          HG12      VAL 133 -10.753 -18.771  14.140
 1077   HG13  VAL 133          HG13      VAL 133  -9.219 -17.915  13.868
 1078   HG21  VAL 133          HG21      VAL 133  -7.886 -18.489  16.428
 1079   HG22  VAL 133          HG22      VAL 133  -7.998 -16.822  15.816
 1080   HG23  VAL 133          HG23      VAL 133  -8.500 -17.217  17.475
 1081    H    ARG 134           H        ARG 134 -12.685 -16.959  17.645
 1082    HA   ARG 134           HA       ARG 134 -14.463 -18.461  15.974
 1083    HB2  ARG 134           HB2      ARG 134 -15.207 -16.970  18.518
 1084    HB3  ARG 134           HB3      ARG 134 -16.020 -18.356  17.811
 1085    HG2  ARG 134           HG2      ARG 134 -13.452 -18.260  19.388
 1086    HG3  ARG 134           HG3      ARG 134 -14.931 -19.152  19.711
 1087    HD2  ARG 134           HD2      ARG 134 -14.376 -20.570  17.669
 1088    HD3  ARG 134           HD3      ARG 134 -12.796 -19.729  17.647
 1089    HE   ARG 134           HE       ARG 134 -13.319 -20.747  20.256
 1090   HH11  ARG 134          HH11      ARG 134 -12.462 -21.977  17.030
 1091   HH12  ARG 134          HH12      ARG 134 -11.615 -23.356  17.630
 1092   HH21  ARG 134          HH21      ARG 134 -12.230 -22.618  21.051
 1093   HH22  ARG 134          HH22      ARG 134 -11.495 -23.730  19.961
 1094    H    GLN 135           H        GLN 135 -14.089 -14.965  16.421
 1095    HA   GLN 135           HA       GLN 135 -16.834 -14.414  15.579
 1096    HB2  GLN 135           HB2      GLN 135 -14.429 -12.719  16.306
 1097    HB3  GLN 135           HB3      GLN 135 -15.831 -11.994  15.530
 1098    HG2  GLN 135           HG2      GLN 135 -16.040 -11.743  17.915
 1099    HG3  GLN 135           HG3      GLN 135 -17.327 -12.773  17.286
 1100   HE21  GLN 135          HE22      GLN 135 -14.106 -12.897  18.905
 1101   HE22  GLN 135          HE21      GLN 135 -14.349 -14.467  19.643
 1102    H    VAL 136           H        VAL 136 -13.764 -14.691  13.844
 1103    HA   VAL 136           HA       VAL 136 -14.715 -12.977  11.681
 1104    HB   VAL 136           HB       VAL 136 -12.414 -13.629  10.738
 1105   HG11  VAL 136          HG11      VAL 136 -12.975 -11.455  11.781
 1106   HG12  VAL 136          HG12      VAL 136 -12.599 -12.125  13.375
 1107   HG13  VAL 136          HG13      VAL 136 -11.322 -11.959  12.144
 1108   HG21  VAL 136          HG21      VAL 136 -11.787 -14.437  13.593
 1109   HG22  VAL 136          HG22      VAL 136 -12.026 -15.610  12.280
 1110   HG23  VAL 136          HG23      VAL 136 -10.720 -14.425  12.174
 1111    H    VAL 137           H        VAL 137 -14.355 -13.693   9.349
 1112    HA   VAL 137           HA       VAL 137 -16.136 -15.961   8.857
 1113    HB   VAL 137           HB       VAL 137 -16.370 -15.118   6.675
 1114   HG11  VAL 137          HG11      VAL 137 -15.867 -12.564   8.252
 1115   HG12  VAL 137          HG12      VAL 137 -16.947 -12.815   6.871
 1116   HG13  VAL 137          HG13      VAL 137 -17.307 -13.593   8.419
 1117   HG21  VAL 137          HG21      VAL 137 -14.749 -13.285   5.788
 1118   HG22  VAL 137          HG22      VAL 137 -13.630 -13.879   7.059
 1119   HG23  VAL 137          HG23      VAL 137 -14.232 -14.974   5.802
 1120    H    SER 138           H        SER 138 -15.474 -17.316   6.738
 1121    HA   SER 138           HA       SER 138 -13.759 -19.221   7.614
 1122    HB2  SER 138           HB2      SER 138 -14.380 -18.598   4.708
 1123    HB3  SER 138           HB3      SER 138 -14.027 -20.194   5.413
 1124    HG   SER 138           HG       SER 138 -16.296 -19.858   5.170
 1125    H    PHE 139           H        PHE 139 -12.762 -16.797   5.041
 1126    HA   PHE 139           HA       PHE 139 -10.157 -18.017   4.926
 1127    HB2  PHE 139           HB2      PHE 139  -9.575 -16.432   3.320
 1128    HB3  PHE 139           HB3      PHE 139 -11.243 -16.850   3.025
 1129    HD1  PHE 139           HD2      PHE 139  -8.891 -14.201   4.047
 1130    HD2  PHE 139           HD1      PHE 139 -13.046 -15.133   3.327
 1131    HE1  PHE 139           HE2      PHE 139  -9.426 -11.779   3.964
 1132    HE2  PHE 139           HE1      PHE 139 -13.578 -12.716   3.301
 1133    HZ   PHE 139           HZ       PHE 139 -11.768 -11.033   3.604
 1134    H    LYS 140           H        LYS 140 -11.440 -15.206   6.698
 1135    HA   LYS 140           HA       LYS 140  -8.808 -14.371   7.654
 1136    HB2  LYS 140           HB2      LYS 140 -11.594 -13.693   8.644
 1137    HB3  LYS 140           HB3      LYS 140 -10.093 -12.949   9.244
 1138    HG2  LYS 140           HG2      LYS 140  -9.573 -12.266   6.853
 1139    HG3  LYS 140           HG3      LYS 140 -11.185 -12.829   6.397
 1140    HD2  LYS 140           HD2      LYS 140 -10.538 -10.595   8.367
 1141    HD3  LYS 140           HD3      LYS 140 -11.139 -10.408   6.712
 1142    HE2  LYS 140           HE2      LYS 140 -13.215 -11.664   7.340
 1143    HE3  LYS 140           HE3      LYS 140 -12.632 -11.768   9.008
 1144    HZ1  LYS 140           HZ1      LYS 140 -12.681  -9.288   9.080
 1145    HZ2  LYS 140           HZ2      LYS 140 -13.213  -9.223   7.536
 1146    HZ3  LYS 140           HZ3      LYS 140 -14.167  -9.862   8.694
 1147    H    ARG 141           H        ARG 141 -11.419 -16.410   9.007
 1148    HA   ARG 141           HA       ARG 141 -10.246 -17.077  11.506
 1149    HB2  ARG 141           HB2      ARG 141 -11.636 -18.930   9.518
 1150    HB3  ARG 141           HB3      ARG 141 -11.163 -19.440  11.139
 1151    HG2  ARG 141           HG2      ARG 141 -12.694 -18.011  12.206
 1152    HG3  ARG 141           HG3      ARG 141 -12.938 -17.048  10.767
 1153    HD2  ARG 141           HD2      ARG 141 -14.816 -18.264  10.434
 1154    HD3  ARG 141           HD3      ARG 141 -13.755 -19.526   9.860
 1155    HE   ARG 141           HE       ARG 141 -14.085 -20.753  11.780
 1156   HH11  ARG 141          HH11      ARG 141 -15.521 -17.523  12.229
 1157   HH12  ARG 141          HH12      ARG 141 -16.356 -17.942  13.686
 1158   HH21  ARG 141          HH21      ARG 141 -15.308 -21.348  13.646
 1159   HH22  ARG 141          HH22      ARG 141 -16.346 -20.209  14.417
 1160    H    ASP 142           H        ASP 142  -9.406 -18.505   8.275
 1161    HA   ASP 142           HA       ASP 142  -7.529 -20.320   9.390
 1162    HB2  ASP 142           HB2      ASP 142  -8.368 -20.590   7.104
 1163    HB3  ASP 142           HB3      ASP 142  -7.481 -19.136   6.600
 1164    H    VAL 143           H        VAL 143  -7.042 -16.992   8.108
 1165    HA   VAL 143           HA       VAL 143  -4.224 -16.974   8.658
 1166    HB   VAL 143           HB       VAL 143  -6.262 -14.688   8.515
 1167   HG11  VAL 143          HG11      VAL 143  -4.302 -13.205   8.082
 1168   HG12  VAL 143          HG12      VAL 143  -4.256 -13.870   9.714
 1169   HG13  VAL 143          HG13      VAL 143  -3.214 -14.566   8.453
 1170   HG21  VAL 143          HG21      VAL 143  -5.426 -14.352   6.249
 1171   HG22  VAL 143          HG22      VAL 143  -4.286 -15.709   6.425
 1172   HG23  VAL 143          HG23      VAL 143  -6.041 -15.993   6.400
 1173    H    TYR 144           H        TYR 144  -7.036 -15.820  10.634
 1174    HA   TYR 144           HA       TYR 144  -5.392 -14.877  12.725
 1175    HB2  TYR 144           HB2      TYR 144  -8.343 -15.491  12.489
 1176    HB3  TYR 144           HB3      TYR 144  -7.645 -14.975  14.008
 1177    HD1  TYR 144           HD1      TYR 144  -6.040 -13.426  11.056
 1178    HD2  TYR 144           HD2      TYR 144  -9.281 -13.081  13.890
 1179    HE1  TYR 144           HE1      TYR 144  -6.194 -11.044  10.563
 1180    HE2  TYR 144           HE2      TYR 144  -9.471 -10.660  13.323
 1181    HH   TYR 144           HH       TYR 144  -7.309  -9.024  11.004
 1182    H    ARG 145           H        ARG 145  -6.769 -18.182  12.285
 1183    HA   ARG 145           HA       ARG 145  -5.841 -18.989  14.904
 1184    HB2  ARG 145           HB2      ARG 145  -6.462 -21.140  14.379
 1185    HB3  ARG 145           HB3      ARG 145  -7.532 -20.176  13.372
 1186    HG2  ARG 145           HG2      ARG 145  -5.637 -20.576  11.552
 1187    HG3  ARG 145           HG3      ARG 145  -5.227 -21.958  12.579
 1188    HD2  ARG 145           HD2      ARG 145  -7.615 -22.710  12.328
 1189    HD3  ARG 145           HD3      ARG 145  -7.903 -21.277  11.331
 1190    HE   ARG 145           HE       ARG 145  -6.565 -22.132   9.572
 1191   HH11  ARG 145          HH11      ARG 145  -6.828 -24.605  12.152
 1192   HH12  ARG 145          HH12      ARG 145  -6.379 -25.885  11.086
 1193   HH21  ARG 145          HH21      ARG 145  -6.027 -23.694   8.272
 1194   HH22  ARG 145          HH22      ARG 145  -5.887 -25.372   8.769
 1195    H    ARG 146           H        ARG 146  -4.250 -19.041  11.643
 1196    HA   ARG 146           HA       ARG 146  -1.800 -20.161  12.580
 1197    HB2  ARG 146           HB2      ARG 146  -2.634 -18.483  10.162
 1198    HB3  ARG 146           HB3      ARG 146  -0.931 -18.597  10.573
 1199    HG2  ARG 146           HG2      ARG 146  -1.141 -20.325   9.094
 1200    HG3  ARG 146           HG3      ARG 146  -1.218 -21.130  10.659
 1201    HD2  ARG 146           HD2      ARG 146  -3.748 -21.170  10.391
 1202    HD3  ARG 146           HD3      ARG 146  -3.513 -20.554   8.749
 1203    HE   ARG 146           HE       ARG 146  -2.489 -23.149   9.859
 1204   HH11  ARG 146          HH11      ARG 146  -3.872 -21.499   6.998
 1205   HH12  ARG 146          HH12      ARG 146  -3.204 -22.634   5.887
 1206   HH21  ARG 146          HH21      ARG 146  -1.830 -24.753   8.375
 1207   HH22  ARG 146          HH22      ARG 146  -2.180 -24.593   6.695
 1208    H    VAL 147           H        VAL 147  -2.844 -16.701  12.463
 1209    HA   VAL 147           HA       VAL 147  -0.476 -15.572  13.415
 1210    HB   VAL 147           HB       VAL 147  -3.384 -14.739  13.835
 1211   HG11  VAL 147          HG11      VAL 147  -2.079 -13.473  15.451
 1212   HG12  VAL 147          HG12      VAL 147  -0.879 -13.052  14.207
 1213   HG13  VAL 147          HG13      VAL 147  -2.544 -12.418  14.129
 1214   HG21  VAL 147          HG21      VAL 147  -1.254 -13.877  11.855
 1215   HG22  VAL 147          HG22      VAL 147  -2.676 -14.816  11.455
 1216   HG23  VAL 147          HG23      VAL 147  -2.888 -13.157  11.979
 1217    H    MET 148           H        MET 148  -2.749 -17.541  15.177
 1218    HA   MET 148           HA       MET 148  -1.700 -16.659  17.818
 1219    HB2  MET 148           HB2      MET 148  -3.890 -18.653  17.168
 1220    HB3  MET 148           HB3      MET 148  -3.376 -18.158  18.788
 1221    HG2  MET 148           HG2      MET 148  -4.537 -16.268  16.720
 1222    HG3  MET 148           HG3      MET 148  -5.476 -17.110  17.933
 1223    HE1  MET 148           HE1      MET 148  -3.742 -14.134  16.884
 1224    HE2  MET 148           HE2      MET 148  -3.361 -13.184  18.324
 1225    HE3  MET 148           HE3      MET 148  -2.251 -14.473  17.798
 1226    H    LYS 149           H        LYS 149  -2.164 -19.706  15.935
 1227    HA   LYS 149           HA       LYS 149  -0.606 -21.328  17.630
 1228    HB2  LYS 149           HB2      LYS 149  -2.308 -22.077  16.179
 1229    HB3  LYS 149           HB3      LYS 149  -1.390 -21.644  14.727
 1230    HG2  LYS 149           HG2      LYS 149  -0.347 -23.616  16.780
 1231    HG3  LYS 149           HG3      LYS 149  -1.486 -24.126  15.538
 1232    HD2  LYS 149           HD2      LYS 149   0.067 -24.111  13.869
 1233    HD3  LYS 149           HD3      LYS 149   0.716 -22.560  14.379
 1234    HE2  LYS 149           HE2      LYS 149   2.502 -24.036  14.661
 1235    HE3  LYS 149           HE3      LYS 149   1.872 -23.695  16.285
 1236    HZ1  LYS 149           HZ1      LYS 149   0.745 -25.876  16.219
 1237    HZ2  LYS 149           HZ2      LYS 149   1.313 -26.168  14.707
 1238    HZ3  LYS 149           HZ3      LYS 149   2.341 -26.071  15.967
 1239    H    GLU 150           H        GLU 150   0.587 -19.313  14.871
 1240    HA   GLU 150           HA       GLU 150   3.115 -20.387  14.714
 1241    HB2  GLU 150           HB2      GLU 150   2.008 -18.670  13.213
 1242    HB3  GLU 150           HB3      GLU 150   2.277 -17.478  14.469
 1243    HG2  GLU 150           HG2      GLU 150   4.161 -17.151  13.220
 1244    HG3  GLU 150           HG3      GLU 150   4.791 -18.340  14.326
 1245    H    PHE 151           H        PHE 151   1.800 -18.032  17.044
 1246    HA   PHE 151           HA       PHE 151   4.441 -17.846  18.433
 1247    HB2  PHE 151           HB2      PHE 151   2.094 -16.032  18.897
 1248    HB3  PHE 151           HB3      PHE 151   3.812 -15.788  19.204
 1249    HD1  PHE 151           HD2      PHE 151   5.179 -16.365  16.680
 1250    HD2  PHE 151           HD1      PHE 151   1.419 -14.347  17.401
 1251    HE1  PHE 151           HE2      PHE 151   5.258 -15.381  14.467
 1252    HE2  PHE 151           HE1      PHE 151   1.602 -13.239  15.213
 1253    HZ   PHE 151           HZ       PHE 151   3.523 -13.774  13.718
 1254    H    ALA 152           H        ALA 152   1.437 -19.422  18.805
 1255    HA   ALA 152           HA       ALA 152   0.724 -19.054  21.432
 1256    HB1  ALA 152           HB1      ALA 152   0.576 -21.620  19.757
 1257    HB2  ALA 152           HB2      ALA 152  -0.391 -21.279  21.204
 1258    HB3  ALA 152           HB3      ALA 152  -0.619 -20.308  19.746
 1259    H    SER 153           H        SER 153   3.159 -21.268  20.139
 1260    HA   SER 153           HA       SER 153   3.666 -22.691  22.545
 1261    HB2  SER 153           HB2      SER 153   5.575 -22.216  20.226
 1262    HB3  SER 153           HB3      SER 153   5.553 -23.594  21.350
 1263    HG   SER 153           HG       SER 153   4.558 -24.116  19.343
 1264    H    VAL 154           H        VAL 154   4.863 -19.590  21.274
 1265    HA   VAL 154           HA       VAL 154   6.970 -19.332  23.291
 1266    HB   VAL 154           HB       VAL 154   5.660 -17.221  21.529
 1267   HG11  VAL 154          HG11      VAL 154   6.705 -16.237  23.578
 1268   HG12  VAL 154          HG12      VAL 154   8.220 -17.083  23.186
 1269   HG13  VAL 154          HG13      VAL 154   7.601 -15.825  22.098
 1270   HG21  VAL 154          HG21      VAL 154   6.834 -18.851  20.132
 1271   HG22  VAL 154          HG22      VAL 154   7.845 -17.407  20.241
 1272   HG23  VAL 154          HG23      VAL 154   8.240 -18.833  21.215
 1273    H    VAL 155           H        VAL 155   3.570 -18.249  22.840
 1274    HA   VAL 155           HA       VAL 155   3.490 -16.655  25.151
 1275    HB   VAL 155           HB       VAL 155   1.190 -18.278  24.010
 1276   HG11  VAL 155          HG11      VAL 155   0.592 -17.533  26.218
 1277   HG12  VAL 155          HG12      VAL 155   1.347 -15.948  25.978
 1278   HG13  VAL 155          HG13      VAL 155  -0.157 -16.387  25.093
 1279   HG21  VAL 155          HG21      VAL 155   2.043 -15.380  23.500
 1280   HG22  VAL 155          HG22      VAL 155   2.175 -16.709  22.328
 1281   HG23  VAL 155          HG23      VAL 155   0.580 -16.186  22.849
 1282    H    MET 156           H        MET 156   2.850 -20.267  24.959
 1283    HA   MET 156           HA       MET 156   2.179 -20.472  27.625
 1284    HB2  MET 156           HB2      MET 156   3.629 -22.400  25.762
 1285    HB3  MET 156           HB3      MET 156   3.166 -22.862  27.405
 1286    HG2  MET 156           HG2      MET 156   1.029 -23.217  26.819
 1287    HG3  MET 156           HG3      MET 156   0.893 -21.577  26.213
 1288    HE1  MET 156           HE1      MET 156  -1.063 -22.560  24.784
 1289    HE2  MET 156           HE2      MET 156  -0.156 -21.186  24.101
 1290    HE3  MET 156           HE3      MET 156  -0.632 -22.557  23.063
 1291    H    SER 157           H        SER 157   5.409 -20.581  26.147
 1292    HA   SER 157           HA       SER 157   6.884 -20.942  28.551
 1293    HB2  SER 157           HB2      SER 157   7.463 -21.432  26.130
 1294    HB3  SER 157           HB3      SER 157   7.781 -19.703  25.922
 1295    HG   SER 157           HG       SER 157   9.690 -20.971  26.444
 1296    H    LEU 158           H        LEU 158   5.552 -18.112  26.930
 1297    HA   LEU 158           HA       LEU 158   6.992 -16.114  28.352
 1298    HB2  LEU 158           HB2      LEU 158   5.696 -15.955  26.120
 1299    HB3  LEU 158           HB3      LEU 158   4.211 -15.931  27.098
 1300    HG   LEU 158           HG       LEU 158   5.038 -13.854  28.217
 1301   HD11  LEU 158          HD11      LEU 158   7.459 -14.076  27.788
 1302   HD12  LEU 158          HD12      LEU 158   7.186 -13.994  26.037
 1303   HD13  LEU 158          HD13      LEU 158   6.854 -12.589  27.080
 1304   HD21  LEU 158          HD21      LEU 158   4.550 -14.034  25.211
 1305   HD22  LEU 158          HD22      LEU 158   3.364 -13.775  26.515
 1306   HD23  LEU 158          HD23      LEU 158   4.523 -12.497  26.079
 1307    H    GLN 159           H        GLN 159   4.021 -17.954  29.066
 1308    HA   GLN 159           HA       GLN 159   3.485 -16.492  31.539
 1309    HB2  GLN 159           HB2      GLN 159   2.531 -19.280  30.832
 1310    HB3  GLN 159           HB3      GLN 159   1.871 -18.148  32.014
 1311    HG2  GLN 159           HG2      GLN 159   1.407 -16.579  29.957
 1312    HG3  GLN 159           HG3      GLN 159   1.708 -18.010  28.992
 1313   HE21  GLN 159          HE22      GLN 159  -0.213 -17.158  31.937
 1314   HE22  GLN 159          HE21      GLN 159  -1.595 -18.167  31.510
 1315    H    GLU 160           H        GLU 160   5.557 -19.248  30.684
 1316    HA   GLU 160           HA       GLU 160   6.172 -19.985  33.374
 1317    HB2  GLU 160           HB2      GLU 160   7.872 -20.356  30.874
 1318    HB3  GLU 160           HB3      GLU 160   8.122 -21.131  32.432
 1319    HG2  GLU 160           HG2      GLU 160   5.795 -22.111  32.285
 1320    HG3  GLU 160           HG3      GLU 160   5.721 -21.527  30.628
 1321    H    ASN 161           H        ASN 161   6.711 -17.171  31.691
 1322    HA   ASN 161           HA       ASN 161   9.195 -16.470  33.211
 1323    HB2  ASN 161           HB2      ASN 161   7.950 -15.154  30.787
 1324    HB3  ASN 161           HB3      ASN 161   9.080 -14.334  31.856
 1325   HD21  ASN 161          HD22      ASN 161   8.893 -17.648  30.187
 1326   HD22  ASN 161          HD21      ASN 161  10.570 -17.584  29.720
 1327    H    THR 162           H        THR 162   6.403 -17.054  34.037
 1328    HA   THR 162           HA       THR 162   5.219 -16.871  35.628
 1329    HB   THR 162           HB       THR 162   5.817 -15.812  37.597
 1330    HG1  THR 162           HG1      THR 162   7.511 -14.266  35.965
 1331   HG21  THR 162          HG21      THR 162   7.918 -16.928  37.922
 1332   HG22  THR 162          HG22      THR 162   6.949 -17.851  36.751
 1333   HG23  THR 162          HG23      THR 162   8.288 -16.847  36.179
 1334    HA   PRO 163           HA       PRO 163   2.209 -14.348  34.384
 1335    HB2  PRO 163           HB2      PRO 163   0.038 -15.005  35.950
 1336    HB3  PRO 163           HB3      PRO 163   0.892 -16.191  34.921
 1337    HG2  PRO 163           HG2      PRO 163   1.421 -15.579  37.859
 1338    HG3  PRO 163           HG3      PRO 163   1.030 -17.176  37.130
 1339    HD2  PRO 163           HD2      PRO 163   3.599 -16.420  37.543
 1340    HD3  PRO 163           HD3      PRO 163   3.129 -17.284  36.038
 1341    H    LYS 164           H        LYS 164   3.961 -12.775  35.938
 1342    HA   LYS 164           HA       LYS 164   2.350 -11.087  37.764
 1343    HB2  LYS 164           HB2      LYS 164   5.333 -11.041  37.116
 1344    HB3  LYS 164           HB3      LYS 164   4.518 -10.004  38.276
 1345    HG2  LYS 164           HG2      LYS 164   4.817 -13.034  38.495
 1346    HG3  LYS 164           HG3      LYS 164   5.731 -11.815  39.386
 1347    HD2  LYS 164           HD2      LYS 164   3.606 -11.025  40.446
 1348    HD3  LYS 164           HD3      LYS 164   2.738 -12.344  39.625
 1349    HE2  LYS 164           HE2      LYS 164   4.190 -14.012  40.740
 1350    HE3  LYS 164           HE3      LYS 164   5.087 -12.716  41.541
 1351    HZ1  LYS 164           HZ1      LYS 164   3.416 -13.669  43.001
 1352    HZ2  LYS 164           HZ2      LYS 164   3.037 -12.109  42.708
 1353    HZ3  LYS 164           HZ3      LYS 164   2.204 -13.313  41.968
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1  -1.458   0.380  -0.865
    2    H2   MET   1           H2       MET   1  -0.953   1.837  -1.424
    3    H3   MET   1           H3       MET   1  -1.916   0.897  -2.352
    4    HA   MET   1           HA       MET   1   0.340   0.816  -3.157
    5    HB2  MET   1           HB2      MET   1   1.255   1.177  -0.724
    6    HB3  MET   1           HB3      MET   1   1.177  -0.570  -0.563
    7    HG2  MET   1           HG2      MET   1   2.741   1.004  -2.649
    8    HG3  MET   1           HG3      MET   1   3.391   0.272  -1.185
    9    HE1  MET   1           HE1      MET   1   4.812  -1.796  -1.259
   10    HE2  MET   1           HE2      MET   1   3.222  -2.383  -0.718
   11    HE3  MET   1           HE3      MET   1   4.134  -3.292  -1.955
   12    H    ILE   2           H        ILE   2   0.441  -0.876  -4.615
   13    HA   ILE   2           HA       ILE   2  -0.037  -3.627  -3.687
   14    HB   ILE   2           HB       ILE   2  -1.198  -2.560  -6.295
   15   HG12  ILE   2          HG12      ILE   2  -2.350  -2.996  -3.561
   16   HG13  ILE   2          HG13      ILE   2  -2.759  -1.793  -4.785
   17   HG21  ILE   2          HG21      ILE   2  -1.340  -5.343  -5.031
   18   HG22  ILE   2          HG22      ILE   2  -2.061  -4.845  -6.573
   19   HG23  ILE   2          HG23      ILE   2  -0.308  -4.901  -6.415
   20   HD11  ILE   2          HD11      ILE   2  -3.591  -4.693  -4.565
   21   HD12  ILE   2          HD12      ILE   2  -4.603  -3.247  -4.381
   22   HD13  ILE   2          HD13      ILE   2  -4.009  -3.675  -5.998
   23    H    ASP   3           H        ASP   3   1.771  -4.827  -4.403
   24    HA   ASP   3           HA       ASP   3   4.019  -3.381  -5.125
   25    HB2  ASP   3           HB2      ASP   3   4.096  -5.466  -3.862
   26    HB3  ASP   3           HB3      ASP   3   3.594  -6.359  -5.311
   27    H    ASP   4           H        ASP   4   2.692  -6.021  -7.135
   28    HA   ASP   4           HA       ASP   4   2.894  -4.494  -9.561
   29    HB2  ASP   4           HB2      ASP   4   5.276  -5.002  -9.285
   30    HB3  ASP   4           HB3      ASP   4   4.905  -6.706  -9.030
   31    H    ASP   5           H        ASP   5   2.946  -7.820  -8.304
   32    HA   ASP   5           HA       ASP   5   1.563  -8.833 -10.607
   33    HB2  ASP   5           HB2      ASP   5   3.473  -9.965  -9.475
   34    HB3  ASP   5           HB3      ASP   5   2.414 -10.314  -8.106
   35    H    GLY   6           H        GLY   6   0.204  -7.114  -8.404
   36    HA2  GLY   6           HA2      GLY   6  -2.078  -6.832  -7.976
   37    HA3  GLY   6           HA3      GLY   6  -2.396  -8.505  -8.451
   38    H    TYR   7           H        TYR   7   0.142  -8.920  -6.431
   39    HA   TYR   7           HA       TYR   7  -1.539  -9.131  -4.008
   40    HB2  TYR   7           HB2      TYR   7   1.270 -10.186  -4.464
   41    HB3  TYR   7           HB3      TYR   7   0.294 -10.379  -3.007
   42    HD1  TYR   7           HD1      TYR   7  -1.719 -11.807  -2.970
   43    HD2  TYR   7           HD2      TYR   7   0.885 -11.630  -6.402
   44    HE1  TYR   7           HE1      TYR   7  -2.714 -13.908  -3.826
   45    HE2  TYR   7           HE2      TYR   7  -0.080 -13.728  -7.257
   46    HH   TYR   7           HH       TYR   7  -1.633 -15.451  -6.897
   47    H    ARG   8           H        ARG   8  -0.633  -8.274  -1.988
   48    HA   ARG   8           HA       ARG   8   1.240  -5.992  -2.308
   49    HB2  ARG   8           HB2      ARG   8  -0.326  -4.476  -1.164
   50    HB3  ARG   8           HB3      ARG   8  -1.071  -5.149  -2.634
   51    HG2  ARG   8           HG2      ARG   8  -2.210  -6.866  -1.180
   52    HG3  ARG   8           HG3      ARG   8  -1.692  -5.915   0.234
   53    HD2  ARG   8           HD2      ARG   8  -3.165  -4.687  -2.111
   54    HD3  ARG   8           HD3      ARG   8  -4.039  -5.552  -0.835
   55    HE   ARG   8           HE       ARG   8  -2.487  -3.014  -0.587
   56   HH11  ARG   8          HH21      ARG   8  -4.572  -5.431   1.080
   57   HH12  ARG   8          HH22      ARG   8  -5.087  -4.312   2.291
   58   HH21  ARG   8          HH11      ARG   8  -3.164  -1.585   1.096
   59   HH22  ARG   8          HH12      ARG   8  -4.242  -2.115   2.327
   60    HA   PRO   9           HA       PRO   9   2.534  -8.058   1.394
   61    HB2  PRO   9           HB2      PRO   9   4.751  -6.674   2.059
   62    HB3  PRO   9           HB3      PRO   9   4.607  -7.528   0.509
   63    HG2  PRO   9           HG2      PRO   9   4.195  -4.565   1.023
   64    HG3  PRO   9           HG3      PRO   9   5.134  -5.353  -0.275
   65    HD2  PRO   9           HD2      PRO   9   2.518  -4.444  -0.499
   66    HD3  PRO   9           HD3      PRO   9   3.247  -5.734  -1.507
   67    H    ASN  10           H        ASN  10   1.926  -8.106   3.590
   68    HA   ASN  10           HA       ASN  10   1.235  -5.532   4.919
   69    HB2  ASN  10           HB2      ASN  10  -0.699  -6.671   3.667
   70    HB3  ASN  10           HB3      ASN  10  -0.542  -8.007   4.786
   71   HD21  ASN  10          HD22      ASN  10  -1.899  -4.823   4.277
   72   HD22  ASN  10          HD21      ASN  10  -2.597  -4.667   5.870
   73    H    VAL  11           H        VAL  11   0.975  -5.798   7.353
   74    HA   VAL  11           HA       VAL  11   2.015  -8.301   8.380
   75    HB   VAL  11           HB       VAL  11   3.640  -7.300   9.895
   76   HG11  VAL  11          HG11      VAL  11   4.436  -7.947   7.699
   77   HG12  VAL  11          HG12      VAL  11   4.212  -6.258   7.204
   78   HG13  VAL  11          HG13      VAL  11   5.363  -6.648   8.487
   79   HG21  VAL  11          HG21      VAL  11   4.294  -4.928   9.728
   80   HG22  VAL  11          HG22      VAL  11   2.918  -4.608   8.646
   81   HG23  VAL  11          HG23      VAL  11   2.649  -5.105  10.339
   82    H    GLY  12           H        GLY  12   1.568  -8.561  10.716
   83    HA2  GLY  12           HA2      GLY  12  -0.445  -6.653  11.785
   84    HA3  GLY  12           HA3      GLY  12  -0.827  -8.358  11.741
   85    H    ILE  13           H        ILE  13  -0.731  -6.821  14.094
   86    HA   ILE  13           HA       ILE  13   1.745  -7.724  15.503
   87    HB   ILE  13           HB       ILE  13  -0.047  -5.285  15.771
   88   HG12  ILE  13          HG12      ILE  13   2.853  -4.807  15.747
   89   HG13  ILE  13          HG13      ILE  13   2.298  -5.619  14.270
   90   HG21  ILE  13          HG21      ILE  13   0.429  -6.000  18.046
   91   HG22  ILE  13          HG22      ILE  13   2.171  -6.151  17.669
   92   HG23  ILE  13          HG23      ILE  13   1.360  -4.558  17.666
   93   HD11  ILE  13          HD11      ILE  13   2.220  -3.182  14.028
   94   HD12  ILE  13          HD12      ILE  13   0.590  -3.875  13.926
   95   HD13  ILE  13          HD13      ILE  13   1.122  -3.057  15.419
   96    H    VAL  14           H        VAL  14   1.439  -8.855  17.386
   97    HA   VAL  14           HA       VAL  14  -1.319  -9.037  18.526
   98    HB   VAL  14           HB       VAL  14   0.781 -11.255  18.567
   99   HG11  VAL  14          HG11      VAL  14  -1.114 -12.654  19.351
  100   HG12  VAL  14          HG12      VAL  14  -0.785 -11.327  20.464
  101   HG13  VAL  14          HG13      VAL  14  -2.167 -11.213  19.353
  102   HG21  VAL  14          HG21      VAL  14  -0.635 -12.494  16.999
  103   HG22  VAL  14          HG22      VAL  14  -1.640 -11.036  16.750
  104   HG23  VAL  14          HG23      VAL  14   0.077 -11.059  16.260
  105    H    ILE  15           H        ILE  15  -1.313  -8.569  20.766
  106    HA   ILE  15           HA       ILE  15   1.329  -8.550  22.090
  107    HB   ILE  15           HB       ILE  15  -0.870  -6.616  22.879
  108   HG12  ILE  15          HG12      ILE  15  -0.009  -5.939  20.627
  109   HG13  ILE  15          HG13      ILE  15   0.296  -4.778  21.909
  110   HG21  ILE  15          HG21      ILE  15   0.602  -7.206  24.694
  111   HG22  ILE  15          HG22      ILE  15   2.045  -6.936  23.683
  112   HG23  ILE  15          HG23      ILE  15   0.999  -5.573  24.128
  113   HD11  ILE  15          HD11      ILE  15   2.222  -5.086  20.354
  114   HD12  ILE  15          HD12      ILE  15   2.627  -5.393  22.059
  115   HD13  ILE  15          HD13      ILE  15   2.384  -6.760  20.928
  116    H    CYS  16           H        CYS  16   1.334  -9.876  23.902
  117    HA   CYS  16           HA       CYS  16  -1.326 -10.523  25.017
  118    HB2  CYS  16           HB2      CYS  16  -0.897 -12.835  25.271
  119    HB3  CYS  16           HB3      CYS  16  -0.469 -12.438  23.598
  120    HG   CYS  16           HG       CYS  16   1.402 -12.981  26.258
  121    H    ASN  17           H        ASN  17  -1.335 -11.212  27.223
  122    HA   ASN  17           HA       ASN  17   0.823  -9.939  28.846
  123    HB2  ASN  17           HB2      ASN  17  -0.818  -9.457  30.523
  124    HB3  ASN  17           HB3      ASN  17  -1.403  -8.851  28.989
  125   HD21  ASN  17          HD22      ASN  17  -3.423  -8.891  30.575
  126   HD22  ASN  17          HD21      ASN  17  -4.402 -10.340  30.480
  127    H    ARG  18           H        ARG  18   0.912 -11.202  31.155
  128    HA   ARG  18           HA       ARG  18   1.529 -13.972  30.433
  129    HB2  ARG  18           HB2      ARG  18   1.676 -12.444  33.081
  130    HB3  ARG  18           HB3      ARG  18   2.025 -14.161  32.956
  131    HG2  ARG  18           HG2      ARG  18   4.116 -13.614  32.580
  132    HG3  ARG  18           HG3      ARG  18   3.593 -13.290  30.927
  133    HD2  ARG  18           HD2      ARG  18   3.351 -10.910  31.428
  134    HD3  ARG  18           HD3      ARG  18   3.670 -11.176  33.140
  135    HE   ARG  18           HE       ARG  18   5.589 -11.136  30.905
  136   HH11  ARG  18          HH11      ARG  18   5.179 -11.931  34.359
  137   HH12  ARG  18          HH12      ARG  18   6.866 -11.857  34.712
  138   HH21  ARG  18          HH21      ARG  18   7.817 -11.031  31.384
  139   HH22  ARG  18          HH22      ARG  18   8.397 -11.318  32.986
  140    H    GLN  19           H        GLN  19  -1.438 -12.664  30.971
  141    HA   GLN  19           HA       GLN  19  -2.537 -14.964  32.420
  142    HB2  GLN  19           HB2      GLN  19  -4.147 -12.752  31.158
  143    HB3  GLN  19           HB3      GLN  19  -4.625 -13.847  32.442
  144    HG2  GLN  19           HG2      GLN  19  -2.636 -11.559  32.600
  145    HG3  GLN  19           HG3      GLN  19  -4.248 -11.587  33.284
  146   HE21  GLN  19          HE22      GLN  19  -1.770 -11.065  34.782
  147   HE22  GLN  19          HE21      GLN  19  -1.620 -12.340  35.967
  148    H    GLY  20           H        GLY  20  -1.528 -14.316  29.228
  149    HA2  GLY  20           HA2      GLY  20  -1.864 -15.515  27.307
  150    HA3  GLY  20           HA3      GLY  20  -3.013 -16.574  28.136
  151    H    GLN  21           H        GLN  21  -3.459 -13.045  28.321
  152    HA   GLN  21           HA       GLN  21  -5.816 -13.282  26.539
  153    HB2  GLN  21           HB2      GLN  21  -4.948 -10.917  28.239
  154    HB3  GLN  21           HB3      GLN  21  -6.421 -11.052  27.280
  155    HG2  GLN  21           HG2      GLN  21  -7.264 -12.855  28.726
  156    HG3  GLN  21           HG3      GLN  21  -5.762 -12.830  29.657
  157   HE21  GLN  21          HE22      GLN  21  -8.865 -11.164  29.191
  158   HE22  GLN  21          HE21      GLN  21  -8.612 -10.007  30.474
  159    H    VAL  22           H        VAL  22  -5.870 -11.999  24.677
  160    HA   VAL  22           HA       VAL  22  -3.350 -10.717  23.804
  161    HB   VAL  22           HB       VAL  22  -3.890 -11.349  21.542
  162   HG11  VAL  22          HG11      VAL  22  -2.597 -12.926  22.976
  163   HG12  VAL  22          HG12      VAL  22  -4.078 -13.800  23.377
  164   HG13  VAL  22          HG13      VAL  22  -3.484 -13.755  21.692
  165   HG21  VAL  22          HG21      VAL  22  -5.740 -12.882  20.967
  166   HG22  VAL  22          HG22      VAL  22  -6.376 -12.772  22.621
  167   HG23  VAL  22          HG23      VAL  22  -6.354 -11.342  21.567
  168    H    MET  23           H        MET  23  -3.644  -8.650  22.727
  169    HA   MET  23           HA       MET  23  -6.115  -7.306  23.531
  170    HB2  MET  23           HB2      MET  23  -5.210  -5.319  22.873
  171    HB3  MET  23           HB3      MET  23  -3.858  -6.205  23.574
  172    HG2  MET  23           HG2      MET  23  -3.184  -6.831  21.193
  173    HG3  MET  23           HG3      MET  23  -4.432  -5.714  20.621
  174    HE1  MET  23           HE1      MET  23  -4.275  -2.909  21.213
  175    HE2  MET  23           HE2      MET  23  -4.173  -3.434  22.917
  176    HE3  MET  23           HE3      MET  23  -2.966  -2.326  22.275
  177    H    TRP  24           H        TRP  24  -7.715  -6.441  22.143
  178    HA   TRP  24           HA       TRP  24  -7.848  -7.391  19.337
  179    HB2  TRP  24           HB2      TRP  24  -8.694  -9.132  20.866
  180    HB3  TRP  24           HB3      TRP  24  -9.786  -7.983  21.612
  181    HD1  TRP  24           HD1      TRP  24 -12.074  -8.782  21.043
  182    HE1  TRP  24           HE1      TRP  24 -13.269  -9.881  19.075
  183    HE3  TRP  24           HE3      TRP  24  -8.175  -8.971  17.733
  184    HZ2  TRP  24           HZ2      TRP  24 -12.647 -10.675  16.401
  185    HZ3  TRP  24           HZ3      TRP  24  -8.473 -10.068  15.543
  186    HH2  TRP  24           HH2      TRP  24 -10.740 -10.908  14.863
  187    H    ALA  25           H        ALA  25  -9.178  -5.795  18.080
  188    HA   ALA  25           HA       ALA  25 -10.355  -3.606  19.707
  189    HB1  ALA  25           HB1      ALA  25  -7.908  -3.161  19.405
  190    HB2  ALA  25           HB2      ALA  25  -8.160  -3.161  17.655
  191    HB3  ALA  25           HB3      ALA  25  -8.952  -1.933  18.693
  192    H    ARG  26           H        ARG  26 -11.747  -2.210  18.681
  193    HA   ARG  26           HA       ARG  26 -13.075  -3.285  16.245
  194    HB2  ARG  26           HB2      ARG  26 -14.351  -3.189  18.374
  195    HB3  ARG  26           HB3      ARG  26 -14.114  -1.445  18.458
  196    HG2  ARG  26           HG2      ARG  26 -15.491  -1.084  16.502
  197    HG3  ARG  26           HG3      ARG  26 -15.454  -2.805  16.089
  198    HD2  ARG  26           HD2      ARG  26 -17.603  -2.387  17.015
  199    HD3  ARG  26           HD3      ARG  26 -16.681  -3.333  18.186
  200    HE   ARG  26           HE       ARG  26 -16.655  -0.391  18.540
  201   HH11  ARG  26          HH11      ARG  26 -18.402  -3.373  19.468
  202   HH12  ARG  26          HH12      ARG  26 -19.100  -2.643  20.869
  203   HH21  ARG  26          HH21      ARG  26 -17.590   0.524  20.226
  204   HH22  ARG  26          HH22      ARG  26 -18.612  -0.339  21.362
  205    H    ARG  27           H        ARG  27 -12.645  -2.049  14.342
  206    HA   ARG  27           HA       ARG  27 -10.782   0.141  14.678
  207    HB2  ARG  27           HB2      ARG  27 -10.737  -1.596  12.868
  208    HB3  ARG  27           HB3      ARG  27 -12.171  -0.882  12.188
  209    HG2  ARG  27           HG2      ARG  27 -10.450  -0.044  10.875
  210    HG3  ARG  27           HG3      ARG  27 -10.779   1.316  11.941
  211    HD2  ARG  27           HD2      ARG  27  -8.777   0.826  13.267
  212    HD3  ARG  27           HD3      ARG  27  -8.598  -0.751  12.516
  213    HE   ARG  27           HE       ARG  27  -7.860   0.180  10.507
  214   HH11  ARG  27          HH21      ARG  27  -8.212   2.704  13.014
  215   HH12  ARG  27          HH22      ARG  27  -7.177   3.829  12.181
  216   HH21  ARG  27          HH11      ARG  27  -6.539   1.733   9.423
  217   HH22  ARG  27          HH12      ARG  27  -6.264   3.283  10.135
  218    H    PHE  28           H        PHE  28 -11.093   2.384  13.964
  219    HA   PHE  28           HA       PHE  28 -13.453   3.437  15.086
  220    HB2  PHE  28           HB2      PHE  28 -11.298   4.623  14.959
  221    HB3  PHE  28           HB3      PHE  28 -11.479   4.804  13.219
  222    HD1  PHE  28           HD2      PHE  28 -13.183   5.574  16.499
  223    HD2  PHE  28           HD1      PHE  28 -12.541   6.779  12.398
  224    HE1  PHE  28           HE2      PHE  28 -14.382   7.697  16.932
  225    HE2  PHE  28           HE1      PHE  28 -13.721   8.916  12.850
  226    HZ   PHE  28           HZ       PHE  28 -14.653   9.372  15.110
  227    H    GLY  29           H        GLY  29 -15.384   3.952  14.311
  228    HA2  GLY  29           HA2      GLY  29 -17.121   4.380  12.881
  229    HA3  GLY  29           HA3      GLY  29 -16.002   4.364  11.512
  230    H    GLN  30           H        GLN  30 -15.655   1.443  13.336
  231    HA   GLN  30           HA       GLN  30 -17.412   0.008  11.396
  232    HB2  GLN  30           HB2      GLN  30 -14.975  -1.216  12.685
  233    HB3  GLN  30           HB3      GLN  30 -15.847  -1.726  11.246
  234    HG2  GLN  30           HG2      GLN  30 -13.922   0.584  11.561
  235    HG3  GLN  30           HG3      GLN  30 -13.717  -0.871  10.602
  236   HE21  GLN  30          HE22      GLN  30 -14.147   2.344  10.211
  237   HE22  GLN  30          HE21      GLN  30 -15.046   2.353   8.701
  238    H    HIS  31           H        HIS  31 -18.253  -2.043  12.154
  239    HA   HIS  31           HA       HIS  31 -18.664  -2.165  15.112
  240    HB2  HIS  31           HB2      HIS  31 -20.223  -3.519  12.892
  241    HB3  HIS  31           HB3      HIS  31 -20.593  -3.557  14.618
  242    HD1  HIS  31           HD1      HIS  31 -22.284  -2.119  12.009
  243    HD2  HIS  31           HD2      HIS  31 -20.283  -0.417  15.307
  244    HE1  HIS  31           HE1      HIS  31 -23.296   0.194  12.353
  245    H    SER  32           H        SER  32 -16.834  -3.629  12.574
  246    HA   SER  32           HA       SER  32 -16.757  -6.300  13.704
  247    HB2  SER  32           HB2      SER  32 -15.043  -6.459  11.714
  248    HB3  SER  32           HB3      SER  32 -16.782  -6.341  11.402
  249    HG   SER  32           HG       SER  32 -15.579  -4.881  10.085
  250    H    TRP  33           H        TRP  33 -14.838  -7.323  14.437
  251    HA   TRP  33           HA       TRP  33 -12.885  -5.480  15.716
  252    HB2  TRP  33           HB2      TRP  33 -13.702  -8.303  16.432
  253    HB3  TRP  33           HB3      TRP  33 -12.445  -7.339  17.212
  254    HD1  TRP  33           HD1      TRP  33 -16.283  -7.250  16.718
  255    HE1  TRP  33           HE1      TRP  33 -17.348  -6.091  18.714
  256    HE3  TRP  33           HE3      TRP  33 -12.029  -5.906  19.199
  257    HZ2  TRP  33           HZ2      TRP  33 -16.448  -4.503  21.001
  258    HZ3  TRP  33           HZ3      TRP  33 -12.146  -4.445  21.205
  259    HH2  TRP  33           HH2      TRP  33 -14.350  -3.728  22.102
  260    H    GLN  34           H        GLN  34 -10.659  -6.021  15.667
  261    HA   GLN  34           HA       GLN  34  -9.674  -8.093  13.867
  262    HB2  GLN  34           HB2      GLN  34  -8.452  -6.470  12.445
  263    HB3  GLN  34           HB3      GLN  34 -10.189  -6.337  12.233
  264    HG2  GLN  34           HG2      GLN  34 -10.297  -4.284  13.452
  265    HG3  GLN  34           HG3      GLN  34  -8.696  -4.506  14.152
  266   HE21  GLN  34          HE22      GLN  34  -6.759  -4.399  12.683
  267   HE22  GLN  34          HE21      GLN  34  -6.864  -3.211  11.404
  268    H    PHE  35           H        PHE  35  -7.248  -8.013  13.808
  269    HA   PHE  35           HA       PHE  35  -6.099  -7.145  16.404
  270    HB2  PHE  35           HB2      PHE  35  -4.937  -8.663  14.047
  271    HB3  PHE  35           HB3      PHE  35  -4.041  -8.258  15.505
  272    HD1  PHE  35           HD2      PHE  35  -5.522  -8.984  17.768
  273    HD2  PHE  35           HD1      PHE  35  -5.359 -11.011  13.936
  274    HE1  PHE  35           HE2      PHE  35  -6.238 -11.084  18.848
  275    HE2  PHE  35           HE1      PHE  35  -6.048 -13.102  15.052
  276    HZ   PHE  35           HZ       PHE  35  -6.536 -13.146  17.484
  277    HA   PRO  36           HA       PRO  36  -4.464  -3.443  14.411
  278    HB2  PRO  36           HB2      PRO  36  -1.968  -3.178  15.597
  279    HB3  PRO  36           HB3      PRO  36  -3.524  -2.721  16.354
  280    HG2  PRO  36           HG2      PRO  36  -1.949  -5.267  16.750
  281    HG3  PRO  36           HG3      PRO  36  -2.737  -4.247  17.988
  282    HD2  PRO  36           HD2      PRO  36  -3.866  -6.517  17.013
  283    HD3  PRO  36           HD3      PRO  36  -4.867  -5.091  17.425
  284    H    GLN  37           H        GLN  37  -3.586  -3.235  12.334
  285    HA   GLN  37           HA       GLN  37  -1.302  -4.832  11.479
  286    HB2  GLN  37           HB2      GLN  37  -2.486  -6.153   9.794
  287    HB3  GLN  37           HB3      GLN  37  -3.144  -6.505  11.391
  288    HG2  GLN  37           HG2      GLN  37  -5.035  -4.885  10.871
  289    HG3  GLN  37           HG3      GLN  37  -4.371  -4.721   9.243
  290   HE21  GLN  37          HE22      GLN  37  -6.868  -5.460   9.076
  291   HE22  GLN  37          HE21      GLN  37  -7.051  -7.176   8.806
  292    H    GLY  38           H        GLY  38  -0.738  -4.418   9.125
  293    HA2  GLY  38           HA2      GLY  38  -2.091  -2.473   7.577
  294    HA3  GLY  38           HA3      GLY  38  -0.851  -1.641   8.507
  295    H    GLY  39           H        GLY  39  -0.463  -1.385   5.885
  296    HA2  GLY  39           HA2      GLY  39   0.712  -3.631   4.577
  297    HA3  GLY  39           HA3      GLY  39   0.541  -1.997   3.958
  298    H    ILE  40           H        ILE  40   2.712  -3.724   3.744
  299    HA   ILE  40           HA       ILE  40   4.979  -2.457   5.203
  300    HB   ILE  40           HB       ILE  40   4.898  -4.603   3.046
  301   HG12  ILE  40          HG12      ILE  40   5.712  -5.002   5.928
  302   HG13  ILE  40          HG13      ILE  40   4.044  -5.203   5.403
  303   HG21  ILE  40          HG21      ILE  40   7.285  -3.719   4.712
  304   HG22  ILE  40          HG22      ILE  40   7.288  -4.986   3.481
  305   HG23  ILE  40          HG23      ILE  40   7.049  -3.316   3.000
  306   HD11  ILE  40          HD11      ILE  40   5.537  -7.303   5.582
  307   HD12  ILE  40          HD12      ILE  40   4.489  -7.103   4.178
  308   HD13  ILE  40          HD13      ILE  40   6.237  -6.792   4.046
  309    H    ASN  41           H        ASN  41   5.771  -0.556   4.373
  310    HA   ASN  41           HA       ASN  41   4.741   0.462   1.840
  311    HB2  ASN  41           HB2      ASN  41   6.827   1.552   3.775
  312    HB3  ASN  41           HB3      ASN  41   6.361   2.364   2.292
  313   HD21  ASN  41          HD22      ASN  41   5.131   1.225   5.440
  314   HD22  ASN  41          HD21      ASN  41   3.681   2.235   5.429
  315    HA   PRO  42           HA       PRO  42   7.752  -1.190  -0.851
  316    HB2  PRO  42           HB2      PRO  42   8.432   1.564  -1.913
  317    HB3  PRO  42           HB3      PRO  42   7.994   0.079  -2.811
  318    HG2  PRO  42           HG2      PRO  42   6.166   2.054  -2.449
  319    HG3  PRO  42           HG3      PRO  42   5.690   0.332  -2.254
  320    HD2  PRO  42           HD2      PRO  42   6.427   2.333  -0.096
  321    HD3  PRO  42           HD3      PRO  42   5.024   1.229  -0.159
  322    H    GLY  43           H        GLY  43   9.777  -1.896  -0.160
  323    HA2  GLY  43           HA2      GLY  43  12.027  -1.779   0.355
  324    HA3  GLY  43           HA3      GLY  43  11.928  -0.025   0.500
  325    H    GLU  44           H        GLU  44   9.410  -1.035   2.481
  326    HA   GLU  44           HA       GLU  44  10.973  -0.894   4.918
  327    HB2  GLU  44           HB2      GLU  44   8.156  -0.767   4.179
  328    HB3  GLU  44           HB3      GLU  44   8.376  -1.950   5.469
  329    HG2  GLU  44           HG2      GLU  44   9.217  -0.377   6.955
  330    HG3  GLU  44           HG3      GLU  44   9.576   0.789   5.661
  331    H    SER  45           H        SER  45  10.972  -2.671   6.522
  332    HA   SER  45           HA       SER  45  10.996  -5.380   5.265
  333    HB2  SER  45           HB2      SER  45  12.173  -6.102   7.275
  334    HB3  SER  45           HB3      SER  45  13.062  -4.792   6.477
  335    HG   SER  45           HG       SER  45  12.762  -4.630   8.842
  336    H    ALA  46           H        ALA  46   9.872  -7.040   6.700
  337    HA   ALA  46           HA       ALA  46   7.251  -6.219   7.356
  338    HB1  ALA  46           HB1      ALA  46   8.859  -8.625   8.314
  339    HB2  ALA  46           HB2      ALA  46   7.082  -8.478   8.385
  340    HB3  ALA  46           HB3      ALA  46   7.896  -8.529   6.809
  341    H    GLU  47           H        GLU  47  10.170  -6.545   9.366
  342    HA   GLU  47           HA       GLU  47   8.848  -6.125  11.871
  343    HB2  GLU  47           HB2      GLU  47  10.932  -7.331  11.502
  344    HB3  GLU  47           HB3      GLU  47  11.757  -5.816  11.051
  345    HG2  GLU  47           HG2      GLU  47  11.235  -4.922  13.335
  346    HG3  GLU  47           HG3      GLU  47  10.506  -6.480  13.744
  347    H    GLN  48           H        GLN  48  10.423  -3.872   9.523
  348    HA   GLN  48           HA       GLN  48  10.047  -1.562  11.277
  349    HB2  GLN  48           HB2      GLN  48  10.546  -1.826   8.292
  350    HB3  GLN  48           HB3      GLN  48  10.388  -0.268   9.119
  351    HG2  GLN  48           HG2      GLN  48  12.280  -0.746  10.562
  352    HG3  GLN  48           HG3      GLN  48  12.396  -2.391   9.919
  353   HE21  GLN  48          HE22      GLN  48  12.932  -2.682   7.678
  354   HE22  GLN  48          HE21      GLN  48  13.897  -1.487   6.808
  355    H    ALA  49           H        ALA  49   8.069  -3.172   8.732
  356    HA   ALA  49           HA       ALA  49   6.021  -1.153   8.681
  357    HB1  ALA  49           HB1      ALA  49   4.684  -2.895   7.635
  358    HB2  ALA  49           HB2      ALA  49   6.342  -2.919   6.976
  359    HB3  ALA  49           HB3      ALA  49   5.813  -4.156   8.162
  360    H    MET  50           H        MET  50   6.668  -4.053  10.692
  361    HA   MET  50           HA       MET  50   4.280  -3.969  12.210
  362    HB2  MET  50           HB2      MET  50   5.676  -5.920  12.153
  363    HB3  MET  50           HB3      MET  50   7.066  -5.063  12.781
  364    HG2  MET  50           HG2      MET  50   4.483  -5.399  14.315
  365    HG3  MET  50           HG3      MET  50   5.794  -6.557  14.370
  366    HE1  MET  50           HE1      MET  50   8.583  -5.089  16.353
  367    HE2  MET  50           HE2      MET  50   8.021  -6.328  15.219
  368    HE3  MET  50           HE3      MET  50   8.537  -4.741  14.611
  369    H    TYR  51           H        TYR  51   7.564  -2.524  13.005
  370    HA   TYR  51           HA       TYR  51   6.492  -1.276  15.311
  371    HB2  TYR  51           HB2      TYR  51   8.952  -0.610  13.667
  372    HB3  TYR  51           HB3      TYR  51   8.532   0.202  15.165
  373    HD1  TYR  51           HD2      TYR  51   7.796  -1.615  17.142
  374    HD2  TYR  51           HD1      TYR  51  10.685  -2.193  13.982
  375    HE1  TYR  51           HE2      TYR  51   9.102  -3.122  18.603
  376    HE2  TYR  51           HE1      TYR  51  12.002  -3.668  15.453
  377    HH   TYR  51           HH       TYR  51  12.208  -4.614  17.599
  378    H    ARG  52           H        ARG  52   6.503  -0.079  11.900
  379    HA   ARG  52           HA       ARG  52   5.619   2.575  12.551
  380    HB2  ARG  52           HB2      ARG  52   6.413   2.077  10.323
  381    HB3  ARG  52           HB3      ARG  52   5.298   0.722  10.162
  382    HG2  ARG  52           HG2      ARG  52   3.363   2.343  10.246
  383    HG3  ARG  52           HG3      ARG  52   4.541   3.669  10.230
  384    HD2  ARG  52           HD2      ARG  52   4.566   1.446   8.167
  385    HD3  ARG  52           HD3      ARG  52   3.411   2.787   8.020
  386    HE   ARG  52           HE       ARG  52   6.233   2.794   7.433
  387   HH11  ARG  52          HH21      ARG  52   3.542   4.946   8.457
  388   HH12  ARG  52          HH22      ARG  52   4.270   6.359   7.763
  389   HH21  ARG  52          HH11      ARG  52   7.180   4.646   6.598
  390   HH22  ARG  52          HH12      ARG  52   6.411   6.196   6.695
  391    H    GLU  53           H        GLU  53   3.802  -0.459  11.716
  392    HA   GLU  53           HA       GLU  53   1.308   0.870  11.989
  393    HB2  GLU  53           HB2      GLU  53   2.020  -2.058  11.816
  394    HB3  GLU  53           HB3      GLU  53   0.359  -1.470  11.881
  395    HG2  GLU  53           HG2      GLU  53   2.440  -0.590   9.842
  396    HG3  GLU  53           HG3      GLU  53   1.210  -1.820   9.546
  397    H    LEU  54           H        LEU  54   3.377  -0.817  14.301
  398    HA   LEU  54           HA       LEU  54   1.546  -1.122  16.413
  399    HB2  LEU  54           HB2      LEU  54   3.867  -2.013  16.280
  400    HB3  LEU  54           HB3      LEU  54   4.490  -0.362  16.465
  401    HG   LEU  54           HG       LEU  54   3.221  -0.340  18.729
  402   HD11  LEU  54          HD11      LEU  54   1.828  -2.318  18.412
  403   HD12  LEU  54          HD12      LEU  54   3.256  -3.322  18.058
  404   HD13  LEU  54          HD13      LEU  54   3.000  -2.681  19.692
  405   HD21  LEU  54          HD21      LEU  54   5.108  -1.425  19.853
  406   HD22  LEU  54          HD22      LEU  54   5.581  -2.226  18.327
  407   HD23  LEU  54          HD23      LEU  54   5.678  -0.455  18.489
  408    H    PHE  55           H        PHE  55   3.428   1.811  15.357
  409    HA   PHE  55           HA       PHE  55   2.137   3.430  17.429
  410    HB2  PHE  55           HB2      PHE  55   4.342   4.049  16.495
  411    HB3  PHE  55           HB3      PHE  55   3.606   4.299  14.911
  412    HD1  PHE  55           HD1      PHE  55   3.599   5.459  18.471
  413    HD2  PHE  55           HD2      PHE  55   2.388   6.344  14.420
  414    HE1  PHE  55           HE1      PHE  55   2.894   7.732  19.175
  415    HE2  PHE  55           HE2      PHE  55   1.687   8.617  15.133
  416    HZ   PHE  55           HZ       PHE  55   1.929   9.313  17.505
  417    H    GLU  56           H        GLU  56   1.618   3.031  13.827
  418    HA   GLU  56           HA       GLU  56  -0.386   4.974  13.865
  419    HB2  GLU  56           HB2      GLU  56   0.054   2.736  11.863
  420    HB3  GLU  56           HB3      GLU  56  -1.108   4.050  11.668
  421    HG2  GLU  56           HG2      GLU  56   0.847   5.682  12.008
  422    HG3  GLU  56           HG3      GLU  56   1.924   4.291  11.883
  423    H    GLU  57           H        GLU  57  -0.687   1.624  14.793
  424    HA   GLU  57           HA       GLU  57  -3.648   1.751  14.790
  425    HB2  GLU  57           HB2      GLU  57  -1.740  -0.543  15.359
  426    HB3  GLU  57           HB3      GLU  57  -3.478  -0.658  15.334
  427    HG2  GLU  57           HG2      GLU  57  -1.949   0.210  12.860
  428    HG3  GLU  57           HG3      GLU  57  -2.127  -1.475  13.305
  429    H    VAL  58           H        VAL  58  -0.913   0.946  17.030
  430    HA   VAL  58           HA       VAL  58  -2.813   0.802  19.274
  431    HB   VAL  58           HB       VAL  58   0.148   0.127  19.371
  432   HG11  VAL  58          HG11      VAL  58  -2.284  -0.982  20.731
  433   HG12  VAL  58          HG12      VAL  58  -0.637  -1.653  20.895
  434   HG13  VAL  58          HG13      VAL  58  -0.967  -0.007  21.445
  435   HG21  VAL  58          HG21      VAL  58  -0.449  -2.215  18.648
  436   HG22  VAL  58          HG22      VAL  58  -2.010  -1.578  18.091
  437   HG23  VAL  58          HG23      VAL  58  -0.479  -0.998  17.370
  438    H    GLY  59           H        GLY  59  -0.316   2.788  18.042
  439    HA2  GLY  59           HA2      GLY  59   0.485   4.888  18.691
  440    HA3  GLY  59           HA3      GLY  59  -0.568   4.847  20.111
  441    H    LEU  60           H        LEU  60   0.958   1.965  20.180
  442    HA   LEU  60           HA       LEU  60   2.891   2.611  22.213
  443    HB2  LEU  60           HB2      LEU  60   1.340   0.687  22.122
  444    HB3  LEU  60           HB3      LEU  60   2.097   0.131  20.635
  445    HG   LEU  60           HG       LEU  60   4.176  -0.418  21.851
  446   HD11  LEU  60          HD11      LEU  60   4.174   1.259  23.624
  447   HD12  LEU  60          HD12      LEU  60   2.677   0.575  24.295
  448   HD13  LEU  60          HD13      LEU  60   4.181  -0.373  24.292
  449   HD21  LEU  60          HD21      LEU  60   2.189  -1.994  21.646
  450   HD22  LEU  60          HD22      LEU  60   3.065  -2.254  23.161
  451   HD23  LEU  60          HD23      LEU  60   1.533  -1.351  23.152
  452    H    SER  61           H        SER  61   5.201   2.007  22.001
  453    HA   SER  61           HA       SER  61   6.286   2.101  19.242
  454    HB2  SER  61           HB2      SER  61   7.881   3.865  20.092
  455    HB3  SER  61           HB3      SER  61   6.192   4.382  19.973
  456    HG   SER  61           HG       SER  61   7.092   5.032  21.973
  457    H    ARG  62           H        ARG  62   8.713   1.759  19.342
  458    HA   ARG  62           HA       ARG  62   9.184  -0.889  19.991
  459    HB2  ARG  62           HB2      ARG  62  11.417   1.174  19.791
  460    HB3  ARG  62           HB3      ARG  62  11.462  -0.549  19.430
  461    HG2  ARG  62           HG2      ARG  62   9.528   0.194  17.692
  462    HG3  ARG  62           HG3      ARG  62  10.383   1.731  17.805
  463    HD2  ARG  62           HD2      ARG  62  11.532  -0.964  17.032
  464    HD3  ARG  62           HD3      ARG  62  11.260   0.373  15.925
  465    HE   ARG  62           HE       ARG  62  13.490  -0.118  17.690
  466   HH11  ARG  62          HH11      ARG  62  11.810   2.520  15.967
  467   HH12  ARG  62          HH12      ARG  62  13.167   3.583  16.007
  468   HH21  ARG  62          HH21      ARG  62  15.266   1.336  17.776
  469   HH22  ARG  62          HH22      ARG  62  15.172   2.893  17.044
  470    H    LYS  63           H        LYS  63   9.814   1.982  21.957
  471    HA   LYS  63           HA       LYS  63  11.641   0.805  23.805
  472    HB2  LYS  63           HB2      LYS  63  11.808   2.858  24.658
  473    HB3  LYS  63           HB3      LYS  63  11.149   3.275  23.103
  474    HG2  LYS  63           HG2      LYS  63   9.767   4.531  24.470
  475    HG3  LYS  63           HG3      LYS  63   8.810   3.053  24.297
  476    HD2  LYS  63           HD2      LYS  63   8.826   3.115  26.623
  477    HD3  LYS  63           HD3      LYS  63  10.424   2.343  26.396
  478    HE2  LYS  63           HE2      LYS  63  11.509   4.579  26.483
  479    HE3  LYS  63           HE3      LYS  63   9.927   5.344  26.710
  480    HZ1  LYS  63           HZ1      LYS  63   9.721   4.164  28.820
  481    HZ2  LYS  63           HZ2      LYS  63  11.183   3.442  28.620
  482    HZ3  LYS  63           HZ3      LYS  63  11.084   5.057  28.807
  483    H    ASP  64           H        ASP  64   8.065   0.576  23.656
  484    HA   ASP  64           HA       ASP  64   8.281  -0.643  26.366
  485    HB2  ASP  64           HB2      ASP  64   6.997   1.537  26.088
  486    HB3  ASP  64           HB3      ASP  64   5.761   0.572  25.317
  487    H    VAL  65           H        VAL  65   8.748  -1.900  23.679
  488    HA   VAL  65           HA       VAL  65   7.071  -4.274  24.248
  489    HB   VAL  65           HB       VAL  65   6.733  -4.664  21.833
  490   HG11  VAL  65          HG11      VAL  65   4.985  -3.611  23.271
  491   HG12  VAL  65          HG12      VAL  65   5.551  -2.024  22.721
  492   HG13  VAL  65          HG13      VAL  65   4.867  -3.180  21.551
  493   HG21  VAL  65          HG21      VAL  65   7.041  -2.871  20.190
  494   HG22  VAL  65          HG22      VAL  65   7.695  -1.807  21.441
  495   HG23  VAL  65          HG23      VAL  65   8.591  -3.248  20.949
  496    H    ARG  66           H        ARG  66   7.869  -6.261  23.169
  497    HA   ARG  66           HA       ARG  66  10.634  -6.217  22.205
  498    HB2  ARG  66           HB2      ARG  66  11.306  -8.116  23.578
  499    HB3  ARG  66           HB3      ARG  66  11.042  -6.648  24.500
  500    HG2  ARG  66           HG2      ARG  66   8.774  -8.663  24.419
  501    HG3  ARG  66           HG3      ARG  66  10.231  -9.084  25.295
  502    HD2  ARG  66           HD2      ARG  66   8.662  -6.529  25.790
  503    HD3  ARG  66           HD3      ARG  66   8.476  -7.998  26.735
  504    HE   ARG  66           HE       ARG  66  10.766  -6.124  26.711
  505   HH11  ARG  66          HH21      ARG  66   9.639  -9.292  27.923
  506   HH12  ARG  66          HH22      ARG  66  10.829  -9.366  29.172
  507   HH21  ARG  66          HH11      ARG  66  12.316  -6.251  28.382
  508   HH22  ARG  66          HH12      ARG  66  12.358  -7.609  29.441
  509    H    ILE  67           H        ILE  67  10.798  -7.712  20.449
  510    HA   ILE  67           HA       ILE  67   8.305  -9.042  19.652
  511    HB   ILE  67           HB       ILE  67  11.079  -9.190  18.437
  512   HG12  ILE  67          HG12      ILE  67   8.814  -7.593  17.230
  513   HG13  ILE  67          HG13      ILE  67   9.978  -6.856  18.337
  514   HG21  ILE  67          HG21      ILE  67   8.366 -10.037  17.299
  515   HG22  ILE  67          HG22      ILE  67   9.918 -10.131  16.439
  516   HG23  ILE  67          HG23      ILE  67   9.652 -11.134  17.848
  517   HD11  ILE  67          HD11      ILE  67  10.580  -8.133  15.640
  518   HD12  ILE  67          HD12      ILE  67  10.690  -6.429  16.090
  519   HD13  ILE  67          HD13      ILE  67  11.822  -7.593  16.805
  520    H    LEU  68           H        LEU  68   7.742 -10.791  20.715
  521    HA   LEU  68           HA       LEU  68   9.796 -12.560  21.942
  522    HB2  LEU  68           HB2      LEU  68   6.758 -12.706  21.921
  523    HB3  LEU  68           HB3      LEU  68   7.845 -13.772  22.795
  524    HG   LEU  68           HG       LEU  68   7.415 -10.797  23.373
  525   HD11  LEU  68          HD11      LEU  68   5.580 -12.065  24.135
  526   HD12  LEU  68          HD12      LEU  68   6.603 -13.424  24.682
  527   HD13  LEU  68          HD13      LEU  68   6.642 -11.895  25.559
  528   HD21  LEU  68          HD21      LEU  68   8.866 -11.219  25.351
  529   HD22  LEU  68          HD22      LEU  68   9.303 -12.806  24.683
  530   HD23  LEU  68          HD23      LEU  68   9.753 -11.307  23.827
  531    H    ALA  69           H        ALA  69   7.550 -12.404  19.160
  532    HA   ALA  69           HA       ALA  69   8.722 -14.791  17.978
  533    HB1  ALA  69           HB1      ALA  69   6.963 -15.632  19.669
  534    HB2  ALA  69           HB2      ALA  69   5.760 -14.927  18.587
  535    HB3  ALA  69           HB3      ALA  69   6.835 -16.201  17.991
  536    H    SER  70           H        SER  70   7.764 -15.211  15.913
  537    HA   SER  70           HA       SER  70   6.081 -13.304  14.662
  538    HB2  SER  70           HB2      SER  70   7.767 -12.546  12.913
  539    HB3  SER  70           HB3      SER  70   7.945 -11.870  14.541
  540    HG   SER  70           HG       SER  70   9.976 -12.558  13.686
  541    H    THR  71           H        THR  71   5.538 -13.962  12.335
  542    HA   THR  71           HA       THR  71   5.240 -16.799  12.472
  543    HB   THR  71           HB       THR  71   4.230 -16.406  10.101
  544    HG1  THR  71           HG1      THR  71   4.809 -14.434   9.545
  545   HG21  THR  71          HG21      THR  71   2.673 -16.890  11.743
  546   HG22  THR  71          HG22      THR  71   3.053 -15.443  12.681
  547   HG23  THR  71          HG23      THR  71   2.169 -15.313  11.134
  548    H    ARG  72           H        ARG  72   5.972 -18.442  11.353
  549    HA   ARG  72           HA       ARG  72   8.690 -18.192  10.219
  550    HB2  ARG  72           HB2      ARG  72   6.881 -20.590  10.773
  551    HB3  ARG  72           HB3      ARG  72   8.599 -20.680  10.388
  552    HG2  ARG  72           HG2      ARG  72   9.281 -19.976  12.502
  553    HG3  ARG  72           HG3      ARG  72   7.826 -19.031  12.806
  554    HD2  ARG  72           HD2      ARG  72   6.522 -21.216  12.910
  555    HD3  ARG  72           HD3      ARG  72   8.072 -22.052  12.965
  556    HE   ARG  72           HE       ARG  72   6.795 -20.303  14.982
  557   HH11  ARG  72          HH21      ARG  72   9.771 -22.073  14.141
  558   HH12  ARG  72          HH22      ARG  72  10.361 -22.132  15.763
  559   HH21  ARG  72          HH11      ARG  72   7.566 -20.422  17.148
  560   HH22  ARG  72          HH12      ARG  72   9.080 -21.166  17.506
  561    H    ASN  73           H        ASN  73   5.377 -18.718   9.211
  562    HA   ASN  73           HA       ASN  73   6.162 -18.979   6.395
  563    HB2  ASN  73           HB2      ASN  73   4.418 -20.460   5.970
  564    HB3  ASN  73           HB3      ASN  73   5.134 -21.081   7.463
  565   HD21  ASN  73          HD22      ASN  73   3.893 -20.345   9.630
  566   HD22  ASN  73          HD21      ASN  73   2.174 -20.252   9.462
  567    H    TRP  74           H        TRP  74   4.732 -17.768   4.928
  568    HA   TRP  74           HA       TRP  74   3.629 -15.388   6.288
  569    HB2  TRP  74           HB2      TRP  74   4.064 -16.108   3.360
  570    HB3  TRP  74           HB3      TRP  74   3.164 -14.692   3.863
  571    HD1  TRP  74           HD1      TRP  74   6.759 -16.094   4.042
  572    HE1  TRP  74           HE1      TRP  74   8.407 -14.144   4.258
  573    HE3  TRP  74           HE3      TRP  74   3.432 -12.261   4.479
  574    HZ2  TRP  74           HZ2      TRP  74   8.293 -11.315   4.721
  575    HZ3  TRP  74           HZ3      TRP  74   4.208  -9.918   4.819
  576    HH2  TRP  74           HH2      TRP  74   6.642  -9.455   5.072
  577    H    LEU  75           H        LEU  75   1.554 -14.915   6.576
  578    HA   LEU  75           HA       LEU  75  -0.392 -17.087   6.066
  579    HB2  LEU  75           HB2      LEU  75  -0.803 -14.517   7.636
  580    HB3  LEU  75           HB3      LEU  75  -1.833 -15.948   7.592
  581    HG   LEU  75           HG       LEU  75   0.836 -15.560   8.960
  582   HD11  LEU  75          HD11      LEU  75  -0.442 -16.244  10.943
  583   HD12  LEU  75          HD12      LEU  75  -1.236 -14.897  10.116
  584   HD13  LEU  75          HD13      LEU  75  -1.891 -16.537   9.950
  585   HD21  LEU  75          HD21      LEU  75  -0.513 -18.235   8.436
  586   HD22  LEU  75          HD22      LEU  75   1.125 -17.713   7.949
  587   HD23  LEU  75          HD23      LEU  75   0.756 -17.952   9.654
  588    H    ARG  76           H        ARG  76  -0.047 -16.545   3.651
  589    HA   ARG  76           HA       ARG  76  -1.166 -14.032   2.723
  590    HB2  ARG  76           HB2      ARG  76   0.649 -15.398   1.577
  591    HB3  ARG  76           HB3      ARG  76  -0.574 -16.636   1.255
  592    HG2  ARG  76           HG2      ARG  76  -1.837 -14.895  -0.101
  593    HG3  ARG  76           HG3      ARG  76  -0.432 -13.826   0.082
  594    HD2  ARG  76           HD2      ARG  76  -0.278 -16.642  -1.023
  595    HD3  ARG  76           HD3      ARG  76  -0.539 -15.221  -2.048
  596    HE   ARG  76           HE       ARG  76   1.900 -15.879  -0.445
  597   HH11  ARG  76          HH21      ARG  76   0.484 -14.020  -3.153
  598   HH12  ARG  76          HH22      ARG  76   2.013 -13.560  -3.793
  599   HH21  ARG  76          HH11      ARG  76   3.913 -15.257  -1.327
  600   HH22  ARG  76          HH12      ARG  76   3.991 -14.265  -2.732
  601    H    TYR  77           H        TYR  77  -3.168 -13.728   1.725
  602    HA   TYR  77           HA       TYR  77  -5.034 -15.985   1.582
  603    HB2  TYR  77           HB2      TYR  77  -6.869 -14.873   2.676
  604    HB3  TYR  77           HB3      TYR  77  -5.555 -15.221   3.788
  605    HD1  TYR  77           HD1      TYR  77  -3.998 -13.342   4.511
  606    HD2  TYR  77           HD2      TYR  77  -7.680 -12.649   2.367
  607    HE1  TYR  77           HE1      TYR  77  -4.008 -11.019   5.295
  608    HE2  TYR  77           HE2      TYR  77  -7.702 -10.314   3.150
  609    HH   TYR  77           HH       TYR  77  -6.634  -8.676   4.484
  610    H    LYS  78           H        LYS  78  -6.629 -15.752   0.062
  611    HA   LYS  78           HA       LYS  78  -6.344 -13.467  -1.825
  612    HB2  LYS  78           HB2      LYS  78  -7.609 -16.227  -2.040
  613    HB3  LYS  78           HB3      LYS  78  -8.143 -14.912  -3.075
  614    HG2  LYS  78           HG2      LYS  78  -6.562 -16.183  -4.283
  615    HG3  LYS  78           HG3      LYS  78  -5.886 -14.588  -3.955
  616    HD2  LYS  78           HD2      LYS  78  -4.401 -15.445  -2.282
  617    HD3  LYS  78           HD3      LYS  78  -5.204 -17.021  -2.228
  618    HE2  LYS  78           HE2      LYS  78  -3.789 -15.925  -4.709
  619    HE3  LYS  78           HE3      LYS  78  -2.972 -16.898  -3.482
  620    HZ1  LYS  78           HZ1      LYS  78  -4.506 -18.718  -3.961
  621    HZ2  LYS  78           HZ2      LYS  78  -5.263 -17.838  -5.127
  622    HZ3  LYS  78           HZ3      LYS  78  -3.705 -18.269  -5.306
  623    H    LEU  79           H        LEU  79  -8.079 -12.176  -2.273
  624    HA   LEU  79           HA       LEU  79 -10.127 -11.692  -0.285
  625    HB2  LEU  79           HB2      LEU  79 -10.056 -10.918  -3.244
  626    HB3  LEU  79           HB3      LEU  79 -11.079 -10.211  -2.007
  627    HG   LEU  79           HG       LEU  79  -8.090  -9.858  -2.381
  628   HD11  LEU  79          HD11      LEU  79 -10.438  -7.905  -2.406
  629   HD12  LEU  79          HD12      LEU  79  -8.726  -7.511  -2.706
  630   HD13  LEU  79          HD13      LEU  79  -9.608  -8.551  -3.837
  631   HD21  LEU  79          HD21      LEU  79  -8.402 -10.089  -0.035
  632   HD22  LEU  79          HD22      LEU  79  -8.218  -8.348  -0.385
  633   HD23  LEU  79          HD23      LEU  79  -9.829  -9.015  -0.037
  634    HA   PRO  80           HA       PRO  80 -13.181 -14.487  -2.208
  635    HB2  PRO  80           HB2      PRO  80 -15.517 -13.298  -1.316
  636    HB3  PRO  80           HB3      PRO  80 -14.476 -14.290  -0.239
  637    HG2  PRO  80           HG2      PRO  80 -14.501 -11.295  -0.586
  638    HG3  PRO  80           HG3      PRO  80 -14.589 -12.209   0.951
  639    HD2  PRO  80           HD2      PRO  80 -12.221 -11.222   0.071
  640    HD3  PRO  80           HD3      PRO  80 -12.290 -12.858   0.784
  641    H    LYS  81           H        LYS  81 -14.319 -14.157  -4.344
  642    HA   LYS  81           HA       LYS  81 -13.159 -11.891  -5.571
  643    HB2  LYS  81           HB2      LYS  81 -15.152 -13.714  -6.872
  644    HB3  LYS  81           HB3      LYS  81 -14.035 -12.534  -7.641
  645    HG2  LYS  81           HG2      LYS  81 -12.106 -13.773  -7.069
  646    HG3  LYS  81           HG3      LYS  81 -13.006 -14.874  -6.025
  647    HD2  LYS  81           HD2      LYS  81 -12.443 -15.937  -8.145
  648    HD3  LYS  81           HD3      LYS  81 -14.190 -15.837  -7.898
  649    HE2  LYS  81           HE2      LYS  81 -14.321 -13.931  -9.480
  650    HE3  LYS  81           HE3      LYS  81 -12.563 -14.008  -9.718
  651    HZ1  LYS  81           HZ1      LYS  81 -13.755 -15.160 -11.478
  652    HZ2  LYS  81           HZ2      LYS  81 -12.851 -16.234 -10.641
  653    HZ3  LYS  81           HZ3      LYS  81 -14.473 -16.170 -10.414
  654    H    ARG  82           H        ARG  82 -16.217 -12.053  -4.022
  655    HA   ARG  82           HA       ARG  82 -17.522  -9.951  -5.342
  656    HB2  ARG  82           HB2      ARG  82 -18.730  -9.523  -3.291
  657    HB3  ARG  82           HB3      ARG  82 -18.608 -11.252  -3.634
  658    HG2  ARG  82           HG2      ARG  82 -16.649 -11.266  -1.941
  659    HG3  ARG  82           HG3      ARG  82 -17.175  -9.647  -1.473
  660    HD2  ARG  82           HD2      ARG  82 -18.903 -12.141  -1.469
  661    HD3  ARG  82           HD3      ARG  82 -18.104 -11.467  -0.036
  662    HE   ARG  82           HE       ARG  82 -19.595  -9.360  -1.076
  663   HH11  ARG  82          HH21      ARG  82 -20.325 -12.589   0.227
  664   HH12  ARG  82          HH22      ARG  82 -21.915 -12.173   0.754
  665   HH21  ARG  82          HH11      ARG  82 -21.728  -8.814  -0.398
  666   HH22  ARG  82          HH12      ARG  82 -22.725  -9.980   0.394
  667    H    LEU  83           H        LEU  83 -14.708  -9.743  -3.242
  668    HA   LEU  83           HA       LEU  83 -14.976  -6.834  -3.004
  669    HB2  LEU  83           HB2      LEU  83 -12.801  -8.671  -1.985
  670    HB3  LEU  83           HB3      LEU  83 -13.024  -6.980  -1.548
  671    HG   LEU  83           HG       LEU  83 -14.925  -9.254  -0.901
  672   HD11  LEU  83          HD11      LEU  83 -13.229  -7.617   1.007
  673   HD12  LEU  83          HD12      LEU  83 -14.226  -9.050   1.376
  674   HD13  LEU  83          HD13      LEU  83 -12.778  -9.214   0.378
  675   HD21  LEU  83          HD21      LEU  83 -15.191  -6.328  -0.181
  676   HD22  LEU  83          HD22      LEU  83 -16.288  -7.303  -1.194
  677   HD23  LEU  83          HD23      LEU  83 -16.150  -7.650   0.527
  678    H    VAL  84           H        VAL  84 -13.387  -9.098  -5.092
  679    HA   VAL  84           HA       VAL  84 -11.056  -7.557  -5.711
  680    HB   VAL  84           HB       VAL  84 -12.512  -9.659  -7.396
  681   HG11  VAL  84          HG11      VAL  84 -10.947  -8.520  -8.808
  682   HG12  VAL  84          HG12      VAL  84  -9.713  -8.494  -7.528
  683   HG13  VAL  84          HG13      VAL  84 -10.148 -10.014  -8.311
  684   HG21  VAL  84          HG21      VAL  84 -11.221 -11.363  -6.506
  685   HG22  VAL  84          HG22      VAL  84 -10.068 -10.246  -5.711
  686   HG23  VAL  84          HG23      VAL  84 -11.696 -10.461  -5.052
  687    H    ARG  85           H        ARG  85 -10.808  -5.849  -7.136
  688    HA   ARG  85           HA       ARG  85 -13.050  -5.152  -8.939
  689    HB2  ARG  85           HB2      ARG  85 -11.227  -3.578  -7.261
  690    HB3  ARG  85           HB3      ARG  85 -11.256  -3.037  -8.942
  691    HG2  ARG  85           HG2      ARG  85 -13.752  -3.623  -7.372
  692    HG3  ARG  85           HG3      ARG  85 -13.027  -2.006  -7.418
  693    HD2  ARG  85           HD2      ARG  85 -13.803  -3.544  -9.948
  694    HD3  ARG  85           HD3      ARG  85 -14.954  -2.515  -9.098
  695    HE   ARG  85           HE       ARG  85 -12.829  -1.698 -10.868
  696   HH11  ARG  85          HH21      ARG  85 -14.754  -0.512  -8.116
  697   HH12  ARG  85          HH22      ARG  85 -14.558   1.148  -8.538
  698   HH21  ARG  85          HH11      ARG  85 -12.589   0.453 -11.443
  699   HH22  ARG  85          HH12      ARG  85 -13.282   1.720 -10.471
  700    H    TRP  86           H        TRP  86 -12.713  -6.669 -10.455
  701    HA   TRP  86           HA       TRP  86 -10.184  -7.291 -11.589
  702    HB2  TRP  86           HB2      TRP  86 -13.066  -7.581 -12.469
  703    HB3  TRP  86           HB3      TRP  86 -11.736  -8.259 -13.415
  704    HD1  TRP  86           HD1      TRP  86 -14.056  -9.274 -10.791
  705    HE1  TRP  86           HE1      TRP  86 -13.298 -11.383  -9.570
  706    HE3  TRP  86           HE3      TRP  86  -9.215  -9.457 -12.453
  707    HZ2  TRP  86           HZ2      TRP  86 -10.811 -12.837  -9.164
  708    HZ3  TRP  86           HZ3      TRP  86  -7.669 -11.202 -11.615
  709    HH2  TRP  86           HH2      TRP  86  -8.453 -12.896  -9.978
  710    H    ASP  87           H        ASP  87 -11.887  -4.406 -11.940
  711    HA   ASP  87           HA       ASP  87 -11.019  -3.805 -14.701
  712    HB2  ASP  87           HB2      ASP  87 -13.103  -2.893 -14.346
  713    HB3  ASP  87           HB3      ASP  87 -12.832  -2.615 -12.634
  714    H    THR  88           H        THR  88  -9.832  -3.551 -11.405
  715    HA   THR  88           HA       THR  88  -8.486  -1.058 -11.865
  716    HB   THR  88           HB       THR  88  -7.595  -1.458  -9.586
  717    HG1  THR  88           HG1      THR  88  -9.156  -3.794  -9.585
  718   HG21  THR  88          HG21      THR  88  -9.343  -0.054  -9.997
  719   HG22  THR  88          HG22      THR  88 -10.549  -1.386 -10.088
  720   HG23  THR  88          HG23      THR  88  -9.780  -0.990  -8.529
  721    H    LYS  89           H        LYS  89  -6.347  -0.657 -11.480
  722    HA   LYS  89           HA       LYS  89  -4.587  -2.752 -12.575
  723    HB2  LYS  89           HB2      LYS  89  -4.692   0.122 -13.462
  724    HB3  LYS  89           HB3      LYS  89  -3.468  -1.046 -13.975
  725    HG2  LYS  89           HG2      LYS  89  -6.448  -1.436 -14.342
  726    HG3  LYS  89           HG3      LYS  89  -5.406  -0.706 -15.567
  727    HD2  LYS  89           HD2      LYS  89  -4.086  -2.756 -15.764
  728    HD3  LYS  89           HD3      LYS  89  -5.027  -3.560 -14.510
  729    HE2  LYS  89           HE2      LYS  89  -6.167  -2.542 -17.148
  730    HE3  LYS  89           HE3      LYS  89  -5.649  -4.204 -16.839
  731    HZ1  LYS  89           HZ1      LYS  89  -7.878  -2.834 -15.427
  732    HZ2  LYS  89           HZ2      LYS  89  -8.009  -4.013 -16.549
  733    HZ3  LYS  89           HZ3      LYS  89  -7.341  -4.354 -15.098
  734    HA   PRO  90           HA       PRO  90  -3.356  -4.026 -11.863
  735    HB2  PRO  90           HB2      PRO  90  -1.813  -5.348 -10.093
  736    HB3  PRO  90           HB3      PRO  90  -1.107  -4.384 -11.428
  737    HG2  PRO  90           HG2      PRO  90  -1.454  -3.573  -8.529
  738    HG3  PRO  90           HG3      PRO  90  -0.007  -3.385  -9.561
  739    HD2  PRO  90           HD2      PRO  90  -1.843  -1.369  -9.134
  740    HD3  PRO  90           HD3      PRO  90  -0.916  -1.527 -10.658
  741    H    VAL  91           H        VAL  91  -5.007  -5.436 -11.174
  742    HA   VAL  91           HA       VAL  91  -6.645  -4.640  -9.028
  743    HB   VAL  91           HB       VAL  91  -7.690  -5.714 -10.839
  744   HG11  VAL  91          HG11      VAL  91  -5.831  -6.832 -11.946
  745   HG12  VAL  91          HG12      VAL  91  -5.729  -8.034 -10.633
  746   HG13  VAL  91          HG13      VAL  91  -7.146  -7.979 -11.703
  747   HG21  VAL  91          HG21      VAL  91  -8.579  -6.508  -8.652
  748   HG22  VAL  91          HG22      VAL  91  -8.812  -7.683  -9.957
  749   HG23  VAL  91          HG23      VAL  91  -7.537  -7.944  -8.776
  750    H    CYS  92           H        CYS  92  -6.878  -5.178  -6.972
  751    HA   CYS  92           HA       CYS  92  -4.810  -6.706  -5.623
  752    HB2  CYS  92           HB2      CYS  92  -6.122  -4.740  -4.606
  753    HB3  CYS  92           HB3      CYS  92  -7.520  -5.813  -4.537
  754    HG   CYS  92           HG       CYS  92  -6.469  -5.659  -2.160
  755    H    ILE  93           H        ILE  93  -4.843  -8.941  -5.548
  756    HA   ILE  93           HA       ILE  93  -7.542 -10.210  -5.342
  757    HB   ILE  93           HB       ILE  93  -6.962 -12.109  -6.466
  758   HG12  ILE  93          HG12      ILE  93  -4.738 -12.638  -5.764
  759   HG13  ILE  93          HG13      ILE  93  -4.843 -12.666  -7.513
  760   HG21  ILE  93          HG21      ILE  93  -6.551 -11.363  -8.735
  761   HG22  ILE  93          HG22      ILE  93  -7.607 -10.227  -7.876
  762   HG23  ILE  93          HG23      ILE  93  -5.903  -9.816  -8.159
  763   HD11  ILE  93          HD11      ILE  93  -3.753 -10.357  -7.525
  764   HD12  ILE  93          HD12      ILE  93  -3.484 -10.586  -5.774
  765   HD13  ILE  93          HD13      ILE  93  -2.749 -11.687  -6.936
  766    H    GLY  94           H        GLY  94  -4.533  -9.683  -3.679
  767    HA2  GLY  94           HA2      GLY  94  -5.549 -10.874  -1.340
  768    HA3  GLY  94           HA3      GLY  94  -4.426 -12.013  -2.115
  769    H    GLN  95           H        GLN  95  -3.545 -11.321   0.167
  770    HA   GLN  95           HA       GLN  95  -1.203  -9.652  -0.433
  771    HB2  GLN  95           HB2      GLN  95  -1.342  -8.795   2.018
  772    HB3  GLN  95           HB3      GLN  95  -2.252  -7.985   0.775
  773    HG2  GLN  95           HG2      GLN  95  -3.607 -10.086   2.453
  774    HG3  GLN  95           HG3      GLN  95  -3.354  -8.463   3.086
  775   HE21  GLN  95          HE22      GLN  95  -5.564 -10.337   1.330
  776   HE22  GLN  95          HE21      GLN  95  -6.424  -9.018   0.543
  777    H    LYS  96           H        LYS  96   0.609 -10.144   0.857
  778    HA   LYS  96           HA       LYS  96   0.502 -12.829   2.189
  779    HB2  LYS  96           HB2      LYS  96   2.947 -12.838   2.064
  780    HB3  LYS  96           HB3      LYS  96   2.202 -12.760   0.472
  781    HG2  LYS  96           HG2      LYS  96   2.673 -10.369   0.306
  782    HG3  LYS  96           HG3      LYS  96   3.395 -10.355   1.926
  783    HD2  LYS  96           HD2      LYS  96   4.446 -11.965  -0.435
  784    HD3  LYS  96           HD3      LYS  96   5.011 -10.350   0.010
  785    HE2  LYS  96           HE2      LYS  96   5.708 -11.236   2.275
  786    HE3  LYS  96           HE3      LYS  96   5.240 -12.861   1.752
  787    HZ1  LYS  96           HZ1      LYS  96   7.616 -12.479   1.436
  788    HZ2  LYS  96           HZ2      LYS  96   6.922 -12.692  -0.025
  789    HZ3  LYS  96           HZ3      LYS  96   7.351 -11.190   0.473
  790    H    GLN  97           H        GLN  97   0.737 -12.827   4.473
  791    HA   GLN  97           HA       GLN  97   1.199 -10.154   5.678
  792    HB2  GLN  97           HB2      GLN  97  -1.236 -10.958   5.479
  793    HB3  GLN  97           HB3      GLN  97  -0.825 -12.096   6.771
  794    HG2  GLN  97           HG2      GLN  97  -0.135 -10.160   8.211
  795    HG3  GLN  97           HG3      GLN  97  -0.440  -9.061   6.874
  796   HE21  GLN  97          HE22      GLN  97  -2.022  -7.856   8.011
  797   HE22  GLN  97          HE21      GLN  97  -3.527  -8.547   8.611
  798    H    LYS  98           H        LYS  98   2.715 -10.086   7.233
  799    HA   LYS  98           HA       LYS  98   3.604 -12.664   8.493
  800    HB2  LYS  98           HB2      LYS  98   5.283 -11.623   7.077
  801    HB3  LYS  98           HB3      LYS  98   5.110 -10.069   7.932
  802    HG2  LYS  98           HG2      LYS  98   6.254 -10.822   9.773
  803    HG3  LYS  98           HG3      LYS  98   5.956 -12.543   9.452
  804    HD2  LYS  98           HD2      LYS  98   7.675 -10.852   7.623
  805    HD3  LYS  98           HD3      LYS  98   8.355 -11.545   9.083
  806    HE2  LYS  98           HE2      LYS  98   6.878 -13.357   7.137
  807    HE3  LYS  98           HE3      LYS  98   8.473 -12.755   6.698
  808    HZ1  LYS  98           HZ1      LYS  98   9.382 -13.731   8.739
  809    HZ2  LYS  98           HZ2      LYS  98   7.924 -14.370   9.154
  810    HZ3  LYS  98           HZ3      LYS  98   8.692 -14.867   7.804
  811    H    TRP  99           H        TRP  99   3.758 -12.673  10.799
  812    HA   TRP  99           HA       TRP  99   2.403 -10.354  12.111
  813    HB2  TRP  99           HB2      TRP  99   1.889 -13.324  12.367
  814    HB3  TRP  99           HB3      TRP  99   1.312 -12.125  13.522
  815    HD1  TRP  99           HD1      TRP  99   0.818 -13.142   9.834
  816    HE1  TRP  99           HE1      TRP  99  -1.517 -12.337   9.096
  817    HE3  TRP  99           HE3      TRP  99  -0.462 -10.436  13.980
  818    HZ2  TRP  99           HZ2      TRP  99  -3.638 -10.728  10.172
  819    HZ3  TRP  99           HZ3      TRP  99  -2.605  -9.222  14.074
  820    HH2  TRP  99           HH2      TRP  99  -4.203  -9.340  12.139
  821    H    PHE 100           H        PHE 100   2.888 -10.027  14.327
  822    HA   PHE 100           HA       PHE 100   5.417 -11.288  15.288
  823    HB2  PHE 100           HB2      PHE 100   4.687  -8.329  15.128
  824    HB3  PHE 100           HB3      PHE 100   6.090  -8.982  15.965
  825    HD1  PHE 100           HD2      PHE 100   4.520  -8.515  12.582
  826    HD2  PHE 100           HD1      PHE 100   8.135  -9.393  14.791
  827    HE1  PHE 100           HE2      PHE 100   5.852  -8.337  10.509
  828    HE2  PHE 100           HE1      PHE 100   9.443  -9.248  12.708
  829    HZ   PHE 100           HZ       PHE 100   8.316  -8.748  10.567
  830    H    LEU 101           H        LEU 101   5.148 -11.943  17.390
  831    HA   LEU 101           HA       LEU 101   2.890 -10.832  19.000
  832    HB2  LEU 101           HB2      LEU 101   2.763 -13.173  19.237
  833    HB3  LEU 101           HB3      LEU 101   4.519 -13.355  19.243
  834    HG   LEU 101           HG       LEU 101   4.626 -12.344  21.490
  835   HD11  LEU 101          HD11      LEU 101   2.468 -10.963  21.310
  836   HD12  LEU 101          HD12      LEU 101   1.603 -12.479  21.643
  837   HD13  LEU 101          HD13      LEU 101   2.770 -11.805  22.818
  838   HD21  LEU 101          HD21      LEU 101   3.754 -14.201  22.777
  839   HD22  LEU 101          HD22      LEU 101   2.681 -14.691  21.455
  840   HD23  LEU 101          HD23      LEU 101   4.438 -14.833  21.275
  841    H    LEU 102           H        LEU 102   3.462  -9.194  20.312
  842    HA   LEU 102           HA       LEU 102   6.281  -9.122  21.243
  843    HB2  LEU 102           HB2      LEU 102   4.650  -6.616  21.309
  844    HB3  LEU 102           HB3      LEU 102   6.376  -6.803  21.179
  845    HG   LEU 102           HG       LEU 102   4.397  -7.252  18.918
  846   HD11  LEU 102          HD11      LEU 102   6.298  -4.920  19.340
  847   HD12  LEU 102          HD12      LEU 102   5.069  -5.113  18.073
  848   HD13  LEU 102          HD13      LEU 102   4.559  -4.884  19.750
  849   HD21  LEU 102          HD21      LEU 102   7.440  -7.074  18.956
  850   HD22  LEU 102          HD22      LEU 102   6.485  -8.527  18.565
  851   HD23  LEU 102          HD23      LEU 102   6.444  -7.125  17.482
  852    H    GLN 103           H        GLN 103   6.490  -8.694  23.549
  853    HA   GLN 103           HA       GLN 103   3.845  -8.727  24.979
  854    HB2  GLN 103           HB2      GLN 103   5.064 -10.409  25.794
  855    HB3  GLN 103           HB3      GLN 103   6.600  -9.512  25.858
  856    HG2  GLN 103           HG2      GLN 103   6.010  -8.501  27.907
  857    HG3  GLN 103           HG3      GLN 103   4.301  -8.398  27.488
  858   HE21  GLN 103          HE22      GLN 103   2.929 -10.380  27.592
  859   HE22  GLN 103          HE21      GLN 103   3.363 -11.571  28.816
  860    H    LEU 104           H        LEU 104   3.125  -6.878  25.854
  861    HA   LEU 104           HA       LEU 104   4.403  -4.339  25.519
  862    HB2  LEU 104           HB2      LEU 104   1.843  -5.460  26.359
  863    HB3  LEU 104           HB3      LEU 104   2.372  -4.353  27.610
  864    HG   LEU 104           HG       LEU 104   2.241  -3.680  24.651
  865   HD11  LEU 104          HD11      LEU 104   0.197  -2.459  25.124
  866   HD12  LEU 104          HD12      LEU 104  -0.011  -4.169  25.502
  867   HD13  LEU 104          HD13      LEU 104   0.226  -3.000  26.819
  868   HD21  LEU 104          HD21      LEU 104   2.864  -2.063  27.147
  869   HD22  LEU 104          HD22      LEU 104   3.758  -2.191  25.625
  870   HD23  LEU 104          HD23      LEU 104   2.234  -1.299  25.677
  871    H    VAL 105           H        VAL 105   5.634  -3.133  27.005
  872    HA   VAL 105           HA       VAL 105   6.959  -4.798  29.002
  873    HB   VAL 105           HB       VAL 105   7.533  -2.073  27.842
  874   HG11  VAL 105          HG11      VAL 105   9.277  -3.660  29.765
  875   HG12  VAL 105          HG12      VAL 105   9.785  -2.219  28.852
  876   HG13  VAL 105          HG13      VAL 105   8.517  -2.084  30.078
  877   HG21  VAL 105          HG21      VAL 105   9.144  -4.619  27.497
  878   HG22  VAL 105          HG22      VAL 105   7.858  -4.164  26.378
  879   HG23  VAL 105          HG23      VAL 105   9.255  -3.103  26.548
  880    H    SER 106           H        SER 106   5.230  -1.641  28.996
  881    HA   SER 106           HA       SER 106   5.224  -1.608  31.953
  882    HB2  SER 106           HB2      SER 106   4.059   0.291  29.888
  883    HB3  SER 106           HB3      SER 106   4.044   0.553  31.634
  884    HG   SER 106           HG       SER 106   6.210   0.521  29.831
  885    H    GLY 107           H        GLY 107   3.152  -2.620  29.349
  886    HA2  GLY 107           HA2      GLY 107   1.334  -4.188  29.804
  887    HA3  GLY 107           HA3      GLY 107   0.988  -3.303  31.295
  888    H    ASP 108           H        ASP 108  -1.191  -3.328  30.246
  889    HA   ASP 108           HA       ASP 108  -1.821  -2.192  27.843
  890    HB2  ASP 108           HB2      ASP 108  -4.022  -2.467  28.460
  891    HB3  ASP 108           HB3      ASP 108  -3.186  -3.642  29.464
  892    H    ALA 109           H        ALA 109  -1.116  -0.565  30.786
  893    HA   ALA 109           HA       ALA 109  -2.282   1.951  30.501
  894    HB1  ALA 109           HB1      ALA 109  -0.938   1.229  32.468
  895    HB2  ALA 109           HB2      ALA 109   0.541   1.295  31.472
  896    HB3  ALA 109           HB3      ALA 109  -0.364   2.780  31.821
  897    H    GLU 110           H        GLU 110   0.419   0.606  28.632
  898    HA   GLU 110           HA       GLU 110   0.993   3.242  27.559
  899    HB2  GLU 110           HB2      GLU 110   2.546   0.671  27.673
  900    HB3  GLU 110           HB3      GLU 110   2.998   1.874  26.462
  901    HG2  GLU 110           HG2      GLU 110   2.755   2.464  29.427
  902    HG3  GLU 110           HG3      GLU 110   4.268   2.071  28.598
  903    H    ILE 111           H        ILE 111  -1.321   1.633  26.812
  904    HA   ILE 111           HA       ILE 111  -1.044   1.536  23.841
  905    HB   ILE 111           HB       ILE 111  -3.456   0.846  25.569
  906   HG12  ILE 111          HG12      ILE 111  -1.629  -1.070  24.040
  907   HG13  ILE 111          HG13      ILE 111  -1.448  -0.766  25.766
  908   HG21  ILE 111          HG21      ILE 111  -4.363  -0.100  23.438
  909   HG22  ILE 111          HG22      ILE 111  -4.043   1.613  23.270
  910   HG23  ILE 111          HG23      ILE 111  -2.901   0.432  22.589
  911   HD11  ILE 111          HD11      ILE 111  -3.993  -1.911  24.554
  912   HD12  ILE 111          HD12      ILE 111  -2.701  -2.842  25.303
  913   HD13  ILE 111          HD13      ILE 111  -3.635  -1.681  26.264
  914    H    ASN 112           H        ASN 112  -1.917   3.212  22.568
  915    HA   ASN 112           HA       ASN 112  -3.558   5.294  23.902
  916    HB2  ASN 112           HB2      ASN 112  -1.332   6.276  23.984
  917    HB3  ASN 112           HB3      ASN 112  -1.045   5.872  22.284
  918   HD21  ASN 112          HD22      ASN 112  -0.678   8.297  21.991
  919   HD22  ASN 112          HD21      ASN 112  -2.115   9.276  21.740
  920    H    MET 113           H        MET 113  -5.415   4.918  22.804
  921    HA   MET 113           HA       MET 113  -5.357   4.128  19.994
  922    HB2  MET 113           HB2      MET 113  -7.568   4.476  22.048
  923    HB3  MET 113           HB3      MET 113  -7.903   4.092  20.355
  924    HG2  MET 113           HG2      MET 113  -6.006   2.470  22.089
  925    HG3  MET 113           HG3      MET 113  -7.717   2.070  21.850
  926    HE1  MET 113           HE1      MET 113  -5.386  -0.449  19.599
  927    HE2  MET 113           HE2      MET 113  -4.700   0.467  20.960
  928    HE3  MET 113           HE3      MET 113  -6.277  -0.353  21.150
  929    H    GLN 114           H        GLN 114  -4.833   7.123  21.187
  930    HA   GLN 114           HA       GLN 114  -6.197   8.492  18.988
  931    HB2  GLN 114           HB2      GLN 114  -6.154   9.422  21.863
  932    HB3  GLN 114           HB3      GLN 114  -6.408  10.460  20.439
  933    HG2  GLN 114           HG2      GLN 114  -8.369   9.146  19.793
  934    HG3  GLN 114           HG3      GLN 114  -8.193   8.123  21.227
  935   HE21  GLN 114          HE22      GLN 114  -8.902  11.483  20.096
  936   HE22  GLN 114          HE21      GLN 114  -9.685  11.987  21.575
  937    H    THR 115           H        THR 115  -4.201   7.953  18.179
  938    HA   THR 115           HA       THR 115  -1.715   9.256  18.935
  939    HB   THR 115           HB       THR 115  -1.267   8.437  16.484
  940    HG1  THR 115           HG1      THR 115  -2.709   6.825  15.793
  941   HG21  THR 115          HG21      THR 115  -0.417   7.272  18.535
  942   HG22  THR 115          HG22      THR 115  -2.013   6.510  18.770
  943   HG23  THR 115          HG23      THR 115  -0.991   6.075  17.371
  944    H    SER 116           H        SER 116  -3.858   9.369  16.159
  945    HA   SER 116           HA       SER 116  -3.626  12.220  15.611
  946    HB2  SER 116           HB2      SER 116  -5.659  10.128  14.705
  947    HB3  SER 116           HB3      SER 116  -5.459  11.745  14.005
  948    HG   SER 116           HG       SER 116  -4.336  10.027  12.852
  949    H    SER 117           H        SER 117  -5.688  13.672  15.742
  950    HA   SER 117           HA       SER 117  -6.736  13.720  18.374
  951    HB2  SER 117           HB2      SER 117  -7.965  14.967  15.883
  952    HB3  SER 117           HB3      SER 117  -8.144  15.505  17.561
  953    HG   SER 117           HG       SER 117  -6.586  16.759  16.416
  954    H    THR 118           H        THR 118  -7.986  12.432  15.292
  955    HA   THR 118           HA       THR 118 -10.414  11.317  16.266
  956    HB   THR 118           HB       THR 118  -9.479   9.907  14.084
  957    HG1  THR 118           HG1      THR 118  -8.971  11.528  12.591
  958   HG21  THR 118          HG21      THR 118 -11.761  10.375  14.576
  959   HG22  THR 118          HG22      THR 118 -11.515  12.123  14.280
  960   HG23  THR 118          HG23      THR 118 -11.374  10.943  12.944
  961    HA   PRO 119           HA       PRO 119  -8.444   7.717  18.100
  962    HB2  PRO 119           HB2      PRO 119 -11.212   6.576  17.775
  963    HB3  PRO 119           HB3      PRO 119 -10.136   6.532  19.211
  964    HG2  PRO 119           HG2      PRO 119 -12.246   8.257  19.104
  965    HG3  PRO 119           HG3      PRO 119 -10.669   8.778  19.777
  966    HD2  PRO 119           HD2      PRO 119 -11.781   9.311  16.995
  967    HD3  PRO 119           HD3      PRO 119 -10.918  10.422  18.107
  968    H    GLU 120           H        GLU 120  -7.559   5.914  17.137
  969    HA   GLU 120           HA       GLU 120  -8.274   5.341  14.318
  970    HB2  GLU 120           HB2      GLU 120  -6.014   4.350  16.104
  971    HB3  GLU 120           HB3      GLU 120  -6.279   3.774  14.460
  972    HG2  GLU 120           HG2      GLU 120  -5.766   6.671  15.262
  973    HG3  GLU 120           HG3      GLU 120  -4.600   5.584  14.536
  974    H    PHE 121           H        PHE 121  -9.007   4.095  17.481
  975    HA   PHE 121           HA       PHE 121 -10.585   1.963  16.173
  976    HB2  PHE 121           HB2      PHE 121  -8.937   1.664  18.684
  977    HB3  PHE 121           HB3      PHE 121 -10.228   0.572  18.233
  978    HD1  PHE 121           HD2      PHE 121  -6.849   1.806  17.206
  979    HD2  PHE 121           HD1      PHE 121  -9.945  -1.101  16.504
  980    HE1  PHE 121           HE2      PHE 121  -5.285   0.413  15.950
  981    HE2  PHE 121           HE1      PHE 121  -8.409  -2.405  15.092
  982    HZ   PHE 121           HZ       PHE 121  -6.044  -1.674  14.824
  983    H    ASP 122           H        ASP 122 -12.592   1.629  17.064
  984    HA   ASP 122           HA       ASP 122 -13.798   3.881  18.523
  985    HB2  ASP 122           HB2      ASP 122 -15.044   2.922  16.676
  986    HB3  ASP 122           HB3      ASP 122 -14.853   1.292  17.322
  987    H    GLY 123           H        GLY 123 -12.632   0.557  19.087
  988    HA2  GLY 123           HA2      GLY 123 -12.933   0.887  21.983
  989    HA3  GLY 123           HA3      GLY 123 -13.912  -0.399  21.236
  990    H    TRP 124           H        TRP 124 -11.709  -0.767  23.136
  991    HA   TRP 124           HA       TRP 124 -10.441  -2.852  21.593
  992    HB2  TRP 124           HB2      TRP 124  -8.394  -2.046  21.406
  993    HB3  TRP 124           HB3      TRP 124  -8.911  -0.507  22.048
  994    HD1  TRP 124           HD1      TRP 124  -7.363  -3.839  23.189
  995    HE1  TRP 124           HE1      TRP 124  -6.151  -3.521  25.400
  996    HE3  TRP 124           HE3      TRP 124  -8.522   1.081  24.015
  997    HZ2  TRP 124           HZ2      TRP 124  -5.739  -1.364  27.338
  998    HZ3  TRP 124           HZ3      TRP 124  -7.663   2.252  26.027
  999    HH2  TRP 124           HH2      TRP 124  -6.284   1.031  27.696
 1000    H    ARG 125           H        ARG 125  -9.717  -4.580  22.909
 1001    HA   ARG 125           HA       ARG 125 -10.346  -4.536  25.774
 1002    HB2  ARG 125           HB2      ARG 125 -11.942  -6.386  25.638
 1003    HB3  ARG 125           HB3      ARG 125 -12.524  -5.013  24.701
 1004    HG2  ARG 125           HG2      ARG 125 -11.570  -6.174  22.620
 1005    HG3  ARG 125           HG3      ARG 125 -11.306  -7.597  23.614
 1006    HD2  ARG 125           HD2      ARG 125 -14.011  -6.222  23.255
 1007    HD3  ARG 125           HD3      ARG 125 -13.432  -7.557  22.251
 1008    HE   ARG 125           HE       ARG 125 -13.437  -8.063  25.151
 1009   HH11  ARG 125          HH11      ARG 125 -15.437  -8.221  22.208
 1010   HH12  ARG 125          HH12      ARG 125 -16.327  -9.615  22.734
 1011   HH21  ARG 125          HH21      ARG 125 -14.739  -9.824  25.894
 1012   HH22  ARG 125          HH22      ARG 125 -16.001 -10.452  24.899
 1013    H    TRP 126           H        TRP 126  -9.793  -6.788  26.692
 1014    HA   TRP 126           HA       TRP 126  -7.620  -8.091  25.125
 1015    HB2  TRP 126           HB2      TRP 126  -7.819  -7.633  28.118
 1016    HB3  TRP 126           HB3      TRP 126  -6.690  -8.741  27.366
 1017    HD1  TRP 126           HD1      TRP 126  -7.349  -4.950  27.654
 1018    HE1  TRP 126           HE1      TRP 126  -5.128  -3.760  27.555
 1019    HE3  TRP 126           HE3      TRP 126  -4.382  -8.885  26.226
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.372  -4.390  26.933
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.960  -8.535  25.874
 1022    HH2  TRP 126           HH2      TRP 126  -0.936  -6.287  26.258
 1023    H    VAL 127           H        VAL 127  -7.865 -10.325  24.903
 1024    HA   VAL 127           HA       VAL 127 -10.192 -11.686  26.186
 1025    HB   VAL 127           HB       VAL 127 -10.621 -12.551  23.763
 1026   HG11  VAL 127          HG11      VAL 127 -11.374  -9.711  24.568
 1027   HG12  VAL 127          HG12      VAL 127 -12.172 -10.651  23.297
 1028   HG13  VAL 127          HG13      VAL 127 -12.237 -11.208  24.981
 1029   HG21  VAL 127          HG21      VAL 127  -9.277  -9.941  22.992
 1030   HG22  VAL 127          HG22      VAL 127  -8.648 -11.571  22.672
 1031   HG23  VAL 127          HG23      VAL 127 -10.163 -11.048  21.922
 1032    H    SER 128           H        SER 128 -10.045 -14.045  26.081
 1033    HA   SER 128           HA       SER 128  -7.439 -15.197  26.091
 1034    HB2  SER 128           HB2      SER 128 -10.155 -16.469  25.563
 1035    HB3  SER 128           HB3      SER 128  -8.696 -17.311  26.133
 1036    HG   SER 128           HG       SER 128 -10.130 -16.782  27.868
 1037    H    TYR 129           H        TYR 129  -6.309 -16.356  24.422
 1038    HA   TYR 129           HA       TYR 129  -6.472 -15.142  21.935
 1039    HB2  TYR 129           HB2      TYR 129  -4.948 -17.234  21.269
 1040    HB3  TYR 129           HB3      TYR 129  -4.398 -15.869  22.189
 1041    HD1  TYR 129           HD1      TYR 129  -6.077 -19.174  22.933
 1042    HD2  TYR 129           HD2      TYR 129  -2.950 -16.361  23.947
 1043    HE1  TYR 129           HE1      TYR 129  -5.312 -20.683  24.726
 1044    HE2  TYR 129           HE2      TYR 129  -2.172 -17.896  25.729
 1045    HH   TYR 129           HH       TYR 129  -3.765 -21.027  26.465
 1046    H    TRP 130           H        TRP 130  -8.301 -18.065  22.807
 1047    HA   TRP 130           HA       TRP 130  -8.817 -18.569  19.949
 1048    HB2  TRP 130           HB2      TRP 130  -9.977 -19.958  22.370
 1049    HB3  TRP 130           HB3      TRP 130 -10.058 -20.498  20.693
 1050    HD1  TRP 130           HD1      TRP 130  -8.436 -21.548  23.576
 1051    HE1  TRP 130           HE1      TRP 130  -6.135 -22.602  23.208
 1052    HE3  TRP 130           HE3      TRP 130  -7.500 -19.888  18.782
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.086 -22.577  21.222
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.363 -20.466  17.686
 1055    HH2  TRP 130           HH2      TRP 130  -3.623 -21.758  18.911
 1056    H    TYR 131           H        TYR 131 -10.207 -16.448  22.242
 1057    HA   TYR 131           HA       TYR 131 -12.946 -16.675  21.335
 1058    HB2  TYR 131           HB2      TYR 131 -12.504 -15.936  23.532
 1059    HB3  TYR 131           HB3      TYR 131 -11.483 -14.610  22.969
 1060    HD1  TYR 131           HD2      TYR 131 -12.477 -12.604  21.845
 1061    HD2  TYR 131           HD1      TYR 131 -14.945 -15.721  23.535
 1062    HE1  TYR 131           HE2      TYR 131 -14.422 -11.099  21.773
 1063    HE2  TYR 131           HE1      TYR 131 -16.894 -14.200  23.488
 1064    HH   TYR 131           HH       TYR 131 -17.688 -12.063  22.933
 1065    HA   PRO 132           HA       PRO 132 -12.089 -12.632  18.922
 1066    HB2  PRO 132           HB2      PRO 132  -9.605 -12.186  17.800
 1067    HB3  PRO 132           HB3      PRO 132 -10.121 -11.594  19.415
 1068    HG2  PRO 132           HG2      PRO 132  -8.524 -14.087  18.791
 1069    HG3  PRO 132           HG3      PRO 132  -8.159 -12.794  19.984
 1070    HD2  PRO 132           HD2      PRO 132  -9.368 -15.039  20.743
 1071    HD3  PRO 132           HD3      PRO 132  -9.941 -13.484  21.403
 1072    H    VAL 133           H        VAL 133 -10.598 -15.674  18.064
 1073    HA   VAL 133           HA       VAL 133 -10.781 -15.491  15.213
 1074    HB   VAL 133           HB       VAL 133 -10.974 -18.025  16.890
 1075   HG11  VAL 133          HG11      VAL 133  -9.674 -17.528  14.170
 1076   HG12  VAL 133          HG12      VAL 133  -9.801 -19.085  15.020
 1077   HG13  VAL 133          HG13      VAL 133 -11.255 -18.298  14.420
 1078   HG21  VAL 133          HG21      VAL 133  -8.405 -16.534  16.162
 1079   HG22  VAL 133          HG22      VAL 133  -9.019 -16.823  17.807
 1080   HG23  VAL 133          HG23      VAL 133  -8.487 -18.182  16.839
 1081    H    ARG 134           H        ARG 134 -13.165 -16.151  17.802
 1082    HA   ARG 134           HA       ARG 134 -14.964 -17.603  16.083
 1083    HB2  ARG 134           HB2      ARG 134 -15.734 -16.130  18.623
 1084    HB3  ARG 134           HB3      ARG 134 -16.541 -17.500  17.876
 1085    HG2  ARG 134           HG2      ARG 134 -14.014 -17.460  19.516
 1086    HG3  ARG 134           HG3      ARG 134 -15.507 -18.330  19.805
 1087    HD2  ARG 134           HD2      ARG 134 -14.952 -19.786  17.809
 1088    HD3  ARG 134           HD3      ARG 134 -13.415 -18.913  17.686
 1089    HE   ARG 134           HE       ARG 134 -12.625 -19.811  19.651
 1090   HH11  ARG 134          HH11      ARG 134 -15.907 -21.074  19.028
 1091   HH12  ARG 134          HH12      ARG 134 -15.750 -22.408  20.108
 1092   HH21  ARG 134          HH21      ARG 134 -12.424 -21.640  21.078
 1093   HH22  ARG 134          HH22      ARG 134 -13.744 -22.727  21.298
 1094    H    GLN 135           H        GLN 135 -14.371 -14.156  16.522
 1095    HA   GLN 135           HA       GLN 135 -17.096 -13.432  15.665
 1096    HB2  GLN 135           HB2      GLN 135 -14.623 -11.741  16.155
 1097    HB3  GLN 135           HB3      GLN 135 -16.139 -11.099  15.549
 1098    HG2  GLN 135           HG2      GLN 135 -16.417 -10.630  17.745
 1099    HG3  GLN 135           HG3      GLN 135 -17.238 -12.185  17.663
 1100   HE21  GLN 135          HE22      GLN 135 -16.344 -13.928  18.942
 1101   HE22  GLN 135          HE21      GLN 135 -14.816 -13.798  19.793
 1102    H    VAL 136           H        VAL 136 -14.015 -13.922  13.997
 1103    HA   VAL 136           HA       VAL 136 -14.846 -12.252  11.761
 1104    HB   VAL 136           HB       VAL 136 -12.578 -13.022  10.863
 1105   HG11  VAL 136          HG11      VAL 136 -12.688 -11.466  13.475
 1106   HG12  VAL 136          HG12      VAL 136 -11.410 -11.385  12.235
 1107   HG13  VAL 136          HG13      VAL 136 -13.039 -10.809  11.869
 1108   HG21  VAL 136          HG21      VAL 136 -10.930 -13.878  12.320
 1109   HG22  VAL 136          HG22      VAL 136 -11.992 -13.794  13.739
 1110   HG23  VAL 136          HG23      VAL 136 -12.293 -14.993  12.467
 1111    H    VAL 137           H        VAL 137 -14.491 -13.063   9.452
 1112    HA   VAL 137           HA       VAL 137 -16.350 -15.288   9.030
 1113    HB   VAL 137           HB       VAL 137 -16.576 -14.489   6.837
 1114   HG11  VAL 137          HG11      VAL 137 -16.005 -11.923   8.359
 1115   HG12  VAL 137          HG12      VAL 137 -17.090 -12.165   6.982
 1116   HG13  VAL 137          HG13      VAL 137 -17.475 -12.911   8.541
 1117   HG21  VAL 137          HG21      VAL 137 -13.803 -13.311   7.177
 1118   HG22  VAL 137          HG22      VAL 137 -14.445 -14.414   5.948
 1119   HG23  VAL 137          HG23      VAL 137 -14.918 -12.712   5.901
 1120    H    SER 138           H        SER 138 -15.723 -16.707   6.938
 1121    HA   SER 138           HA       SER 138 -14.049 -18.629   7.863
 1122    HB2  SER 138           HB2      SER 138 -14.678 -18.065   4.947
 1123    HB3  SER 138           HB3      SER 138 -14.341 -19.647   5.686
 1124    HG   SER 138           HG       SER 138 -16.610 -19.281   5.453
 1125    H    PHE 139           H        PHE 139 -13.023 -16.280   5.239
 1126    HA   PHE 139           HA       PHE 139 -10.447 -17.561   5.110
 1127    HB2  PHE 139           HB2      PHE 139  -9.839 -15.960   3.487
 1128    HB3  PHE 139           HB3      PHE 139 -11.494 -16.436   3.193
 1129    HD1  PHE 139           HD1      PHE 139 -13.357 -14.792   3.463
 1130    HD2  PHE 139           HD2      PHE 139  -9.239 -13.682   4.157
 1131    HE1  PHE 139           HE1      PHE 139 -13.981 -12.393   3.370
 1132    HE2  PHE 139           HE2      PHE 139  -9.868 -11.291   4.006
 1133    HZ   PHE 139           HZ       PHE 139 -12.239 -10.638   3.629
 1134    H    LYS 140           H        LYS 140 -11.644 -14.743   6.912
 1135    HA   LYS 140           HA       LYS 140  -8.959 -13.955   7.788
 1136    HB2  LYS 140           HB2      LYS 140 -11.710 -13.155   8.810
 1137    HB3  LYS 140           HB3      LYS 140 -10.170 -12.445   9.353
 1138    HG2  LYS 140           HG2      LYS 140  -9.683 -11.838   6.940
 1139    HG3  LYS 140           HG3      LYS 140 -11.315 -12.374   6.525
 1140    HD2  LYS 140           HD2      LYS 140 -10.599 -10.098   8.415
 1141    HD3  LYS 140           HD3      LYS 140 -11.199  -9.952   6.753
 1142    HE2  LYS 140           HE2      LYS 140 -13.299 -11.136   7.427
 1143    HE3  LYS 140           HE3      LYS 140 -12.723 -11.185   9.098
 1144    HZ1  LYS 140           HZ1      LYS 140 -13.241  -8.689   7.517
 1145    HZ2  LYS 140           HZ2      LYS 140 -14.209  -9.256   8.697
 1146    HZ3  LYS 140           HZ3      LYS 140 -12.712  -8.706   9.063
 1147    H    ARG 141           H        ARG 141 -11.646 -15.835   9.197
 1148    HA   ARG 141           HA       ARG 141 -10.521 -16.543  11.698
 1149    HB2  ARG 141           HB2      ARG 141 -12.005 -18.322   9.708
 1150    HB3  ARG 141           HB3      ARG 141 -11.551 -18.874  11.317
 1151    HG2  ARG 141           HG2      ARG 141 -12.988 -17.367  12.410
 1152    HG3  ARG 141           HG3      ARG 141 -13.223 -16.399  10.971
 1153    HD2  ARG 141           HD2      ARG 141 -15.133 -17.552  10.638
 1154    HD3  ARG 141           HD3      ARG 141 -14.130 -18.874  10.109
 1155    HE   ARG 141           HE       ARG 141 -14.476 -20.024  12.082
 1156   HH11  ARG 141          HH21      ARG 141 -15.858 -16.756  12.397
 1157   HH12  ARG 141          HH22      ARG 141 -16.773 -17.124  13.819
 1158   HH21  ARG 141          HH11      ARG 141 -15.769 -20.546  13.912
 1159   HH22  ARG 141          HH12      ARG 141 -16.810 -19.370  14.624
 1160    H    ASP 142           H        ASP 142  -9.716 -18.023   8.478
 1161    HA   ASP 142           HA       ASP 142  -7.972 -19.939   9.623
 1162    HB2  ASP 142           HB2      ASP 142  -8.803 -20.139   7.313
 1163    HB3  ASP 142           HB3      ASP 142  -7.780 -18.761   6.839
 1164    H    VAL 143           H        VAL 143  -7.266 -16.635   8.386
 1165    HA   VAL 143           HA       VAL 143  -4.452 -16.829   9.013
 1166    HB   VAL 143           HB       VAL 143  -6.301 -14.404   8.757
 1167   HG11  VAL 143          HG11      VAL 143  -4.338 -13.715  10.096
 1168   HG12  VAL 143          HG12      VAL 143  -3.257 -14.487   8.913
 1169   HG13  VAL 143          HG13      VAL 143  -4.222 -13.062   8.469
 1170   HG21  VAL 143          HG21      VAL 143  -6.050 -15.698   6.659
 1171   HG22  VAL 143          HG22      VAL 143  -5.236 -14.139   6.553
 1172   HG23  VAL 143          HG23      VAL 143  -4.280 -15.611   6.808
 1173    H    TYR 144           H        TYR 144  -7.247 -15.446  10.890
 1174    HA   TYR 144           HA       TYR 144  -5.578 -14.648  13.014
 1175    HB2  TYR 144           HB2      TYR 144  -8.564 -15.019  12.752
 1176    HB3  TYR 144           HB3      TYR 144  -7.820 -14.506  14.256
 1177    HD1  TYR 144           HD1      TYR 144  -5.964 -13.128  11.421
 1178    HD2  TYR 144           HD2      TYR 144  -9.459 -12.571  13.891
 1179    HE1  TYR 144           HE1      TYR 144  -5.972 -10.763  10.835
 1180    HE2  TYR 144           HE2      TYR 144  -9.482 -10.162  13.248
 1181    HH   TYR 144           HH       TYR 144  -6.997  -8.686  11.142
 1182    H    ARG 145           H        ARG 145  -7.172 -17.841  12.572
 1183    HA   ARG 145           HA       ARG 145  -6.399 -18.700  15.229
 1184    HB2  ARG 145           HB2      ARG 145  -7.072 -20.833  14.633
 1185    HB3  ARG 145           HB3      ARG 145  -8.075 -19.781  13.635
 1186    HG2  ARG 145           HG2      ARG 145  -6.263 -20.217  11.806
 1187    HG3  ARG 145           HG3      ARG 145  -5.805 -21.600  12.814
 1188    HD2  ARG 145           HD2      ARG 145  -8.194 -22.368  12.651
 1189    HD3  ARG 145           HD3      ARG 145  -8.523 -20.950  11.641
 1190    HE   ARG 145           HE       ARG 145  -7.149 -21.814   9.875
 1191   HH11  ARG 145          HH11      ARG 145  -7.592 -24.275  12.438
 1192   HH12  ARG 145          HH12      ARG 145  -7.205 -25.575  11.373
 1193   HH21  ARG 145          HH21      ARG 145  -6.706 -23.406   8.569
 1194   HH22  ARG 145          HH22      ARG 145  -6.678 -25.090   9.061
 1195    H    ARG 146           H        ARG 146  -4.741 -18.907  12.029
 1196    HA   ARG 146           HA       ARG 146  -2.382 -20.148  13.027
 1197    HB2  ARG 146           HB2      ARG 146  -3.038 -18.470  10.565
 1198    HB3  ARG 146           HB3      ARG 146  -1.357 -18.685  11.024
 1199    HG2  ARG 146           HG2      ARG 146  -1.600 -20.429   9.595
 1200    HG3  ARG 146           HG3      ARG 146  -1.858 -21.204  11.155
 1201    HD2  ARG 146           HD2      ARG 146  -4.361 -21.031  10.707
 1202    HD3  ARG 146           HD3      ARG 146  -3.950 -20.457   9.082
 1203    HE   ARG 146           HE       ARG 146  -3.192 -23.109  10.269
 1204   HH11  ARG 146          HH11      ARG 146  -4.394 -21.412   7.355
 1205   HH12  ARG 146          HH12      ARG 146  -3.773 -22.604   6.275
 1206   HH21  ARG 146          HH21      ARG 146  -2.586 -24.769   8.817
 1207   HH22  ARG 146          HH22      ARG 146  -2.889 -24.609   7.129
 1208    H    VAL 147           H        VAL 147  -3.170 -16.636  12.814
 1209    HA   VAL 147           HA       VAL 147  -0.782 -15.618  13.805
 1210    HB   VAL 147           HB       VAL 147  -3.660 -14.666  14.163
 1211   HG11  VAL 147          HG11      VAL 147  -2.322 -13.451  15.803
 1212   HG12  VAL 147          HG12      VAL 147  -1.118 -13.044  14.563
 1213   HG13  VAL 147          HG13      VAL 147  -2.776 -12.387  14.484
 1214   HG21  VAL 147          HG21      VAL 147  -3.115 -13.152  12.303
 1215   HG22  VAL 147          HG22      VAL 147  -1.464 -13.821  12.251
 1216   HG23  VAL 147          HG23      VAL 147  -2.826 -14.809  11.792
 1217    H    MET 148           H        MET 148  -3.224 -17.394  15.572
 1218    HA   MET 148           HA       MET 148  -2.175 -16.487  18.208
 1219    HB2  MET 148           HB2      MET 148  -4.496 -18.322  17.550
 1220    HB3  MET 148           HB3      MET 148  -3.991 -17.821  19.174
 1221    HG2  MET 148           HG2      MET 148  -4.881 -15.874  17.021
 1222    HG3  MET 148           HG3      MET 148  -5.963 -16.620  18.175
 1223    HE1  MET 148           HE1      MET 148  -4.036 -13.727  17.239
 1224    HE2  MET 148           HE2      MET 148  -3.526 -12.893  18.711
 1225    HE3  MET 148           HE3      MET 148  -2.586 -14.280  18.109
 1226    H    LYS 149           H        LYS 149  -2.775 -19.587  16.431
 1227    HA   LYS 149           HA       LYS 149  -1.375 -21.211  18.243
 1228    HB2  LYS 149           HB2      LYS 149  -2.959 -22.044  16.761
 1229    HB3  LYS 149           HB3      LYS 149  -2.110 -21.496  15.321
 1230    HG2  LYS 149           HG2      LYS 149  -1.049 -23.671  17.184
 1231    HG3  LYS 149           HG3      LYS 149  -2.134 -23.971  15.820
 1232    HD2  LYS 149           HD2      LYS 149  -0.318 -22.675  14.404
 1233    HD3  LYS 149           HD3      LYS 149   0.763 -23.085  15.734
 1234    HE2  LYS 149           HE2      LYS 149  -0.900 -25.063  14.111
 1235    HE3  LYS 149           HE3      LYS 149   0.800 -24.691  13.826
 1236    HZ1  LYS 149           HZ1      LYS 149   0.577 -26.702  15.122
 1237    HZ2  LYS 149           HZ2      LYS 149   1.312 -25.579  16.045
 1238    HZ3  LYS 149           HZ3      LYS 149  -0.269 -25.959  16.298
 1239    H    GLU 150           H        GLU 150   0.005 -19.397  15.415
 1240    HA   GLU 150           HA       GLU 150   2.443 -20.638  15.350
 1241    HB2  GLU 150           HB2      GLU 150   1.402 -18.946  13.752
 1242    HB3  GLU 150           HB3      GLU 150   1.808 -17.692  14.910
 1243    HG2  GLU 150           HG2      GLU 150   3.645 -17.595  13.601
 1244    HG3  GLU 150           HG3      GLU 150   4.246 -18.786  14.714
 1245    H    PHE 151           H        PHE 151   1.261 -18.088  17.526
 1246    HA   PHE 151           HA       PHE 151   3.908 -17.924  18.904
 1247    HB2  PHE 151           HB2      PHE 151   1.573 -16.062  19.252
 1248    HB3  PHE 151           HB3      PHE 151   3.276 -15.832  19.648
 1249    HD1  PHE 151           HD1      PHE 151   4.684 -16.610  17.094
 1250    HD2  PHE 151           HD2      PHE 151   1.099 -14.266  17.793
 1251    HE1  PHE 151           HE1      PHE 151   4.839 -15.651  14.884
 1252    HE2  PHE 151           HE2      PHE 151   1.437 -13.139  15.635
 1253    HZ   PHE 151           HZ       PHE 151   3.318 -13.834  14.158
 1254    H    ALA 152           H        ALA 152   0.810 -19.354  19.321
 1255    HA   ALA 152           HA       ALA 152   0.156 -18.946  21.956
 1256    HB1  ALA 152           HB1      ALA 152  -0.129 -21.515  20.311
 1257    HB2  ALA 152           HB2      ALA 152  -1.060 -21.105  21.767
 1258    HB3  ALA 152           HB3      ALA 152  -1.263 -20.150  20.297
 1259    H    SER 153           H        SER 153   2.481 -21.264  20.645
 1260    HA   SER 153           HA       SER 153   2.952 -22.685  23.071
 1261    HB2  SER 153           HB2      SER 153   4.829 -22.364  20.699
 1262    HB3  SER 153           HB3      SER 153   4.773 -23.714  21.855
 1263    HG   SER 153           HG       SER 153   3.688 -24.256  19.912
 1264    H    VAL 154           H        VAL 154   4.255 -19.657  21.781
 1265    HA   VAL 154           HA       VAL 154   6.439 -19.491  23.719
 1266    HB   VAL 154           HB       VAL 154   5.112 -17.329  22.032
 1267   HG11  VAL 154          HG11      VAL 154   7.087 -15.991  22.461
 1268   HG12  VAL 154          HG12      VAL 154   6.373 -16.437  24.025
 1269   HG13  VAL 154          HG13      VAL 154   7.813 -17.296  23.407
 1270   HG21  VAL 154          HG21      VAL 154   6.106 -18.972  20.525
 1271   HG22  VAL 154          HG22      VAL 154   7.215 -17.602  20.605
 1272   HG23  VAL 154          HG23      VAL 154   7.574 -19.064  21.526
 1273    H    VAL 155           H        VAL 155   3.055 -18.361  23.373
 1274    HA   VAL 155           HA       VAL 155   3.072 -16.712  25.627
 1275    HB   VAL 155           HB       VAL 155   0.668 -18.224  24.536
 1276   HG11  VAL 155          HG11      VAL 155   0.123 -17.358  26.712
 1277   HG12  VAL 155          HG12      VAL 155   1.017 -15.846  26.422
 1278   HG13  VAL 155          HG13      VAL 155  -0.520 -16.186  25.552
 1279   HG21  VAL 155          HG21      VAL 155   1.847 -15.503  23.853
 1280   HG22  VAL 155          HG22      VAL 155   1.614 -16.875  22.759
 1281   HG23  VAL 155          HG23      VAL 155   0.208 -16.026  23.382
 1282    H    MET 156           H        MET 156   2.257 -20.311  25.599
 1283    HA   MET 156           HA       MET 156   1.492 -20.404  28.247
 1284    HB2  MET 156           HB2      MET 156   3.063 -22.397  26.542
 1285    HB3  MET 156           HB3      MET 156   2.469 -22.808  28.155
 1286    HG2  MET 156           HG2      MET 156   0.423 -23.264  27.369
 1287    HG3  MET 156           HG3      MET 156   0.256 -21.591  26.870
 1288    HE1  MET 156           HE1      MET 156  -1.090 -22.410  23.588
 1289    HE2  MET 156           HE2      MET 156  -1.594 -22.490  25.286
 1290    HE3  MET 156           HE3      MET 156  -0.676 -21.080  24.701
 1291    H    SER 157           H        SER 157   4.766 -20.628  26.949
 1292    HA   SER 157           HA       SER 157   6.066 -20.744  29.596
 1293    HB2  SER 157           HB2      SER 157   6.743 -20.980  26.680
 1294    HB3  SER 157           HB3      SER 157   8.039 -20.613  27.870
 1295    HG   SER 157           HG       SER 157   6.251 -22.851  27.973
 1296    H    LEU 158           H        LEU 158   4.867 -18.160  27.612
 1297    HA   LEU 158           HA       LEU 158   6.681 -16.261  28.830
 1298    HB2  LEU 158           HB2      LEU 158   5.529 -15.941  26.584
 1299    HB3  LEU 158           HB3      LEU 158   3.967 -15.961  27.427
 1300    HG   LEU 158           HG       LEU 158   4.639 -13.982  28.763
 1301   HD11  LEU 158          HD11      LEU 158   7.106 -14.146  26.995
 1302   HD12  LEU 158          HD12      LEU 158   6.627 -12.683  27.890
 1303   HD13  LEU 158          HD13      LEU 158   7.030 -14.161  28.771
 1304   HD21  LEU 158          HD21      LEU 158   3.184 -13.775  27.051
 1305   HD22  LEU 158          HD22      LEU 158   4.390 -12.511  26.650
 1306   HD23  LEU 158          HD23      LEU 158   4.393 -14.046  25.762
 1307    H    GLN 159           H        GLN 159   3.362 -17.444  29.278
 1308    HA   GLN 159           HA       GLN 159   2.755 -15.994  31.703
 1309    HB2  GLN 159           HB2      GLN 159   1.821 -18.840  31.085
 1310    HB3  GLN 159           HB3      GLN 159   1.101 -17.673  32.172
 1311    HG2  GLN 159           HG2      GLN 159   0.618 -16.248  30.026
 1312    HG3  GLN 159           HG3      GLN 159   1.046 -17.705  29.147
 1313   HE21  GLN 159          HE22      GLN 159  -1.028 -16.924  32.009
 1314   HE22  GLN 159          HE21      GLN 159  -2.339 -17.995  31.520
 1315    H    GLU 160           H        GLU 160   4.253 -19.156  31.048
 1316    HA   GLU 160           HA       GLU 160   5.375 -19.230  33.714
 1317    HB2  GLU 160           HB2      GLU 160   5.740 -21.226  31.542
 1318    HB3  GLU 160           HB3      GLU 160   6.361 -21.286  33.207
 1319    HG2  GLU 160           HG2      GLU 160   4.003 -21.165  34.052
 1320    HG3  GLU 160           HG3      GLU 160   3.409 -21.203  32.393
 1321    H    ASN 161           H        ASN 161   6.129 -17.285  31.994
 1322    HA   ASN 161           HA       ASN 161   7.602 -15.649  32.001
 1323    HB2  ASN 161           HB2      ASN 161   8.620 -15.227  34.030
 1324    HB3  ASN 161           HB3      ASN 161   7.303 -16.320  34.453
 1325   HD21  ASN 161          HD22      ASN 161   8.483 -18.837  33.639
 1326   HD22  ASN 161          HD21      ASN 161   9.764 -19.162  34.780
 1327    H    THR 162           H        THR 162   8.628 -18.370  30.873
 1328    HA   THR 162           HA       THR 162  11.328 -17.292  30.160
 1329    HB   THR 162           HB       THR 162  11.871 -18.670  31.961
 1330    HG1  THR 162           HG1      THR 162  13.356 -18.903  30.394
 1331   HG21  THR 162          HG21      THR 162   9.951 -20.693  30.884
 1332   HG22  THR 162          HG22      THR 162  11.409 -21.261  31.741
 1333   HG23  THR 162          HG23      THR 162  10.283 -20.152  32.529
 1334    HA   PRO 163           HA       PRO 163   8.547 -18.477  26.743
 1335    HB2  PRO 163           HB2      PRO 163   9.199 -16.516  24.951
 1336    HB3  PRO 163           HB3      PRO 163   8.033 -16.293  26.292
 1337    HG2  PRO 163           HG2      PRO 163  10.969 -15.533  26.188
 1338    HG3  PRO 163           HG3      PRO 163   9.603 -14.544  26.789
 1339    HD2  PRO 163           HD2      PRO 163  11.253 -16.003  28.418
 1340    HD3  PRO 163           HD3      PRO 163   9.518 -15.747  28.819
 1341    H    LYS 164           H        LYS 164   9.044 -19.145  24.488
 1342    HA   LYS 164           HA       LYS 164  11.462 -20.726  24.682
 1343    HB2  LYS 164           HB2      LYS 164   9.450 -20.758  22.412
 1344    HB3  LYS 164           HB3      LYS 164  10.491 -22.076  22.926
 1345    HG2  LYS 164           HG2      LYS 164   8.160 -20.981  24.601
 1346    HG3  LYS 164           HG3      LYS 164   8.005 -22.265  23.426
 1347    HD2  LYS 164           HD2      LYS 164   8.105 -23.182  25.642
 1348    HD3  LYS 164           HD3      LYS 164   9.483 -23.736  24.693
 1349    HE2  LYS 164           HE2      LYS 164  11.022 -22.391  25.904
 1350    HE3  LYS 164           HE3      LYS 164   9.750 -21.355  26.563
 1351    HZ1  LYS 164           HZ1      LYS 164  10.158 -24.200  27.311
 1352    HZ2  LYS 164           HZ2      LYS 164  10.575 -22.906  28.223
 1353    HZ3  LYS 164           HZ3      LYS 164   8.992 -23.207  27.924
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1  -0.741   0.693   0.778
    2    H2   MET   1           H2       MET   1  -0.299   2.268   0.599
    3    H3   MET   1           H3       MET   1  -1.436   1.614  -0.375
    4    HA   MET   1           HA       MET   1   0.587   1.825  -1.602
    5    HB2  MET   1           HB2      MET   1   2.665   0.996  -0.945
    6    HB3  MET   1           HB3      MET   1   2.032   1.645   0.543
    7    HG2  MET   1           HG2      MET   1   3.057  -0.340   1.152
    8    HG3  MET   1           HG3      MET   1   1.344  -0.717   1.188
    9    HE1  MET   1           HE1      MET   1   4.037  -0.705  -1.845
   10    HE2  MET   1           HE2      MET   1   4.844  -1.443  -0.437
   11    HE3  MET   1           HE3      MET   1   4.417  -2.438  -1.850
   12    H    ILE   2           H        ILE   2   1.200   0.219  -3.255
   13    HA   ILE   2           HA       ILE   2   0.232  -2.542  -2.966
   14    HB   ILE   2           HB       ILE   2  -0.454  -0.722  -5.286
   15   HG12  ILE   2          HG12      ILE   2  -1.964  -1.594  -3.009
   16   HG13  ILE   2          HG13      ILE   2  -2.437  -0.515  -4.313
   17   HG21  ILE   2          HG21      ILE   2   0.361  -2.847  -6.226
   18   HG22  ILE   2          HG22      ILE   2  -0.774  -3.742  -5.184
   19   HG23  ILE   2          HG23      ILE   2  -1.362  -2.670  -6.474
   20   HD11  ILE   2          HD11      ILE   2  -3.360  -2.517  -5.513
   21   HD12  ILE   2          HD12      ILE   2  -2.817  -3.513  -4.110
   22   HD13  ILE   2          HD13      ILE   2  -4.046  -2.245  -3.911
   23    H    ASP   3           H        ASP   3   1.697  -3.956  -3.939
   24    HA   ASP   3           HA       ASP   3   4.334  -3.010  -4.404
   25    HB2  ASP   3           HB2      ASP   3   3.934  -5.231  -3.531
   26    HB3  ASP   3           HB3      ASP   3   3.088  -5.684  -5.018
   27    H    ASP   4           H        ASP   4   2.497  -4.967  -6.744
   28    HA   ASP   4           HA       ASP   4   2.554  -2.975  -8.798
   29    HB2  ASP   4           HB2      ASP   4   4.908  -3.695  -8.958
   30    HB3  ASP   4           HB3      ASP   4   4.398  -5.379  -9.014
   31    H    ASP   5           H        ASP   5   2.347  -6.465  -8.170
   32    HA   ASP   5           HA       ASP   5   0.692  -6.904 -10.494
   33    HB2  ASP   5           HB2      ASP   5   2.638  -8.324  -9.886
   34    HB3  ASP   5           HB3      ASP   5   1.724  -8.930  -8.503
   35    H    GLY   6           H        GLY   6  -0.348  -5.538  -8.006
   36    HA2  GLY   6           HA2      GLY   6  -2.519  -5.271  -7.221
   37    HA3  GLY   6           HA3      GLY   6  -3.019  -6.810  -7.939
   38    H    TYR   7           H        TYR   7  -0.138  -6.828  -5.920
   39    HA   TYR   7           HA       TYR   7  -1.745  -7.747  -3.596
   40    HB2  TYR   7           HB2      TYR   7   1.082  -8.621  -4.264
   41    HB3  TYR   7           HB3      TYR   7   0.149  -9.048  -2.829
   42    HD1  TYR   7           HD2      TYR   7   0.161  -9.409  -6.581
   43    HD2  TYR   7           HD1      TYR   7  -1.111 -11.049  -2.796
   44    HE1  TYR   7           HE2      TYR   7  -0.672 -11.413  -7.738
   45    HE2  TYR   7           HE1      TYR   7  -1.975 -13.047  -3.950
   46    HH   TYR   7           HH       TYR   7  -1.701 -13.496  -7.521
   47    H    ARG   8           H        ARG   8  -0.903  -7.012  -1.524
   48    HA   ARG   8           HA       ARG   8   1.209  -4.921  -1.688
   49    HB2  ARG   8           HB2      ARG   8   0.016  -3.495  -0.114
   50    HB3  ARG   8           HB3      ARG   8  -0.803  -3.646  -1.667
   51    HG2  ARG   8           HG2      ARG   8  -1.792  -5.348   0.633
   52    HG3  ARG   8           HG3      ARG   8  -2.127  -3.627   0.587
   53    HD2  ARG   8           HD2      ARG   8  -2.920  -4.023  -1.877
   54    HD3  ARG   8           HD3      ARG   8  -2.969  -5.721  -1.424
   55    HE   ARG   8           HE       ARG   8  -4.829  -5.362  -0.148
   56   HH11  ARG   8          HH21      ARG   8  -3.438  -2.127  -0.794
   57   HH12  ARG   8          HH22      ARG   8  -4.862  -1.289  -0.299
   58   HH21  ARG   8          HH11      ARG   8  -6.700  -4.200   0.532
   59   HH22  ARG   8          HH12      ARG   8  -6.716  -2.478   0.501
   60    HA   PRO   9           HA       PRO   9   2.516  -7.852   1.438
   61    HB2  PRO   9           HB2      PRO   9   4.684  -5.841   1.953
   62    HB3  PRO   9           HB3      PRO   9   4.831  -7.613   1.697
   63    HG2  PRO   9           HG2      PRO   9   5.507  -5.879  -0.245
   64    HG3  PRO   9           HG3      PRO   9   4.501  -7.309  -0.672
   65    HD2  PRO   9           HD2      PRO   9   3.577  -4.486  -0.049
   66    HD3  PRO   9           HD3      PRO   9   3.174  -5.502  -1.470
   67    H    ASN  10           H        ASN  10   2.117  -8.050   3.700
   68    HA   ASN  10           HA       ASN  10   1.338  -5.570   5.160
   69    HB2  ASN  10           HB2      ASN  10  -0.631  -6.481   4.003
   70    HB3  ASN  10           HB3      ASN  10  -0.281  -8.081   4.631
   71   HD21  ASN  10          HD21      ASN  10  -1.917  -5.075   5.283
   72   HD22  ASN  10          HD22      ASN  10  -2.491  -5.530   6.863
   73    H    VAL  11           H        VAL  11   1.345  -5.786   7.410
   74    HA   VAL  11           HA       VAL  11   2.498  -8.230   8.557
   75    HB   VAL  11           HB       VAL  11   4.004  -6.802  10.003
   76   HG11  VAL  11          HG11      VAL  11   5.781  -6.620   8.249
   77   HG12  VAL  11          HG12      VAL  11   5.040  -8.200   8.494
   78   HG13  VAL  11          HG13      VAL  11   4.574  -7.238   7.096
   79   HG21  VAL  11          HG21      VAL  11   3.559  -4.674   7.874
   80   HG22  VAL  11          HG22      VAL  11   3.102  -4.572   9.593
   81   HG23  VAL  11          HG23      VAL  11   4.808  -4.688   9.136
   82    H    GLY  12           H        GLY  12   1.805  -8.542  10.756
   83    HA2  GLY  12           HA2      GLY  12   0.273  -6.356  11.989
   84    HA3  GLY  12           HA3      GLY  12  -0.563  -7.893  11.730
   85    H    ILE  13           H        ILE  13  -0.289  -6.731  14.222
   86    HA   ILE  13           HA       ILE  13   1.944  -8.230  15.505
   87    HB   ILE  13           HB       ILE  13   0.796  -5.580  16.463
   88   HG12  ILE  13          HG12      ILE  13   3.269  -4.895  15.543
   89   HG13  ILE  13          HG13      ILE  13   2.854  -6.140  14.363
   90   HG21  ILE  13          HG21      ILE  13   3.049  -5.614  17.670
   91   HG22  ILE  13          HG22      ILE  13   1.906  -6.854  18.160
   92   HG23  ILE  13          HG23      ILE  13   3.259  -7.263  17.070
   93   HD11  ILE  13          HD11      ILE  13   0.781  -4.870  13.756
   94   HD12  ILE  13          HD12      ILE  13   1.235  -3.628  14.930
   95   HD13  ILE  13          HD13      ILE  13   2.257  -3.946  13.500
   96    H    VAL  14           H        VAL  14   1.589  -9.319  17.352
   97    HA   VAL  14           HA       VAL  14  -1.132  -9.183  18.584
   98    HB   VAL  14           HB       VAL  14   0.748 -11.574  18.706
   99   HG11  VAL  14          HG11      VAL  14  -1.055 -11.368  20.421
  100   HG12  VAL  14          HG12      VAL  14  -2.269 -11.356  19.124
  101   HG13  VAL  14          HG13      VAL  14  -1.240 -12.785  19.415
  102   HG21  VAL  14          HG21      VAL  14  -1.427 -11.223  16.619
  103   HG22  VAL  14          HG22      VAL  14   0.327 -11.354  16.323
  104   HG23  VAL  14          HG23      VAL  14  -0.541 -12.734  16.995
  105    H    ILE  15           H        ILE  15  -0.990  -8.562  20.795
  106    HA   ILE  15           HA       ILE  15   1.672  -8.950  22.028
  107    HB   ILE  15           HB       ILE  15  -0.299  -6.983  23.223
  108   HG12  ILE  15          HG12      ILE  15   0.345  -5.892  21.158
  109   HG13  ILE  15          HG13      ILE  15   1.136  -5.137  22.523
  110   HG21  ILE  15          HG21      ILE  15   1.348  -8.046  24.761
  111   HG22  ILE  15          HG22      ILE  15   2.650  -7.680  23.629
  112   HG23  ILE  15          HG23      ILE  15   1.812  -6.370  24.443
  113   HD11  ILE  15          HD11      ILE  15   2.581  -5.381  20.525
  114   HD12  ILE  15          HD12      ILE  15   3.237  -6.260  21.927
  115   HD13  ILE  15          HD13      ILE  15   2.388  -7.142  20.633
  116    H    CYS  16           H        CYS  16   1.719 -10.443  23.581
  117    HA   CYS  16           HA       CYS  16  -0.911 -11.323  24.695
  118    HB2  CYS  16           HB2      CYS  16   1.609 -13.015  24.412
  119    HB3  CYS  16           HB3      CYS  16   0.063 -13.520  25.133
  120    HG   CYS  16           HG       CYS  16   0.146 -14.591  22.765
  121    H    ASN  17           H        ASN  17  -1.038 -11.672  26.909
  122    HA   ASN  17           HA       ASN  17   1.095 -10.365  28.525
  123    HB2  ASN  17           HB2      ASN  17  -0.465  -9.761  30.151
  124    HB3  ASN  17           HB3      ASN  17  -1.239  -9.354  28.642
  125   HD21  ASN  17          HD22      ASN  17  -2.966  -9.419  30.653
  126   HD22  ASN  17          HD21      ASN  17  -3.898 -10.897  30.694
  127    H    ARG  18           H        ARG  18   0.952 -11.562  30.916
  128    HA   ARG  18           HA       ARG  18   1.917 -14.228  30.188
  129    HB2  ARG  18           HB2      ARG  18   2.014 -12.766  32.838
  130    HB3  ARG  18           HB3      ARG  18   2.798 -14.312  32.441
  131    HG2  ARG  18           HG2      ARG  18   4.560 -12.957  32.083
  132    HG3  ARG  18           HG3      ARG  18   3.842 -12.949  30.474
  133    HD2  ARG  18           HD2      ARG  18   4.599 -10.699  31.250
  134    HD3  ARG  18           HD3      ARG  18   2.862 -10.764  30.881
  135    HE   ARG  18           HE       ARG  18   3.099 -11.291  33.620
  136   HH11  ARG  18          HH11      ARG  18   3.819  -8.501  31.495
  137   HH12  ARG  18          HH12      ARG  18   3.402  -7.342  32.704
  138   HH21  ARG  18          HH21      ARG  18   2.598  -9.782  35.174
  139   HH22  ARG  18          HH22      ARG  18   2.705  -8.070  34.857
  140    H    GLN  19           H        GLN  19  -1.055 -13.383  30.532
  141    HA   GLN  19           HA       GLN  19  -1.883 -15.739  32.107
  142    HB2  GLN  19           HB2      GLN  19  -3.562 -13.384  31.153
  143    HB3  GLN  19           HB3      GLN  19  -4.129 -14.694  32.171
  144    HG2  GLN  19           HG2      GLN  19  -1.966 -12.683  32.920
  145    HG3  GLN  19           HG3      GLN  19  -3.653 -12.564  33.366
  146   HE21  GLN  19          HE22      GLN  19  -0.848 -13.236  34.939
  147   HE22  GLN  19          HE21      GLN  19  -1.417 -14.517  35.979
  148    H    GLY  20           H        GLY  20  -1.148 -14.864  28.921
  149    HA2  GLY  20           HA2      GLY  20  -1.635 -15.931  26.942
  150    HA3  GLY  20           HA3      GLY  20  -2.809 -16.977  27.761
  151    H    GLN  21           H        GLN  21  -3.219 -13.528  28.389
  152    HA   GLN  21           HA       GLN  21  -5.567 -13.511  26.577
  153    HB2  GLN  21           HB2      GLN  21  -4.571 -11.277  28.369
  154    HB3  GLN  21           HB3      GLN  21  -6.091 -11.337  27.485
  155    HG2  GLN  21           HG2      GLN  21  -6.871 -13.227  28.863
  156    HG3  GLN  21           HG3      GLN  21  -5.323 -13.268  29.718
  157   HE21  GLN  21          HE22      GLN  21  -8.403 -11.497  29.459
  158   HE22  GLN  21          HE21      GLN  21  -8.094 -10.459  30.827
  159    H    VAL  22           H        VAL  22  -5.676 -12.038  24.835
  160    HA   VAL  22           HA       VAL  22  -3.148 -10.893  23.845
  161    HB   VAL  22           HB       VAL  22  -3.595 -11.687  21.659
  162   HG11  VAL  22          HG11      VAL  22  -4.192 -14.174  23.295
  163   HG12  VAL  22          HG12      VAL  22  -3.126 -13.957  21.865
  164   HG13  VAL  22          HG13      VAL  22  -2.675 -13.326  23.466
  165   HG21  VAL  22          HG21      VAL  22  -5.470 -13.149  21.008
  166   HG22  VAL  22          HG22      VAL  22  -6.239 -12.919  22.601
  167   HG23  VAL  22          HG23      VAL  22  -6.047 -11.556  21.493
  168    H    MET  23           H        MET  23  -3.432  -9.015  22.529
  169    HA   MET  23           HA       MET  23  -5.695  -7.338  23.147
  170    HB2  MET  23           HB2      MET  23  -4.598  -5.720  21.814
  171    HB3  MET  23           HB3      MET  23  -3.295  -6.655  22.553
  172    HG2  MET  23           HG2      MET  23  -3.405  -8.091  20.342
  173    HG3  MET  23           HG3      MET  23  -4.288  -6.714  19.690
  174    HE1  MET  23           HE1      MET  23  -1.400  -3.919  20.307
  175    HE2  MET  23           HE2      MET  23  -3.169  -4.150  20.244
  176    HE3  MET  23           HE3      MET  23  -2.266  -4.548  21.723
  177    H    TRP  24           H        TRP  24  -7.431  -6.627  21.703
  178    HA   TRP  24           HA       TRP  24  -7.671  -7.834  19.027
  179    HB2  TRP  24           HB2      TRP  24  -8.589  -9.435  20.721
  180    HB3  TRP  24           HB3      TRP  24  -9.706  -8.204  21.267
  181    HD1  TRP  24           HD1      TRP  24 -11.927  -9.194  20.681
  182    HE1  TRP  24           HE1      TRP  24 -12.987 -10.500  18.793
  183    HE3  TRP  24           HE3      TRP  24  -7.858  -9.614  17.613
  184    HZ2  TRP  24           HZ2      TRP  24 -12.268 -11.372  16.129
  185    HZ3  TRP  24           HZ3      TRP  24  -8.046 -10.865  15.485
  186    HH2  TRP  24           HH2      TRP  24 -10.263 -11.675  14.702
  187    H    ALA  25           H        ALA  25  -8.701  -6.171  17.657
  188    HA   ALA  25           HA       ALA  25 -10.073  -3.971  19.088
  189    HB1  ALA  25           HB1      ALA  25  -7.598  -3.514  17.359
  190    HB2  ALA  25           HB2      ALA  25  -8.593  -2.262  18.140
  191    HB3  ALA  25           HB3      ALA  25  -7.654  -3.372  19.121
  192    H    ARG  26           H        ARG  26 -11.319  -2.593  17.777
  193    HA   ARG  26           HA       ARG  26 -12.387  -3.942  15.325
  194    HB2  ARG  26           HB2      ARG  26 -13.965  -3.674  17.207
  195    HB3  ARG  26           HB3      ARG  26 -13.548  -1.974  17.342
  196    HG2  ARG  26           HG2      ARG  26 -14.456  -1.730  14.914
  197    HG3  ARG  26           HG3      ARG  26 -15.173  -3.327  15.156
  198    HD2  ARG  26           HD2      ARG  26 -15.563  -0.984  17.060
  199    HD3  ARG  26           HD3      ARG  26 -16.605  -1.240  15.661
  200    HE   ARG  26           HE       ARG  26 -16.572  -3.648  17.148
  201   HH11  ARG  26          HH21      ARG  26 -17.580  -0.245  17.594
  202   HH12  ARG  26          HH22      ARG  26 -18.963  -0.643  18.558
  203   HH21  ARG  26          HH11      ARG  26 -18.464  -4.152  18.455
  204   HH22  ARG  26          HH12      ARG  26 -19.446  -2.882  19.070
  205    H    ARG  27           H        ARG  27 -11.704  -2.875  13.358
  206    HA   ARG  27           HA       ARG  27 -10.139  -0.455  13.769
  207    HB2  ARG  27           HB2      ARG  27  -9.624  -2.264  12.083
  208    HB3  ARG  27           HB3      ARG  27 -10.888  -1.562  11.054
  209    HG2  ARG  27           HG2      ARG  27  -9.705   0.589  10.997
  210    HG3  ARG  27           HG3      ARG  27  -8.545   0.033  12.212
  211    HD2  ARG  27           HD2      ARG  27  -8.787  -1.067   9.397
  212    HD3  ARG  27           HD3      ARG  27  -7.561   0.072   9.960
  213    HE   ARG  27           HE       ARG  27  -7.686  -2.807  10.452
  214   HH11  ARG  27          HH21      ARG  27  -6.009   0.249  11.521
  215   HH12  ARG  27          HH22      ARG  27  -4.788  -0.719  12.329
  216   HH21  ARG  27          HH11      ARG  27  -6.088  -3.828  11.675
  217   HH22  ARG  27          HH12      ARG  27  -4.767  -2.830  12.350
  218    H    PHE  28           H        PHE  28 -10.500   1.649  12.926
  219    HA   PHE  28           HA       PHE  28 -13.108   2.593  13.479
  220    HB2  PHE  28           HB2      PHE  28 -10.997   3.842  13.729
  221    HB3  PHE  28           HB3      PHE  28 -10.824   3.935  11.981
  222    HD1  PHE  28           HD1      PHE  28 -12.872   5.016  14.911
  223    HD2  PHE  28           HD2      PHE  28 -12.042   5.619  10.717
  224    HE1  PHE  28           HE1      PHE  28 -14.209   7.107  14.942
  225    HE2  PHE  28           HE2      PHE  28 -13.373   7.712  10.759
  226    HZ   PHE  28           HZ       PHE  28 -14.471   8.454  12.866
  227    H    GLY  29           H        GLY  29 -14.784   3.245  12.156
  228    HA2  GLY  29           HA2      GLY  29 -16.115   3.370  10.296
  229    HA3  GLY  29           HA3      GLY  29 -14.718   3.049   9.261
  230    H    GLN  30           H        GLN  30 -14.967   0.626  11.713
  231    HA   GLN  30           HA       GLN  30 -16.587  -1.171   9.971
  232    HB2  GLN  30           HB2      GLN  30 -14.284  -2.121  11.700
  233    HB3  GLN  30           HB3      GLN  30 -15.139  -2.999  10.446
  234    HG2  GLN  30           HG2      GLN  30 -13.178  -0.720  10.058
  235    HG3  GLN  30           HG3      GLN  30 -12.898  -2.437   9.774
  236   HE21  GLN  30          HE22      GLN  30 -12.725  -0.094   7.842
  237   HE22  GLN  30          HE21      GLN  30 -13.777  -0.545   6.520
  238    H    HIS  31           H        HIS  31 -17.406  -3.043  11.218
  239    HA   HIS  31           HA       HIS  31 -17.716  -2.595  14.140
  240    HB2  HIS  31           HB2      HIS  31 -19.792  -2.042  12.686
  241    HB3  HIS  31           HB3      HIS  31 -19.934  -3.780  12.458
  242    HD1  HIS  31           HD1      HIS  31 -20.799  -5.145  14.659
  243    HD2  HIS  31           HD2      HIS  31 -20.188  -1.005  15.142
  244    HE1  HIS  31           HE1      HIS  31 -21.897  -4.511  16.871
  245    H    SER  32           H        SER  32 -15.704  -4.059  12.548
  246    HA   SER  32           HA       SER  32 -16.262  -6.871  13.361
  247    HB2  SER  32           HB2      SER  32 -14.728  -5.937  10.903
  248    HB3  SER  32           HB3      SER  32 -15.146  -7.602  11.347
  249    HG   SER  32           HG       SER  32 -16.595  -6.740   9.766
  250    H    TRP  33           H        TRP  33 -14.485  -7.981  14.240
  251    HA   TRP  33           HA       TRP  33 -12.421  -6.176  15.366
  252    HB2  TRP  33           HB2      TRP  33 -13.403  -8.890  16.281
  253    HB3  TRP  33           HB3      TRP  33 -12.176  -7.885  17.066
  254    HD1  TRP  33           HD1      TRP  33 -15.965  -7.923  16.397
  255    HE1  TRP  33           HE1      TRP  33 -17.134  -6.430  18.083
  256    HE3  TRP  33           HE3      TRP  33 -11.837  -6.076  18.753
  257    HZ2  TRP  33           HZ2      TRP  33 -16.351  -4.498  20.152
  258    HZ3  TRP  33           HZ3      TRP  33 -12.066  -4.379  20.550
  259    HH2  TRP  33           HH2      TRP  33 -14.316  -3.572  21.241
  260    H    GLN  34           H        GLN  34 -10.222  -6.774  15.430
  261    HA   GLN  34           HA       GLN  34  -9.224  -9.066  13.950
  262    HB2  GLN  34           HB2      GLN  34  -8.008  -7.643  12.299
  263    HB3  GLN  34           HB3      GLN  34  -9.747  -7.676  12.060
  264    HG2  GLN  34           HG2      GLN  34  -9.953  -5.423  13.075
  265    HG3  GLN  34           HG3      GLN  34  -8.218  -5.408  13.423
  266   HE21  GLN  34          HE22      GLN  34 -10.572  -5.622  10.655
  267   HE22  GLN  34          HE21      GLN  34  -9.477  -4.913   9.497
  268    H    PHE  35           H        PHE  35  -6.769  -8.948  13.874
  269    HA   PHE  35           HA       PHE  35  -5.680  -7.764  16.343
  270    HB2  PHE  35           HB2      PHE  35  -4.413  -9.424  14.140
  271    HB3  PHE  35           HB3      PHE  35  -3.571  -8.892  15.592
  272    HD1  PHE  35           HD1      PHE  35  -5.078  -9.467  17.871
  273    HD2  PHE  35           HD2      PHE  35  -4.973 -11.690  14.162
  274    HE1  PHE  35           HE1      PHE  35  -5.945 -11.460  19.039
  275    HE2  PHE  35           HE2      PHE  35  -5.750 -13.708  15.376
  276    HZ   PHE  35           HZ       PHE  35  -6.313 -13.584  17.789
  277    HA   PRO  36           HA       PRO  36  -4.017  -4.038  14.402
  278    HB2  PRO  36           HB2      PRO  36  -1.463  -5.071  15.712
  279    HB3  PRO  36           HB3      PRO  36  -2.019  -3.377  15.593
  280    HG2  PRO  36           HG2      PRO  36  -2.461  -4.695  17.847
  281    HG3  PRO  36           HG3      PRO  36  -3.832  -3.793  17.131
  282    HD2  PRO  36           HD2      PRO  36  -3.276  -6.770  16.997
  283    HD3  PRO  36           HD3      PRO  36  -4.825  -5.918  17.259
  284    H    GLN  37           H        GLN  37  -3.092  -3.665  12.349
  285    HA   GLN  37           HA       GLN  37  -1.113  -5.220  11.214
  286    HB2  GLN  37           HB2      GLN  37  -2.249  -6.489   9.483
  287    HB3  GLN  37           HB3      GLN  37  -2.886  -6.988  11.051
  288    HG2  GLN  37           HG2      GLN  37  -4.742  -5.209  10.628
  289    HG3  GLN  37           HG3      GLN  37  -4.184  -5.232   8.955
  290   HE21  GLN  37          HE22      GLN  37  -5.691  -7.110  11.593
  291   HE22  GLN  37          HE21      GLN  37  -6.428  -8.319  10.534
  292    H    GLY  38           H        GLY  38  -0.516  -4.504   9.141
  293    HA2  GLY  38           HA2      GLY  38  -1.963  -2.412   7.740
  294    HA3  GLY  38           HA3      GLY  38  -0.602  -1.795   8.687
  295    H    GLY  39           H        GLY  39  -0.442  -1.403   5.990
  296    HA2  GLY  39           HA2      GLY  39   0.809  -3.570   4.564
  297    HA3  GLY  39           HA3      GLY  39   0.617  -1.898   4.035
  298    H    ILE  40           H        ILE  40   2.916  -3.670   4.033
  299    HA   ILE  40           HA       ILE  40   4.964  -2.422   5.743
  300    HB   ILE  40           HB       ILE  40   5.194  -4.206   3.297
  301   HG12  ILE  40          HG12      ILE  40   5.357  -5.031   6.240
  302   HG13  ILE  40          HG13      ILE  40   3.989  -5.327   5.186
  303   HG21  ILE  40          HG21      ILE  40   7.356  -3.672   5.373
  304   HG22  ILE  40          HG22      ILE  40   7.491  -4.670   3.922
  305   HG23  ILE  40          HG23      ILE  40   7.278  -2.934   3.754
  306   HD11  ILE  40          HD11      ILE  40   5.869  -6.476   3.647
  307   HD12  ILE  40          HD12      ILE  40   6.617  -6.721   5.243
  308   HD13  ILE  40          HD13      ILE  40   4.967  -7.324   4.900
  309    H    ASN  41           H        ASN  41   5.586  -0.337   5.306
  310    HA   ASN  41           HA       ASN  41   4.602   0.952   2.900
  311    HB2  ASN  41           HB2      ASN  41   6.429   2.066   5.092
  312    HB3  ASN  41           HB3      ASN  41   5.723   2.989   3.791
  313   HD21  ASN  41          HD22      ASN  41   4.998   1.073   6.656
  314   HD22  ASN  41          HD21      ASN  41   3.353   1.654   6.940
  315    HA   PRO  42           HA       PRO  42   7.654  -0.345   0.233
  316    HB2  PRO  42           HB2      PRO  42   8.341   1.844  -1.358
  317    HB3  PRO  42           HB3      PRO  42   6.858   0.863  -1.521
  318    HG2  PRO  42           HG2      PRO  42   7.213   3.475  -0.029
  319    HG3  PRO  42           HG3      PRO  42   5.897   3.016  -1.161
  320    HD2  PRO  42           HD2      PRO  42   5.531   2.855   1.500
  321    HD3  PRO  42           HD3      PRO  42   4.926   1.543   0.442
  322    H    GLY  43           H        GLY  43   9.712  -0.898   0.609
  323    HA2  GLY  43           HA2      GLY  43  12.014  -0.605   0.871
  324    HA3  GLY  43           HA3      GLY  43  11.774   1.064   1.393
  325    H    GLU  44           H        GLU  44   9.507  -0.452   3.289
  326    HA   GLU  44           HA       GLU  44  11.273  -0.697   5.568
  327    HB2  GLU  44           HB2      GLU  44   8.315  -1.320   5.171
  328    HB3  GLU  44           HB3      GLU  44   9.176  -1.643   6.674
  329    HG2  GLU  44           HG2      GLU  44   9.834   0.657   6.886
  330    HG3  GLU  44           HG3      GLU  44   8.895   1.095   5.432
  331    H    SER  45           H        SER  45  11.610  -2.614   6.812
  332    HA   SER  45           HA       SER  45  11.501  -5.165   5.305
  333    HB2  SER  45           HB2      SER  45  12.773  -6.032   7.228
  334    HB3  SER  45           HB3      SER  45  13.592  -4.639   6.499
  335    HG   SER  45           HG       SER  45  13.543  -4.427   8.751
  336    H    ALA  46           H        ALA  46  10.397  -6.997   6.658
  337    HA   ALA  46           HA       ALA  46   7.768  -6.209   7.314
  338    HB1  ALA  46           HB1      ALA  46   9.334  -8.680   8.168
  339    HB2  ALA  46           HB2      ALA  46   7.562  -8.521   8.216
  340    HB3  ALA  46           HB3      ALA  46   8.395  -8.494   6.647
  341    H    GLU  47           H        GLU  47  10.625  -6.596   9.395
  342    HA   GLU  47           HA       GLU  47   9.169  -6.375  11.872
  343    HB2  GLU  47           HB2      GLU  47  11.238  -7.598  11.573
  344    HB3  GLU  47           HB3      GLU  47  12.109  -6.107  11.140
  345    HG2  GLU  47           HG2      GLU  47  11.574  -5.205  13.431
  346    HG3  GLU  47           HG3      GLU  47  10.810  -6.751  13.812
  347    H    GLN  48           H        GLN  48  10.897  -4.035   9.738
  348    HA   GLN  48           HA       GLN  48  10.636  -1.845  11.616
  349    HB2  GLN  48           HB2      GLN  48  11.095  -1.913   8.622
  350    HB3  GLN  48           HB3      GLN  48  11.002  -0.416   9.555
  351    HG2  GLN  48           HG2      GLN  48  12.907  -2.674  10.230
  352    HG3  GLN  48           HG3      GLN  48  13.358  -1.305   9.207
  353   HE21  GLN  48          HE22      GLN  48  13.206  -2.500  12.410
  354   HE22  GLN  48          HE21      GLN  48  13.512  -0.997  13.254
  355    H    ALA  49           H        ALA  49   8.599  -3.149   8.946
  356    HA   ALA  49           HA       ALA  49   6.638  -1.064   9.124
  357    HB1  ALA  49           HB1      ALA  49   5.295  -2.662   7.805
  358    HB2  ALA  49           HB2      ALA  49   6.914  -2.335   7.122
  359    HB3  ALA  49           HB3      ALA  49   6.584  -3.874   7.976
  360    H    MET  50           H        MET  50   7.093  -4.223  10.752
  361    HA   MET  50           HA       MET  50   4.582  -4.384  12.037
  362    HB2  MET  50           HB2      MET  50   6.032  -6.258  12.049
  363    HB3  MET  50           HB3      MET  50   7.371  -5.364  12.741
  364    HG2  MET  50           HG2      MET  50   4.828  -5.997  14.187
  365    HG3  MET  50           HG3      MET  50   6.267  -6.978  14.244
  366    HE1  MET  50           HE1      MET  50   8.379  -6.566  15.222
  367    HE2  MET  50           HE2      MET  50   8.767  -4.924  14.665
  368    HE3  MET  50           HE3      MET  50   8.767  -5.300  16.398
  369    H    TYR  51           H        TYR  51   7.645  -2.751  13.170
  370    HA   TYR  51           HA       TYR  51   6.343  -1.599  15.423
  371    HB2  TYR  51           HB2      TYR  51   8.831  -0.699  13.933
  372    HB3  TYR  51           HB3      TYR  51   8.300  -0.067  15.503
  373    HD1  TYR  51           HD2      TYR  51   7.740  -2.022  17.318
  374    HD2  TYR  51           HD1      TYR  51  10.612  -2.188  14.102
  375    HE1  TYR  51           HE2      TYR  51   9.240  -3.397  18.725
  376    HE2  TYR  51           HE1      TYR  51  12.083  -3.615  15.479
  377    HH   TYR  51           HH       TYR  51  11.329  -4.492  18.885
  378    H    ARG  52           H        ARG  52   6.949  -0.132  12.106
  379    HA   ARG  52           HA       ARG  52   5.906   2.384  12.559
  380    HB2  ARG  52           HB2      ARG  52   7.007   1.428  10.522
  381    HB3  ARG  52           HB3      ARG  52   5.551   0.521  10.164
  382    HG2  ARG  52           HG2      ARG  52   5.356   2.288   8.716
  383    HG3  ARG  52           HG3      ARG  52   4.320   2.796  10.044
  384    HD2  ARG  52           HD2      ARG  52   5.676   4.643   9.287
  385    HD3  ARG  52           HD3      ARG  52   6.226   4.139  10.932
  386    HE   ARG  52           HE       ARG  52   7.708   2.755   8.971
  387   HH11  ARG  52          HH21      ARG  52   7.454   6.115  10.150
  388   HH12  ARG  52          HH22      ARG  52   9.079   6.522   9.732
  389   HH21  ARG  52          HH11      ARG  52   9.834   3.281   8.448
  390   HH22  ARG  52          HH12      ARG  52  10.476   4.867   8.719
  391    H    GLU  53           H        GLU  53   4.069  -0.547  11.470
  392    HA   GLU  53           HA       GLU  53   1.664   0.937  11.351
  393    HB2  GLU  53           HB2      GLU  53   2.141  -2.036  11.215
  394    HB3  GLU  53           HB3      GLU  53   0.580  -1.254  10.937
  395    HG2  GLU  53           HG2      GLU  53   3.134  -0.644   9.418
  396    HG3  GLU  53           HG3      GLU  53   1.820  -1.651   8.814
  397    H    LEU  54           H        LEU  54   3.086  -1.221  13.833
  398    HA   LEU  54           HA       LEU  54   0.975  -1.322  15.663
  399    HB2  LEU  54           HB2      LEU  54   3.207  -2.496  15.854
  400    HB3  LEU  54           HB3      LEU  54   3.956  -0.950  16.206
  401    HG   LEU  54           HG       LEU  54   2.398  -0.802  18.235
  402   HD11  LEU  54          HD11      LEU  54   0.781  -2.601  17.500
  403   HD12  LEU  54          HD12      LEU  54   2.084  -3.758  17.578
  404   HD13  LEU  54          HD13      LEU  54   1.528  -2.991  19.067
  405   HD21  LEU  54          HD21      LEU  54   3.889  -2.335  19.547
  406   HD22  LEU  54          HD22      LEU  54   4.487  -3.024  18.026
  407   HD23  LEU  54          HD23      LEU  54   4.786  -1.315  18.421
  408    H    PHE  55           H        PHE  55   3.554   1.226  15.325
  409    HA   PHE  55           HA       PHE  55   2.501   2.862  17.397
  410    HB2  PHE  55           HB2      PHE  55   4.771   3.166  16.542
  411    HB3  PHE  55           HB3      PHE  55   4.154   3.583  14.943
  412    HD1  PHE  55           HD2      PHE  55   4.138   4.676  18.527
  413    HD2  PHE  55           HD1      PHE  55   3.546   5.849  14.420
  414    HE1  PHE  55           HE2      PHE  55   3.948   7.050  19.229
  415    HE2  PHE  55           HE1      PHE  55   3.356   8.218  15.124
  416    HZ   PHE  55           HZ       PHE  55   3.560   8.824  17.533
  417    H    GLU  56           H        GLU  56   1.860   2.842  13.841
  418    HA   GLU  56           HA       GLU  56   0.233   5.100  13.855
  419    HB2  GLU  56           HB2      GLU  56   0.428   2.711  12.010
  420    HB3  GLU  56           HB3      GLU  56  -0.721   4.006  11.705
  421    HG2  GLU  56           HG2      GLU  56   2.239   4.557  12.112
  422    HG3  GLU  56           HG3      GLU  56   1.553   4.178  10.534
  423    H    GLU  57           H        GLU  57  -0.608   1.825  15.009
  424    HA   GLU  57           HA       GLU  57  -3.475   2.613  14.827
  425    HB2  GLU  57           HB2      GLU  57  -4.067   0.440  14.371
  426    HB3  GLU  57           HB3      GLU  57  -2.742   0.855  13.310
  427    HG2  GLU  57           HG2      GLU  57  -1.231  -0.467  15.028
  428    HG3  GLU  57           HG3      GLU  57  -2.744  -1.112  15.618
  429    H    VAL  58           H        VAL  58  -1.068   1.231  17.086
  430    HA   VAL  58           HA       VAL  58  -3.149   1.563  19.218
  431    HB   VAL  58           HB       VAL  58  -1.936  -0.111  20.510
  432   HG11  VAL  58          HG11      VAL  58  -2.799  -2.035  19.437
  433   HG12  VAL  58          HG12      VAL  58  -3.912  -0.705  19.098
  434   HG13  VAL  58          HG13      VAL  58  -2.778  -1.259  17.841
  435   HG21  VAL  58          HG21      VAL  58  -0.401  -0.871  18.053
  436   HG22  VAL  58          HG22      VAL  58   0.270   0.168  19.318
  437   HG23  VAL  58          HG23      VAL  58  -0.241  -1.465  19.764
  438    H    GLY  59           H        GLY  59  -0.564   3.222  17.947
  439    HA2  GLY  59           HA2      GLY  59   0.603   4.996  18.775
  440    HA3  GLY  59           HA3      GLY  59  -0.311   4.822  20.273
  441    H    LEU  60           H        LEU  60   1.079   1.886  19.988
  442    HA   LEU  60           HA       LEU  60   3.044   2.367  22.004
  443    HB2  LEU  60           HB2      LEU  60   1.455   0.469  21.785
  444    HB3  LEU  60           HB3      LEU  60   2.316  -0.051  20.332
  445    HG   LEU  60           HG       LEU  60   4.315  -0.652  21.670
  446   HD11  LEU  60          HD11      LEU  60   4.180  -0.659  24.091
  447   HD12  LEU  60          HD12      LEU  60   4.153   0.997  23.476
  448   HD13  LEU  60          HD13      LEU  60   2.643   0.242  24.035
  449   HD21  LEU  60          HD21      LEU  60   1.541  -1.598  22.705
  450   HD22  LEU  60          HD22      LEU  60   2.358  -2.227  21.275
  451   HD23  LEU  60          HD23      LEU  60   3.057  -2.511  22.883
  452    H    SER  61           H        SER  61   5.256   2.104  21.866
  453    HA   SER  61           HA       SER  61   6.462   2.219  19.130
  454    HB2  SER  61           HB2      SER  61   7.361   3.730  21.618
  455    HB3  SER  61           HB3      SER  61   7.986   3.901  19.964
  456    HG   SER  61           HG       SER  61   6.458   5.545  20.549
  457    H    ARG  62           H        ARG  62   8.746   1.597  19.077
  458    HA   ARG  62           HA       ARG  62   9.424  -0.929  19.704
  459    HB2  ARG  62           HB2      ARG  62  11.278   1.496  19.597
  460    HB3  ARG  62           HB3      ARG  62  11.833  -0.172  19.696
  461    HG2  ARG  62           HG2      ARG  62  10.215  -0.543  17.638
  462    HG3  ARG  62           HG3      ARG  62  10.363   1.198  17.442
  463    HD2  ARG  62           HD2      ARG  62  11.987   0.077  16.053
  464    HD3  ARG  62           HD3      ARG  62  12.839   0.924  17.386
  465    HE   ARG  62           HE       ARG  62  12.230  -1.833  18.017
  466   HH11  ARG  62          HH11      ARG  62  14.603   0.163  16.298
  467   HH12  ARG  62          HH12      ARG  62  15.802  -1.079  16.217
  468   HH21  ARG  62          HH21      ARG  62  13.754  -3.517  17.825
  469   HH22  ARG  62          HH22      ARG  62  15.323  -3.210  17.165
  470    H    LYS  63           H        LYS  63   9.911   1.886  21.833
  471    HA   LYS  63           HA       LYS  63  11.695   0.591  23.617
  472    HB2  LYS  63           HB2      LYS  63   9.950   2.991  24.301
  473    HB3  LYS  63           HB3      LYS  63  11.550   2.582  24.936
  474    HG2  LYS  63           HG2      LYS  63  10.898   3.643  22.175
  475    HG3  LYS  63           HG3      LYS  63  11.751   4.477  23.473
  476    HD2  LYS  63           HD2      LYS  63  12.729   1.885  22.286
  477    HD3  LYS  63           HD3      LYS  63  13.147   3.427  21.550
  478    HE2  LYS  63           HE2      LYS  63  13.725   2.771  24.478
  479    HE3  LYS  63           HE3      LYS  63  14.862   2.394  23.182
  480    HZ1  LYS  63           HZ1      LYS  63  14.971   4.761  22.653
  481    HZ2  LYS  63           HZ2      LYS  63  13.932   5.131  23.867
  482    HZ3  LYS  63           HZ3      LYS  63  15.399   4.496  24.201
  483    H    ASP  64           H        ASP  64   8.226   0.380  23.476
  484    HA   ASP  64           HA       ASP  64   8.328  -0.782  26.224
  485    HB2  ASP  64           HB2      ASP  64   6.978   1.368  25.916
  486    HB3  ASP  64           HB3      ASP  64   5.784   0.341  25.139
  487    H    VAL  65           H        VAL  65   8.820  -2.008  23.465
  488    HA   VAL  65           HA       VAL  65   7.233  -4.415  24.145
  489    HB   VAL  65           HB       VAL  65   6.980  -4.867  21.660
  490   HG11  VAL  65          HG11      VAL  65   5.090  -4.271  23.109
  491   HG12  VAL  65          HG12      VAL  65   5.402  -2.549  22.821
  492   HG13  VAL  65          HG13      VAL  65   4.897  -3.600  21.477
  493   HG21  VAL  65          HG21      VAL  65   7.336  -1.859  21.365
  494   HG22  VAL  65          HG22      VAL  65   8.556  -3.044  20.884
  495   HG23  VAL  65          HG23      VAL  65   6.972  -3.020  20.081
  496    H    ARG  66           H        ARG  66   8.044  -6.410  23.268
  497    HA   ARG  66           HA       ARG  66  10.792  -6.343  22.164
  498    HB2  ARG  66           HB2      ARG  66  11.589  -8.151  23.486
  499    HB3  ARG  66           HB3      ARG  66  11.137  -6.814  24.521
  500    HG2  ARG  66           HG2      ARG  66   9.169  -9.105  24.133
  501    HG3  ARG  66           HG3      ARG  66  10.600  -9.372  25.101
  502    HD2  ARG  66           HD2      ARG  66   8.617  -7.142  25.687
  503    HD3  ARG  66           HD3      ARG  66   8.638  -8.730  26.459
  504    HE   ARG  66           HE       ARG  66  10.895  -6.774  26.584
  505   HH11  ARG  66          HH21      ARG  66   8.905  -9.246  28.354
  506   HH12  ARG  66          HH22      ARG  66   9.838  -9.060  29.780
  507   HH21  ARG  66          HH11      ARG  66  12.078  -6.636  28.514
  508   HH22  ARG  66          HH12      ARG  66  11.634  -7.573  29.889
  509    H    ILE  67           H        ILE  67  11.037  -7.902  20.458
  510    HA   ILE  67           HA       ILE  67   8.602  -9.230  19.562
  511    HB   ILE  67           HB       ILE  67  11.443  -9.357  18.470
  512   HG12  ILE  67          HG12      ILE  67   9.158  -7.614  17.446
  513   HG13  ILE  67          HG13      ILE  67  10.460  -7.003  18.457
  514   HG21  ILE  67          HG21      ILE  67  10.337 -10.210  16.407
  515   HG22  ILE  67          HG22      ILE  67   9.997 -11.252  17.773
  516   HG23  ILE  67          HG23      ILE  67   8.750 -10.116  17.203
  517   HD11  ILE  67          HD11      ILE  67  11.011  -6.484  16.198
  518   HD12  ILE  67          HD12      ILE  67  12.129  -7.732  16.766
  519   HD13  ILE  67          HD13      ILE  67  10.787  -8.160  15.675
  520    H    LEU  68           H        LEU  68   8.055 -11.126  20.371
  521    HA   LEU  68           HA       LEU  68  10.024 -12.851  21.809
  522    HB2  LEU  68           HB2      LEU  68   7.051 -13.040  21.431
  523    HB3  LEU  68           HB3      LEU  68   8.026 -14.075  22.465
  524    HG   LEU  68           HG       LEU  68   7.741 -11.044  22.942
  525   HD11  LEU  68          HD11      LEU  68   5.629 -11.661  23.350
  526   HD12  LEU  68          HD12      LEU  68   6.002 -13.387  23.579
  527   HD13  LEU  68          HD13      LEU  68   6.346 -12.244  24.873
  528   HD21  LEU  68          HD21      LEU  68   8.848 -13.314  24.648
  529   HD22  LEU  68          HD22      LEU  68   9.789 -12.008  23.895
  530   HD23  LEU  68          HD23      LEU  68   8.626 -11.620  25.161
  531    H    ALA  69           H        ALA  69   7.954 -12.674  18.846
  532    HA   ALA  69           HA       ALA  69   9.212 -14.936  17.567
  533    HB1  ALA  69           HB1      ALA  69   6.324 -15.303  18.436
  534    HB2  ALA  69           HB2      ALA  69   7.325 -16.421  17.488
  535    HB3  ALA  69           HB3      ALA  69   7.707 -16.115  19.184
  536    H    SER  70           H        SER  70   8.166 -15.364  15.521
  537    HA   SER  70           HA       SER  70   6.453 -13.384  14.353
  538    HB2  SER  70           HB2      SER  70   8.142 -12.687  12.604
  539    HB3  SER  70           HB3      SER  70   8.418 -12.056  14.237
  540    HG   SER  70           HG       SER  70  10.369 -12.858  13.289
  541    H    THR  71           H        THR  71   5.812 -14.019  12.097
  542    HA   THR  71           HA       THR  71   5.323 -16.795  12.189
  543    HB   THR  71           HB       THR  71   4.616 -16.245   9.693
  544    HG1  THR  71           HG1      THR  71   5.442 -14.197   9.609
  545   HG21  THR  71          HG21      THR  71   2.865 -16.901  11.087
  546   HG22  THR  71          HG22      THR  71   3.139 -15.599  12.239
  547   HG23  THR  71          HG23      THR  71   2.434 -15.253  10.639
  548    H    ARG  72           H        ARG  72   5.957 -18.522  11.199
  549    HA   ARG  72           HA       ARG  72   8.760 -18.635  10.341
  550    HB2  ARG  72           HB2      ARG  72   6.640 -20.799  10.640
  551    HB3  ARG  72           HB3      ARG  72   8.369 -21.069  10.498
  552    HG2  ARG  72           HG2      ARG  72   8.808 -20.461  12.708
  553    HG3  ARG  72           HG3      ARG  72   7.464 -19.342  12.813
  554    HD2  ARG  72           HD2      ARG  72   5.928 -21.420  12.603
  555    HD3  ARG  72           HD3      ARG  72   7.346 -22.354  13.064
  556    HE   ARG  72           HE       ARG  72   5.681 -20.575  14.680
  557   HH11  ARG  72          HH21      ARG  72   8.884 -22.123  14.611
  558   HH12  ARG  72          HH22      ARG  72   9.089 -22.056  16.325
  559   HH21  ARG  72          HH11      ARG  72   5.926 -20.485  16.890
  560   HH22  ARG  72          HH12      ARG  72   7.367 -21.097  17.662
  561    H    ASN  73           H        ASN  73   5.487 -18.820   9.067
  562    HA   ASN  73           HA       ASN  73   6.456 -18.889   6.311
  563    HB2  ASN  73           HB2      ASN  73   4.847 -20.449   5.663
  564    HB3  ASN  73           HB3      ASN  73   5.475 -21.129   7.175
  565   HD21  ASN  73          HD22      ASN  73   3.964 -20.254   9.299
  566   HD22  ASN  73          HD21      ASN  73   2.285 -20.461   8.951
  567    H    TRP  74           H        TRP  74   5.124 -17.648   4.851
  568    HA   TRP  74           HA       TRP  74   3.752 -15.419   6.192
  569    HB2  TRP  74           HB2      TRP  74   4.168 -16.152   3.249
  570    HB3  TRP  74           HB3      TRP  74   3.230 -14.777   3.758
  571    HD1  TRP  74           HD1      TRP  74   6.852 -15.939   3.472
  572    HE1  TRP  74           HE1      TRP  74   8.367 -13.874   3.417
  573    HE3  TRP  74           HE3      TRP  74   3.435 -12.377   4.789
  574    HZ2  TRP  74           HZ2      TRP  74   8.070 -11.031   3.599
  575    HZ3  TRP  74           HZ3      TRP  74   4.041  -9.964   4.724
  576    HH2  TRP  74           HH2      TRP  74   6.364  -9.283   4.153
  577    H    LEU  75           H        LEU  75   1.569 -14.963   6.183
  578    HA   LEU  75           HA       LEU  75  -0.213 -17.232   5.438
  579    HB2  LEU  75           HB2      LEU  75  -1.001 -14.672   6.866
  580    HB3  LEU  75           HB3      LEU  75  -1.936 -16.140   6.693
  581    HG   LEU  75           HG       LEU  75   0.542 -15.642   8.400
  582   HD11  LEU  75          HD11      LEU  75  -2.222 -16.701   9.130
  583   HD12  LEU  75          HD12      LEU  75  -0.872 -16.429  10.255
  584   HD13  LEU  75          HD13      LEU  75  -1.593 -15.064   9.428
  585   HD21  LEU  75          HD21      LEU  75   1.061 -17.789   7.510
  586   HD22  LEU  75          HD22      LEU  75   0.463 -18.030   9.143
  587   HD23  LEU  75          HD23      LEU  75  -0.610 -18.377   7.758
  588    H    ARG  76           H        ARG  76   0.087 -17.092   3.187
  589    HA   ARG  76           HA       ARG  76  -0.212 -14.599   1.743
  590    HB2  ARG  76           HB2      ARG  76   1.075 -16.539   0.899
  591    HB3  ARG  76           HB3      ARG  76  -0.411 -17.506   0.870
  592    HG2  ARG  76           HG2      ARG  76  -1.356 -15.926  -0.835
  593    HG3  ARG  76           HG3      ARG  76   0.186 -15.055  -0.867
  594    HD2  ARG  76           HD2      ARG  76  -0.130 -18.040  -1.366
  595    HD3  ARG  76           HD3      ARG  76  -0.181 -16.829  -2.671
  596    HE   ARG  76           HE       ARG  76   2.184 -16.291  -1.351
  597   HH11  ARG  76          HH21      ARG  76   0.859 -19.144  -3.026
  598   HH12  ARG  76          HH22      ARG  76   2.406 -19.774  -3.462
  599   HH21  ARG  76          HH11      ARG  76   4.246 -17.152  -1.930
  600   HH22  ARG  76          HH12      ARG  76   4.362 -18.612  -2.841
  601    H    TYR  77           H        TYR  77  -2.024 -13.849   0.737
  602    HA   TYR  77           HA       TYR  77  -4.630 -15.076   1.518
  603    HB2  TYR  77           HB2      TYR  77  -3.589 -13.145   2.972
  604    HB3  TYR  77           HB3      TYR  77  -4.026 -12.146   1.583
  605    HD1  TYR  77           HD1      TYR  77  -5.396 -14.512   4.101
  606    HD2  TYR  77           HD2      TYR  77  -6.222 -11.268   1.374
  607    HE1  TYR  77           HE1      TYR  77  -7.582 -14.207   5.162
  608    HE2  TYR  77           HE2      TYR  77  -8.429 -10.949   2.400
  609    HH   TYR  77           HH       TYR  77  -9.934 -11.674   4.028
  610    H    LYS  78           H        LYS  78  -6.228 -14.693   0.225
  611    HA   LYS  78           HA       LYS  78  -6.101 -13.000  -2.185
  612    HB2  LYS  78           HB2      LYS  78  -6.620 -15.993  -2.162
  613    HB3  LYS  78           HB3      LYS  78  -7.648 -14.975  -3.155
  614    HG2  LYS  78           HG2      LYS  78  -6.021 -15.725  -4.590
  615    HG3  LYS  78           HG3      LYS  78  -5.647 -14.024  -4.282
  616    HD2  LYS  78           HD2      LYS  78  -3.786 -14.597  -2.884
  617    HD3  LYS  78           HD3      LYS  78  -4.234 -16.306  -2.807
  618    HE2  LYS  78           HE2      LYS  78  -3.426 -14.823  -5.356
  619    HE3  LYS  78           HE3      LYS  78  -2.283 -15.695  -4.340
  620    HZ1  LYS  78           HZ1      LYS  78  -3.543 -17.748  -4.787
  621    HZ2  LYS  78           HZ2      LYS  78  -4.573 -16.936  -5.775
  622    HZ3  LYS  78           HZ3      LYS  78  -3.001 -17.067  -6.170
  623    H    LEU  79           H        LEU  79  -8.074 -11.992  -2.470
  624    HA   LEU  79           HA       LEU  79 -10.350 -12.767  -0.704
  625    HB2  LEU  79           HB2      LEU  79 -11.097 -10.577  -0.692
  626    HB3  LEU  79           HB3      LEU  79  -9.454 -10.712  -0.091
  627    HG   LEU  79           HG       LEU  79  -8.559  -9.619  -2.068
  628   HD11  LEU  79          HD11      LEU  79 -10.398  -8.460  -3.551
  629   HD12  LEU  79          HD12      LEU  79  -9.894 -10.120  -3.896
  630   HD13  LEU  79          HD13      LEU  79 -11.411  -9.838  -3.024
  631   HD21  LEU  79          HD21      LEU  79 -10.921  -8.136  -0.838
  632   HD22  LEU  79          HD22      LEU  79  -9.315  -8.321  -0.100
  633   HD23  LEU  79          HD23      LEU  79  -9.495  -7.397  -1.603
  634    HA   PRO  80           HA       PRO  80 -12.256 -14.212  -4.346
  635    HB2  PRO  80           HB2      PRO  80 -14.925 -14.066  -3.750
  636    HB3  PRO  80           HB3      PRO  80 -13.802 -15.184  -2.910
  637    HG2  PRO  80           HG2      PRO  80 -14.781 -12.480  -2.015
  638    HG3  PRO  80           HG3      PRO  80 -14.699 -13.994  -1.058
  639    HD2  PRO  80           HD2      PRO  80 -12.746 -12.032  -0.988
  640    HD3  PRO  80           HD3      PRO  80 -12.378 -13.771  -0.740
  641    H    LYS  81           H        LYS  81 -13.422 -13.466  -6.312
  642    HA   LYS  81           HA       LYS  81 -12.672 -10.781  -6.690
  643    HB2  LYS  81           HB2      LYS  81 -14.221 -12.429  -8.668
  644    HB3  LYS  81           HB3      LYS  81 -13.255 -10.942  -8.952
  645    HG2  LYS  81           HG2      LYS  81 -11.213 -12.109  -8.212
  646    HG3  LYS  81           HG3      LYS  81 -12.116 -13.617  -8.023
  647    HD2  LYS  81           HD2      LYS  81 -11.819 -12.078 -10.642
  648    HD3  LYS  81           HD3      LYS  81 -10.821 -13.458 -10.151
  649    HE2  LYS  81           HE2      LYS  81 -12.857 -14.887 -10.026
  650    HE3  LYS  81           HE3      LYS  81 -13.849 -13.528 -10.567
  651    HZ1  LYS  81           HZ1      LYS  81 -11.682 -14.803 -12.146
  652    HZ2  LYS  81           HZ2      LYS  81 -13.283 -14.990 -12.398
  653    HZ3  LYS  81           HZ3      LYS  81 -12.590 -13.534 -12.657
  654    H    ARG  82           H        ARG  82 -15.742 -11.966  -5.651
  655    HA   ARG  82           HA       ARG  82 -17.326  -9.752  -6.378
  656    HB2  ARG  82           HB2      ARG  82 -18.759 -10.303  -4.501
  657    HB3  ARG  82           HB3      ARG  82 -18.291 -11.736  -5.430
  658    HG2  ARG  82           HG2      ARG  82 -16.511 -12.147  -3.611
  659    HG3  ARG  82           HG3      ARG  82 -17.318 -10.892  -2.665
  660    HD2  ARG  82           HD2      ARG  82 -18.628 -13.399  -3.780
  661    HD3  ARG  82           HD3      ARG  82 -18.034 -13.227  -2.114
  662    HE   ARG  82           HE       ARG  82 -19.770 -11.089  -2.454
  663   HH11  ARG  82          HH11      ARG  82 -20.069 -14.632  -2.562
  664   HH12  ARG  82          HH12      ARG  82 -21.734 -14.649  -2.116
  665   HH21  ARG  82          HH21      ARG  82 -21.994 -11.109  -1.854
  666   HH22  ARG  82          HH22      ARG  82 -22.847 -12.595  -1.693
  667    H    LEU  83           H        LEU  83 -14.803  -9.944  -3.927
  668    HA   LEU  83           HA       LEU  83 -15.607  -7.388  -2.733
  669    HB2  LEU  83           HB2      LEU  83 -13.207  -9.103  -2.071
  670    HB3  LEU  83           HB3      LEU  83 -13.825  -7.755  -1.132
  671    HG   LEU  83           HG       LEU  83 -15.161 -10.439  -1.555
  672   HD11  LEU  83          HD11      LEU  83 -14.713 -10.874   0.758
  673   HD12  LEU  83          HD12      LEU  83 -13.192 -10.332   0.043
  674   HD13  LEU  83          HD13      LEU  83 -14.140  -9.206   1.025
  675   HD21  LEU  83          HD21      LEU  83 -16.212  -8.076   0.033
  676   HD22  LEU  83          HD22      LEU  83 -16.943  -8.792  -1.427
  677   HD23  LEU  83          HD23      LEU  83 -16.874  -9.728   0.067
  678    H    VAL  84           H        VAL  84 -13.599  -8.407  -5.341
  679    HA   VAL  84           HA       VAL  84 -11.427  -6.568  -4.948
  680    HB   VAL  84           HB       VAL  84 -12.452  -7.939  -7.480
  681   HG11  VAL  84          HG11      VAL  84 -11.071  -6.044  -8.122
  682   HG12  VAL  84          HG12      VAL  84  -9.852  -6.464  -6.900
  683   HG13  VAL  84          HG13      VAL  84 -10.093  -7.499  -8.317
  684   HG21  VAL  84          HG21      VAL  84  -9.966  -8.743  -5.940
  685   HG22  VAL  84          HG22      VAL  84 -11.537  -9.470  -5.591
  686   HG23  VAL  84          HG23      VAL  84 -10.845  -9.621  -7.221
  687    H    ARG  85           H        ARG  85 -11.317  -4.400  -5.433
  688    HA   ARG  85           HA       ARG  85 -13.563  -3.162  -6.872
  689    HB2  ARG  85           HB2      ARG  85 -11.768  -2.344  -4.708
  690    HB3  ARG  85           HB3      ARG  85 -11.664  -1.186  -6.040
  691    HG2  ARG  85           HG2      ARG  85 -14.259  -2.170  -4.864
  692    HG3  ARG  85           HG3      ARG  85 -13.419  -0.678  -4.363
  693    HD2  ARG  85           HD2      ARG  85 -13.493   0.027  -6.831
  694    HD3  ARG  85           HD3      ARG  85 -14.649  -1.267  -7.105
  695    HE   ARG  85           HE       ARG  85 -14.993   1.269  -5.660
  696   HH11  ARG  85          HH21      ARG  85 -16.509  -1.919  -6.213
  697   HH12  ARG  85          HH22      ARG  85 -18.088  -1.380  -5.780
  698   HH21  ARG  85          HH11      ARG  85 -17.090   1.954  -5.081
  699   HH22  ARG  85          HH12      ARG  85 -18.426   0.866  -5.125
  700    H    TRP  86           H        TRP  86 -13.243  -3.807  -8.895
  701    HA   TRP  86           HA       TRP  86 -10.769  -3.626 -10.300
  702    HB2  TRP  86           HB2      TRP  86 -13.651  -3.744 -11.229
  703    HB3  TRP  86           HB3      TRP  86 -12.258  -3.959 -12.292
  704    HD1  TRP  86           HD1      TRP  86 -14.565  -5.888 -10.168
  705    HE1  TRP  86           HE1      TRP  86 -13.769  -8.278  -9.779
  706    HE3  TRP  86           HE3      TRP  86  -9.782  -5.423 -11.923
  707    HZ2  TRP  86           HZ2      TRP  86 -11.312  -9.793 -10.102
  708    HZ3  TRP  86           HZ3      TRP  86  -8.217  -7.352 -11.841
  709    HH2  TRP  86           HH2      TRP  86  -8.973  -9.541 -10.939
  710    H    ASP  87           H        ASP  87 -13.244  -1.267  -9.524
  711    HA   ASP  87           HA       ASP  87 -12.929   0.398 -11.828
  712    HB2  ASP  87           HB2      ASP  87 -14.986   0.284 -10.510
  713    HB3  ASP  87           HB3      ASP  87 -14.155   0.945  -9.099
  714    H    THR  88           H        THR  88 -11.120   0.222  -8.826
  715    HA   THR  88           HA       THR  88  -9.944   2.875  -9.355
  716    HB   THR  88           HB       THR  88 -11.196   2.504  -7.161
  717    HG1  THR  88           HG1      THR  88  -9.821   3.935  -6.223
  718   HG21  THR  88          HG21      THR  88 -10.011   1.485  -5.333
  719   HG22  THR  88          HG22      THR  88 -10.066   0.283  -6.630
  720   HG23  THR  88          HG23      THR  88  -8.567   1.198  -6.346
  721    H    LYS  89           H        LYS  89  -7.593   3.019  -8.905
  722    HA   LYS  89           HA       LYS  89  -6.212   0.576  -9.809
  723    HB2  LYS  89           HB2      LYS  89  -5.759   3.335 -10.991
  724    HB3  LYS  89           HB3      LYS  89  -5.026   1.829 -11.523
  725    HG2  LYS  89           HG2      LYS  89  -7.970   2.575 -11.737
  726    HG3  LYS  89           HG3      LYS  89  -6.790   2.656 -13.041
  727    HD2  LYS  89           HD2      LYS  89  -6.507   0.217 -13.031
  728    HD3  LYS  89           HD3      LYS  89  -7.620   0.061 -11.657
  729    HE2  LYS  89           HE2      LYS  89  -9.385   1.245 -13.052
  730    HE3  LYS  89           HE3      LYS  89  -8.279   1.124 -14.432
  731    HZ1  LYS  89           HZ1      LYS  89  -8.361  -1.342 -14.092
  732    HZ2  LYS  89           HZ2      LYS  89  -9.550  -1.119 -12.955
  733    HZ3  LYS  89           HZ3      LYS  89  -9.801  -0.688 -14.507
  734    HA   PRO  90           HA       PRO  90  -4.372  -0.316  -9.936
  735    HB2  PRO  90           HB2      PRO  90  -2.577  -1.715  -8.531
  736    HB3  PRO  90           HB3      PRO  90  -2.130  -0.390  -9.656
  737    HG2  PRO  90           HG2      PRO  90  -2.444  -0.240  -6.642
  738    HG3  PRO  90           HG3      PRO  90  -1.064   0.351  -7.626
  739    HD2  PRO  90           HD2      PRO  90  -3.126   1.975  -6.789
  740    HD3  PRO  90           HD3      PRO  90  -2.311   2.220  -8.366
  741    H    VAL  91           H        VAL  91  -5.559  -2.174  -9.621
  742    HA   VAL  91           HA       VAL  91  -7.229  -2.354  -7.268
  743    HB   VAL  91           HB       VAL  91  -8.240  -2.796  -9.373
  744   HG11  VAL  91          HG11      VAL  91  -6.083  -4.873  -9.951
  745   HG12  VAL  91          HG12      VAL  91  -7.548  -4.616 -10.918
  746   HG13  VAL  91          HG13      VAL  91  -6.343  -3.335 -10.810
  747   HG21  VAL  91          HG21      VAL  91  -7.801  -5.562  -8.173
  748   HG22  VAL  91          HG22      VAL  91  -8.892  -4.334  -7.506
  749   HG23  VAL  91          HG23      VAL  91  -9.180  -4.985  -9.130
  750    H    CYS  92           H        CYS  92  -7.208  -3.871  -5.621
  751    HA   CYS  92           HA       CYS  92  -4.818  -5.590  -5.419
  752    HB2  CYS  92           HB2      CYS  92  -5.492  -5.741  -3.006
  753    HB3  CYS  92           HB3      CYS  92  -5.087  -4.107  -3.564
  754    HG   CYS  92           HG       CYS  92  -8.142  -5.364  -3.438
  755    H    ILE  93           H        ILE  93  -5.035  -7.843  -5.358
  756    HA   ILE  93           HA       ILE  93  -7.792  -8.922  -5.000
  757    HB   ILE  93           HB       ILE  93  -7.558 -10.596  -6.533
  758   HG12  ILE  93          HG12      ILE  93  -5.382 -11.486  -6.156
  759   HG13  ILE  93          HG13      ILE  93  -5.629 -11.198  -7.868
  760   HG21  ILE  93          HG21      ILE  93  -7.259  -9.519  -8.673
  761   HG22  ILE  93          HG22      ILE  93  -8.030  -8.401  -7.544
  762   HG23  ILE  93          HG23      ILE  93  -6.315  -8.207  -7.948
  763   HD11  ILE  93          HD11      ILE  93  -3.396 -10.607  -7.400
  764   HD12  ILE  93          HD12      ILE  93  -4.233  -9.063  -7.598
  765   HD13  ILE  93          HD13      ILE  93  -3.831  -9.674  -5.967
  766    H    GLY  94           H        GLY  94  -4.577  -8.867  -3.765
  767    HA2  GLY  94           HA2      GLY  94  -5.280 -10.754  -1.681
  768    HA3  GLY  94           HA3      GLY  94  -4.087 -11.375  -2.836
  769    H    GLN  95           H        GLN  95  -2.951 -11.338  -0.626
  770    HA   GLN  95           HA       GLN  95  -0.972  -9.254  -0.617
  771    HB2  GLN  95           HB2      GLN  95  -1.401  -8.473   1.719
  772    HB3  GLN  95           HB3      GLN  95  -2.626  -7.970   0.557
  773    HG2  GLN  95           HG2      GLN  95  -4.124  -9.832   1.423
  774    HG3  GLN  95           HG3      GLN  95  -2.900 -10.177   2.651
  775   HE21  GLN  95          HE22      GLN  95  -5.236  -7.792   1.438
  776   HE22  GLN  95          HE21      GLN  95  -5.329  -6.853   2.916
  777    H    LYS  96           H        LYS  96   0.675  -9.679   1.132
  778    HA   LYS  96           HA       LYS  96   0.649 -12.546   2.064
  779    HB2  LYS  96           HB2      LYS  96   2.992 -10.611   1.654
  780    HB3  LYS  96           HB3      LYS  96   3.088 -12.235   2.354
  781    HG2  LYS  96           HG2      LYS  96   2.464 -13.279   0.280
  782    HG3  LYS  96           HG3      LYS  96   2.128 -11.714  -0.468
  783    HD2  LYS  96           HD2      LYS  96   4.292 -12.652  -1.187
  784    HD3  LYS  96           HD3      LYS  96   4.459 -11.077  -0.404
  785    HE2  LYS  96           HE2      LYS  96   5.316 -12.118   1.666
  786    HE3  LYS  96           HE3      LYS  96   4.984 -13.737   1.029
  787    HZ1  LYS  96           HZ1      LYS  96   6.644 -13.324  -0.715
  788    HZ2  LYS  96           HZ2      LYS  96   6.961 -11.827  -0.119
  789    HZ3  LYS  96           HZ3      LYS  96   7.315 -13.159   0.762
  790    H    GLN  97           H        GLN  97   0.213 -12.639   4.328
  791    HA   GLN  97           HA       GLN  97   0.652 -10.082   5.835
  792    HB2  GLN  97           HB2      GLN  97  -1.226 -12.344   6.562
  793    HB3  GLN  97           HB3      GLN  97  -1.001 -10.789   7.380
  794    HG2  GLN  97           HG2      GLN  97  -1.695  -9.746   5.093
  795    HG3  GLN  97           HG3      GLN  97  -2.303 -11.358   4.710
  796   HE21  GLN  97          HE22      GLN  97  -2.518  -8.683   7.122
  797   HE22  GLN  97          HE21      GLN  97  -4.179  -8.972   7.573
  798    H    LYS  98           H        LYS  98   2.419 -10.086   7.015
  799    HA   LYS  98           HA       LYS  98   3.489 -12.620   8.181
  800    HB2  LYS  98           HB2      LYS  98   4.756 -10.243   7.104
  801    HB3  LYS  98           HB3      LYS  98   4.995 -10.215   8.860
  802    HG2  LYS  98           HG2      LYS  98   6.020 -12.257   8.935
  803    HG3  LYS  98           HG3      LYS  98   5.528 -12.678   7.254
  804    HD2  LYS  98           HD2      LYS  98   7.062 -10.674   6.609
  805    HD3  LYS  98           HD3      LYS  98   7.783 -10.909   8.204
  806    HE2  LYS  98           HE2      LYS  98   7.420 -13.204   6.194
  807    HE3  LYS  98           HE3      LYS  98   8.801 -12.126   6.111
  808    HZ1  LYS  98           HZ1      LYS  98   9.344 -14.103   7.375
  809    HZ2  LYS  98           HZ2      LYS  98   9.442 -12.817   8.365
  810    HZ3  LYS  98           HZ3      LYS  98   8.160 -13.849   8.464
  811    H    TRP  99           H        TRP  99   3.841 -12.675  10.533
  812    HA   TRP  99           HA       TRP  99   2.336 -10.605  12.022
  813    HB2  TRP  99           HB2      TRP  99   1.864 -13.582  12.220
  814    HB3  TRP  99           HB3      TRP  99   1.176 -12.353  13.286
  815    HD1  TRP  99           HD1      TRP  99   0.913 -13.740   9.738
  816    HE1  TRP  99           HE1      TRP  99  -1.219 -12.884   8.636
  817    HE3  TRP  99           HE3      TRP  99  -0.519 -10.355  13.298
  818    HZ2  TRP  99           HZ2      TRP  99  -3.336 -11.021   9.236
  819    HZ3  TRP  99           HZ3      TRP  99  -2.571  -9.004  12.977
  820    HH2  TRP  99           HH2      TRP  99  -4.004  -9.359  10.979
  821    H    PHE 100           H        PHE 100   2.957 -10.349  14.161
  822    HA   PHE 100           HA       PHE 100   5.491 -11.679  14.993
  823    HB2  PHE 100           HB2      PHE 100   4.838  -8.707  14.881
  824    HB3  PHE 100           HB3      PHE 100   6.195  -9.402  15.761
  825    HD1  PHE 100           HD1      PHE 100   4.742  -9.175  12.281
  826    HD2  PHE 100           HD2      PHE 100   8.293  -9.552  14.730
  827    HE1  PHE 100           HE1      PHE 100   6.196  -8.895  10.287
  828    HE2  PHE 100           HE2      PHE 100   9.706  -9.321  12.732
  829    HZ   PHE 100           HZ       PHE 100   8.669  -9.016  10.502
  830    H    LEU 101           H        LEU 101   5.377 -12.344  17.072
  831    HA   LEU 101           HA       LEU 101   3.161 -11.335  18.800
  832    HB2  LEU 101           HB2      LEU 101   3.127 -13.667  18.985
  833    HB3  LEU 101           HB3      LEU 101   4.890 -13.797  18.925
  834    HG   LEU 101           HG       LEU 101   5.012 -12.777  21.197
  835   HD11  LEU 101          HD11      LEU 101   2.907 -11.463  21.163
  836   HD12  LEU 101          HD12      LEU 101   2.013 -12.983  21.197
  837   HD13  LEU 101          HD13      LEU 101   3.061 -12.490  22.578
  838   HD21  LEU 101          HD21      LEU 101   3.209 -15.213  21.111
  839   HD22  LEU 101          HD22      LEU 101   4.974 -15.253  20.941
  840   HD23  LEU 101          HD23      LEU 101   4.242 -14.704  22.463
  841    H    LEU 102           H        LEU 102   3.739  -9.627  19.931
  842    HA   LEU 102           HA       LEU 102   6.544  -9.331  20.842
  843    HB2  LEU 102           HB2      LEU 102   4.392  -7.412  19.949
  844    HB3  LEU 102           HB3      LEU 102   5.506  -6.894  21.223
  845    HG   LEU 102           HG       LEU 102   7.364  -7.174  19.742
  846   HD11  LEU 102          HD11      LEU 102   5.325  -8.159  17.736
  847   HD12  LEU 102          HD12      LEU 102   6.930  -7.555  17.263
  848   HD13  LEU 102          HD13      LEU 102   6.796  -8.984  18.304
  849   HD21  LEU 102          HD21      LEU 102   5.753  -5.099  19.753
  850   HD22  LEU 102          HD22      LEU 102   6.958  -5.224  18.455
  851   HD23  LEU 102          HD23      LEU 102   5.257  -5.659  18.153
  852    H    GLN 103           H        GLN 103   6.690  -8.584  23.058
  853    HA   GLN 103           HA       GLN 103   4.172  -9.020  24.653
  854    HB2  GLN 103           HB2      GLN 103   5.269 -10.585  25.513
  855    HB3  GLN 103           HB3      GLN 103   6.892  -9.859  25.321
  856    HG2  GLN 103           HG2      GLN 103   6.411  -8.319  27.212
  857    HG3  GLN 103           HG3      GLN 103   4.718  -8.849  27.259
  858   HE21  GLN 103          HE22      GLN 103   4.203 -11.025  27.946
  859   HE22  GLN 103          HE21      GLN 103   5.361 -11.875  28.998
  860    H    LEU 104           H        LEU 104   3.582  -7.262  25.983
  861    HA   LEU 104           HA       LEU 104   4.743  -4.637  25.422
  862    HB2  LEU 104           HB2      LEU 104   2.249  -5.782  26.562
  863    HB3  LEU 104           HB3      LEU 104   2.851  -4.473  27.537
  864    HG   LEU 104           HG       LEU 104   2.693  -4.148  24.523
  865   HD11  LEU 104          HD11      LEU 104   0.492  -3.078  24.827
  866   HD12  LEU 104          HD12      LEU 104   0.436  -4.824  25.129
  867   HD13  LEU 104          HD13      LEU 104   0.447  -3.687  26.494
  868   HD21  LEU 104          HD21      LEU 104   2.838  -2.292  26.938
  869   HD22  LEU 104          HD22      LEU 104   3.968  -2.470  25.610
  870   HD23  LEU 104          HD23      LEU 104   2.386  -1.730  25.318
  871    H    VAL 105           H        VAL 105   5.843  -3.337  26.902
  872    HA   VAL 105           HA       VAL 105   7.282  -4.917  28.882
  873    HB   VAL 105           HB       VAL 105   7.722  -2.171  27.714
  874   HG11  VAL 105          HG11      VAL 105  10.000  -2.242  28.688
  875   HG12  VAL 105          HG12      VAL 105   8.739  -2.166  29.926
  876   HG13  VAL 105          HG13      VAL 105   9.549  -3.711  29.592
  877   HG21  VAL 105          HG21      VAL 105   9.461  -4.630  27.286
  878   HG22  VAL 105          HG22      VAL 105   8.109  -4.258  26.219
  879   HG23  VAL 105          HG23      VAL 105   9.432  -3.113  26.343
  880    H    SER 106           H        SER 106   5.277  -1.934  28.818
  881    HA   SER 106           HA       SER 106   5.276  -1.857  31.777
  882    HB2  SER 106           HB2      SER 106   3.986  -0.058  29.694
  883    HB3  SER 106           HB3      SER 106   3.947   0.196  31.447
  884    HG   SER 106           HG       SER 106   6.129   0.314  29.656
  885    H    GLY 107           H        GLY 107   3.097  -2.756  29.119
  886    HA2  GLY 107           HA2      GLY 107   1.572  -4.681  29.789
  887    HA3  GLY 107           HA3      GLY 107   1.014  -3.621  31.090
  888    H    ASP 108           H        ASP 108  -1.013  -4.272  29.708
  889    HA   ASP 108           HA       ASP 108  -1.608  -3.354  27.208
  890    HB2  ASP 108           HB2      ASP 108  -3.873  -3.715  27.738
  891    HB3  ASP 108           HB3      ASP 108  -2.946  -4.900  28.654
  892    H    ALA 109           H        ALA 109  -1.479  -1.516  30.145
  893    HA   ALA 109           HA       ALA 109  -2.951   0.781  29.586
  894    HB1  ALA 109           HB1      ALA 109  -0.242   0.523  30.952
  895    HB2  ALA 109           HB2      ALA 109  -1.368   1.881  31.147
  896    HB3  ALA 109           HB3      ALA 109  -1.822   0.268  31.749
  897    H    GLU 110           H        GLU 110   0.211  -0.122  28.235
  898    HA   GLU 110           HA       GLU 110   0.764   2.605  27.520
  899    HB2  GLU 110           HB2      GLU 110   2.327   0.226  27.934
  900    HB3  GLU 110           HB3      GLU 110   2.727   0.837  26.341
  901    HG2  GLU 110           HG2      GLU 110   2.750   2.468  28.912
  902    HG3  GLU 110           HG3      GLU 110   4.169   1.755  28.154
  903    H    ILE 111           H        ILE 111  -1.449   1.280  26.317
  904    HA   ILE 111           HA       ILE 111  -0.867   1.548  23.406
  905    HB   ILE 111           HB       ILE 111  -3.017   0.010  24.898
  906   HG12  ILE 111          HG12      ILE 111  -1.035  -0.927  22.759
  907   HG13  ILE 111          HG13      ILE 111  -0.690  -0.984  24.513
  908   HG21  ILE 111          HG21      ILE 111  -2.910   0.924  22.033
  909   HG22  ILE 111          HG22      ILE 111  -3.733  -0.588  22.449
  910   HG23  ILE 111          HG23      ILE 111  -4.267   0.940  23.170
  911   HD11  ILE 111          HD11      ILE 111  -1.468  -3.169  23.624
  912   HD12  ILE 111          HD12      ILE 111  -2.489  -2.539  24.924
  913   HD13  ILE 111          HD13      ILE 111  -3.038  -2.471  23.240
  914    H    ASN 112           H        ASN 112  -1.826   3.158  22.306
  915    HA   ASN 112           HA       ASN 112  -3.830   4.926  23.638
  916    HB2  ASN 112           HB2      ASN 112  -1.804   6.227  23.670
  917    HB3  ASN 112           HB3      ASN 112  -1.353   5.684  22.052
  918   HD21  ASN 112          HD22      ASN 112  -1.219   7.886  21.190
  919   HD22  ASN 112          HD21      ASN 112  -2.708   8.744  20.833
  920    H    MET 113           H        MET 113  -5.683   4.870  22.433
  921    HA   MET 113           HA       MET 113  -5.654   3.584  19.790
  922    HB2  MET 113           HB2      MET 113  -7.837   4.605  21.649
  923    HB3  MET 113           HB3      MET 113  -8.183   3.933  20.057
  924    HG2  MET 113           HG2      MET 113  -6.513   2.402  22.079
  925    HG3  MET 113           HG3      MET 113  -8.279   2.320  22.074
  926    HE1  MET 113           HE1      MET 113  -6.511  -0.216  21.873
  927    HE2  MET 113           HE2      MET 113  -6.224  -0.872  20.235
  928    HE3  MET 113           HE3      MET 113  -5.209   0.453  20.844
  929    H    GLN 114           H        GLN 114  -5.356   6.828  20.884
  930    HA   GLN 114           HA       GLN 114  -6.679   7.977  18.513
  931    HB2  GLN 114           HB2      GLN 114  -6.023   9.214  21.203
  932    HB3  GLN 114           HB3      GLN 114  -6.623  10.092  19.782
  933    HG2  GLN 114           HG2      GLN 114  -8.715   8.878  19.808
  934    HG3  GLN 114           HG3      GLN 114  -8.143   7.787  21.082
  935   HE21  GLN 114          HE22      GLN 114  -8.999  11.241  20.395
  936   HE22  GLN 114          HE21      GLN 114  -9.387  11.636  22.054
  937    H    THR 115           H        THR 115  -4.866   7.128  17.439
  938    HA   THR 115           HA       THR 115  -2.176   7.956  17.975
  939    HB   THR 115           HB       THR 115  -1.987   6.753  15.661
  940    HG1  THR 115           HG1      THR 115  -3.731   5.640  14.999
  941   HG21  THR 115          HG21      THR 115  -3.239   5.365  18.121
  942   HG22  THR 115          HG22      THR 115  -2.326   4.536  16.833
  943   HG23  THR 115          HG23      THR 115  -1.509   5.699  17.889
  944    H    SER 116           H        SER 116  -4.236   8.332  15.179
  945    HA   SER 116           HA       SER 116  -3.188  10.989  14.445
  946    HB2  SER 116           HB2      SER 116  -5.345   9.300  13.131
  947    HB3  SER 116           HB3      SER 116  -4.546  10.715  12.438
  948    HG   SER 116           HG       SER 116  -2.611   9.548  12.352
  949    H    SER 117           H        SER 117  -5.186  12.544  13.718
  950    HA   SER 117           HA       SER 117  -6.662  13.345  15.989
  951    HB2  SER 117           HB2      SER 117  -7.447  13.713  13.069
  952    HB3  SER 117           HB3      SER 117  -7.870  14.765  14.428
  953    HG   SER 117           HG       SER 117  -5.693  15.379  14.589
  954    H    THR 118           H        THR 118  -7.383  10.997  13.408
  955    HA   THR 118           HA       THR 118  -9.940  10.202  14.543
  956    HB   THR 118           HB       THR 118  -9.224   8.369  12.673
  957    HG1  THR 118           HG1      THR 118  -8.518   9.533  10.848
  958   HG21  THR 118          HG21      THR 118 -10.903  10.851  12.344
  959   HG22  THR 118          HG22      THR 118 -10.936   9.412  11.277
  960   HG23  THR 118          HG23      THR 118 -11.394   9.251  12.976
  961    HA   PRO 119           HA       PRO 119  -7.556   7.091  16.797
  962    HB2  PRO 119           HB2      PRO 119  -9.645   5.587  17.760
  963    HB3  PRO 119           HB3      PRO 119  -9.111   7.109  18.509
  964    HG2  PRO 119           HG2      PRO 119 -11.409   6.666  16.600
  965    HG3  PRO 119           HG3      PRO 119 -11.379   7.688  18.069
  966    HD2  PRO 119           HD2      PRO 119 -11.053   8.684  15.508
  967    HD3  PRO 119           HD3      PRO 119 -10.257   9.439  16.918
  968    H    GLU 120           H        GLU 120  -6.730   5.263  15.849
  969    HA   GLU 120           HA       GLU 120  -7.740   4.461  13.309
  970    HB2  GLU 120           HB2      GLU 120  -5.363   3.910  14.885
  971    HB3  GLU 120           HB3      GLU 120  -5.986   2.397  14.254
  972    HG2  GLU 120           HG2      GLU 120  -5.318   4.880  12.635
  973    HG3  GLU 120           HG3      GLU 120  -4.381   3.390  12.709
  974    H    PHE 121           H        PHE 121  -8.602   3.359  16.483
  975    HA   PHE 121           HA       PHE 121 -10.191   1.165  15.262
  976    HB2  PHE 121           HB2      PHE 121  -8.898   1.178  17.979
  977    HB3  PHE 121           HB3      PHE 121  -9.998  -0.046  17.397
  978    HD1  PHE 121           HD1      PHE 121  -9.315  -1.515  15.420
  979    HD2  PHE 121           HD2      PHE 121  -6.539   1.013  17.509
  980    HE1  PHE 121           HE1      PHE 121  -7.446  -2.831  14.491
  981    HE2  PHE 121           HE2      PHE 121  -4.685  -0.404  16.709
  982    HZ   PHE 121           HZ       PHE 121  -5.112  -2.292  15.164
  983    H    ASP 122           H        ASP 122 -12.278   0.989  15.919
  984    HA   ASP 122           HA       ASP 122 -13.540   3.337  17.194
  985    HB2  ASP 122           HB2      ASP 122 -14.571   2.430  15.197
  986    HB3  ASP 122           HB3      ASP 122 -14.627   0.815  15.899
  987    H    GLY 123           H        GLY 123 -12.448   0.084  18.018
  988    HA2  GLY 123           HA2      GLY 123 -13.254   0.456  20.801
  989    HA3  GLY 123           HA3      GLY 123 -14.043  -0.896  19.959
  990    H    TRP 124           H        TRP 124 -12.212  -1.163  22.187
  991    HA   TRP 124           HA       TRP 124 -10.294  -2.988  20.935
  992    HB2  TRP 124           HB2      TRP 124  -8.380  -2.175  21.815
  993    HB3  TRP 124           HB3      TRP 124  -9.186  -0.685  21.380
  994    HD1  TRP 124           HD1      TRP 124 -10.882   0.011  23.845
  995    HE1  TRP 124           HE1      TRP 124  -9.970   0.310  26.204
  996    HE3  TRP 124           HE3      TRP 124  -6.341  -2.293  23.244
  997    HZ2  TRP 124           HZ2      TRP 124  -7.626  -0.521  27.715
  998    HZ3  TRP 124           HZ3      TRP 124  -4.741  -2.375  25.143
  999    HH2  TRP 124           HH2      TRP 124  -5.383  -1.538  27.373
 1000    H    ARG 125           H        ARG 125  -9.682  -4.721  22.367
 1001    HA   ARG 125           HA       ARG 125 -10.642  -4.760  25.097
 1002    HB2  ARG 125           HB2      ARG 125 -12.090  -6.728  24.874
 1003    HB3  ARG 125           HB3      ARG 125 -12.704  -5.367  23.959
 1004    HG2  ARG 125           HG2      ARG 125 -11.539  -6.477  21.888
 1005    HG3  ARG 125           HG3      ARG 125 -11.457  -7.922  22.896
 1006    HD2  ARG 125           HD2      ARG 125 -13.987  -6.343  22.268
 1007    HD3  ARG 125           HD3      ARG 125 -13.483  -7.787  21.392
 1008    HE   ARG 125           HE       ARG 125 -13.566  -8.511  24.102
 1009   HH11  ARG 125          HH11      ARG 125 -15.885  -7.379  21.653
 1010   HH12  ARG 125          HH12      ARG 125 -17.256  -8.115  22.403
 1011   HH21  ARG 125          HH21      ARG 125 -15.396  -9.515  25.096
 1012   HH22  ARG 125          HH22      ARG 125 -16.965  -9.351  24.405
 1013    H    TRP 126           H        TRP 126 -10.012  -6.971  26.082
 1014    HA   TRP 126           HA       TRP 126  -7.741  -8.223  24.648
 1015    HB2  TRP 126           HB2      TRP 126  -7.784  -7.037  27.407
 1016    HB3  TRP 126           HB3      TRP 126  -6.909  -8.539  27.156
 1017    HD1  TRP 126           HD1      TRP 126  -6.956  -4.952  25.603
 1018    HE1  TRP 126           HE1      TRP 126  -4.609  -4.337  24.915
 1019    HE3  TRP 126           HE3      TRP 126  -4.603  -9.363  26.713
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.966  -5.525  24.955
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.168  -9.586  26.367
 1022    HH2  TRP 126           HH2      TRP 126  -0.826  -7.668  25.548
 1023    H    VAL 127           H        VAL 127  -7.777 -10.440  24.704
 1024    HA   VAL 127           HA       VAL 127 -10.016 -11.837  26.091
 1025    HB   VAL 127           HB       VAL 127 -10.314 -12.901  23.679
 1026   HG11  VAL 127          HG11      VAL 127 -11.412 -10.140  24.383
 1027   HG12  VAL 127          HG12      VAL 127 -12.098 -11.221  23.162
 1028   HG13  VAL 127          HG13      VAL 127 -12.098 -11.708  24.870
 1029   HG21  VAL 127          HG21      VAL 127  -8.489 -11.706  22.556
 1030   HG22  VAL 127          HG22      VAL 127 -10.068 -11.431  21.799
 1031   HG23  VAL 127          HG23      VAL 127  -9.352 -10.169  22.811
 1032    H    SER 128           H        SER 128  -9.765 -14.241  26.044
 1033    HA   SER 128           HA       SER 128  -7.058 -15.220  26.086
 1034    HB2  SER 128           HB2      SER 128  -9.712 -16.680  25.746
 1035    HB3  SER 128           HB3      SER 128  -8.176 -17.407  26.280
 1036    HG   SER 128           HG       SER 128  -9.565 -16.865  28.065
 1037    H    TYR 129           H        TYR 129  -5.926 -16.420  24.442
 1038    HA   TYR 129           HA       TYR 129  -6.112 -15.370  21.923
 1039    HB2  TYR 129           HB2      TYR 129  -4.751 -17.637  21.313
 1040    HB3  TYR 129           HB3      TYR 129  -4.081 -16.223  22.065
 1041    HD1  TYR 129           HD1      TYR 129  -5.929 -19.307  23.247
 1042    HD2  TYR 129           HD2      TYR 129  -2.553 -16.665  23.739
 1043    HE1  TYR 129           HE1      TYR 129  -5.224 -20.600  25.230
 1044    HE2  TYR 129           HE2      TYR 129  -1.779 -18.031  25.670
 1045    HH   TYR 129           HH       TYR 129  -2.292 -19.799  27.142
 1046    H    TRP 130           H        TRP 130  -7.945 -18.324  22.854
 1047    HA   TRP 130           HA       TRP 130  -8.474 -18.823  20.007
 1048    HB2  TRP 130           HB2      TRP 130  -9.601 -20.227  22.433
 1049    HB3  TRP 130           HB3      TRP 130  -9.711 -20.758  20.757
 1050    HD1  TRP 130           HD1      TRP 130  -7.928 -21.696  23.643
 1051    HE1  TRP 130           HE1      TRP 130  -5.601 -22.668  23.206
 1052    HE3  TRP 130           HE3      TRP 130  -7.311 -20.243  18.741
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.671 -22.695  21.099
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.213 -20.793  17.547
 1055    HH2  TRP 130           HH2      TRP 130  -3.370 -21.978  18.718
 1056    H    TYR 131           H        TYR 131  -9.992 -16.941  22.509
 1057    HA   TYR 131           HA       TYR 131 -12.684 -17.145  21.604
 1058    HB2  TYR 131           HB2      TYR 131 -12.031 -16.423  23.819
 1059    HB3  TYR 131           HB3      TYR 131 -11.315 -14.952  23.163
 1060    HD1  TYR 131           HD2      TYR 131 -12.790 -13.169  22.169
 1061    HD2  TYR 131           HD1      TYR 131 -14.431 -16.670  24.087
 1062    HE1  TYR 131           HE2      TYR 131 -14.971 -12.033  22.347
 1063    HE2  TYR 131           HE1      TYR 131 -16.635 -15.551  24.246
 1064    HH   TYR 131           HH       TYR 131 -17.218 -12.208  23.033
 1065    HA   PRO 132           HA       PRO 132 -11.933 -13.047  19.128
 1066    HB2  PRO 132           HB2      PRO 132  -9.521 -12.826  17.775
 1067    HB3  PRO 132           HB3      PRO 132  -9.894 -12.072  19.363
 1068    HG2  PRO 132           HG2      PRO 132  -8.447 -14.663  18.843
 1069    HG3  PRO 132           HG3      PRO 132  -7.966 -13.313  19.922
 1070    HD2  PRO 132           HD2      PRO 132  -9.198 -15.429  20.914
 1071    HD3  PRO 132           HD3      PRO 132  -9.707 -13.820  21.474
 1072    H    VAL 133           H        VAL 133 -10.502 -16.143  18.219
 1073    HA   VAL 133           HA       VAL 133 -10.938 -16.010  15.405
 1074    HB   VAL 133           HB       VAL 133 -10.927 -18.514  17.125
 1075   HG11  VAL 133          HG11      VAL 133  -9.873 -19.573  15.195
 1076   HG12  VAL 133          HG12      VAL 133 -11.388 -18.832  14.694
 1077   HG13  VAL 133          HG13      VAL 133  -9.847 -18.027  14.308
 1078   HG21  VAL 133          HG21      VAL 133  -8.427 -18.579  16.848
 1079   HG22  VAL 133          HG22      VAL 133  -8.476 -16.938  16.170
 1080   HG23  VAL 133          HG23      VAL 133  -8.926 -17.239  17.861
 1081    H    ARG 134           H        ARG 134 -13.080 -16.622  18.170
 1082    HA   ARG 134           HA       ARG 134 -15.064 -18.101  16.674
 1083    HB2  ARG 134           HB2      ARG 134 -15.481 -16.541  19.246
 1084    HB3  ARG 134           HB3      ARG 134 -16.420 -17.907  18.642
 1085    HG2  ARG 134           HG2      ARG 134 -13.567 -18.079  19.645
 1086    HG3  ARG 134           HG3      ARG 134 -14.996 -18.439  20.597
 1087    HD2  ARG 134           HD2      ARG 134 -14.288 -19.828  18.007
 1088    HD3  ARG 134           HD3      ARG 134 -13.804 -20.427  19.594
 1089    HE   ARG 134           HE       ARG 134 -16.460 -20.496  18.344
 1090   HH11  ARG 134          HH11      ARG 134 -14.698 -20.926  21.415
 1091   HH12  ARG 134          HH12      ARG 134 -15.953 -21.851  22.155
 1092   HH21  ARG 134          HH21      ARG 134 -18.123 -21.710  19.347
 1093   HH22  ARG 134          HH22      ARG 134 -17.944 -22.289  20.962
 1094    H    GLN 135           H        GLN 135 -14.362 -14.646  16.987
 1095    HA   GLN 135           HA       GLN 135 -17.137 -13.872  16.388
 1096    HB2  GLN 135           HB2      GLN 135 -14.553 -12.263  16.564
 1097    HB3  GLN 135           HB3      GLN 135 -16.069 -11.580  16.015
 1098    HG2  GLN 135           HG2      GLN 135 -16.117 -10.963  18.205
 1099    HG3  GLN 135           HG3      GLN 135 -17.099 -12.421  18.245
 1100   HE21  GLN 135          HE22      GLN 135 -16.265 -14.270  19.427
 1101   HE22  GLN 135          HE21      GLN 135 -14.704 -14.241  20.233
 1102    H    VAL 136           H        VAL 136 -14.212 -14.442  14.482
 1103    HA   VAL 136           HA       VAL 136 -15.220 -12.885  12.245
 1104    HB   VAL 136           HB       VAL 136 -13.009 -13.681  11.236
 1105   HG11  VAL 136          HG11      VAL 136 -11.786 -11.971  12.524
 1106   HG12  VAL 136          HG12      VAL 136 -13.422 -11.432  12.160
 1107   HG13  VAL 136          HG13      VAL 136 -13.025 -12.015  13.790
 1108   HG21  VAL 136          HG21      VAL 136 -12.678 -15.587  12.941
 1109   HG22  VAL 136          HG22      VAL 136 -11.295 -14.557  12.590
 1110   HG23  VAL 136          HG23      VAL 136 -12.216 -14.325  14.093
 1111    H    VAL 137           H        VAL 137 -15.043 -13.695   9.996
 1112    HA   VAL 137           HA       VAL 137 -16.649 -16.139   9.632
 1113    HB   VAL 137           HB       VAL 137 -17.078 -15.350   7.461
 1114   HG11  VAL 137          HG11      VAL 137 -17.877 -13.104   7.648
 1115   HG12  VAL 137          HG12      VAL 137 -18.098 -13.890   9.215
 1116   HG13  VAL 137          HG13      VAL 137 -16.773 -12.726   8.981
 1117   HG21  VAL 137          HG21      VAL 137 -15.685 -13.365   6.490
 1118   HG22  VAL 137          HG22      VAL 137 -14.465 -13.838   7.730
 1119   HG23  VAL 137          HG23      VAL 137 -14.999 -14.995   6.504
 1120    H    SER 138           H        SER 138 -15.862 -17.467   7.536
 1121    HA   SER 138           HA       SER 138 -13.716 -18.998   8.342
 1122    HB2  SER 138           HB2      SER 138 -14.868 -18.668   5.562
 1123    HB3  SER 138           HB3      SER 138 -13.984 -20.091   6.177
 1124    HG   SER 138           HG       SER 138 -16.305 -20.310   6.349
 1125    H    PHE 139           H        PHE 139 -13.527 -16.449   5.743
 1126    HA   PHE 139           HA       PHE 139 -10.854 -17.023   5.052
 1127    HB2  PHE 139           HB2      PHE 139 -12.324 -14.352   4.930
 1128    HB3  PHE 139           HB3      PHE 139 -10.800 -14.705   4.134
 1129    HD1  PHE 139           HD1      PHE 139 -10.688 -16.567   2.383
 1130    HD2  PHE 139           HD2      PHE 139 -14.394 -14.847   3.798
 1131    HE1  PHE 139           HE1      PHE 139 -11.855 -17.379   0.346
 1132    HE2  PHE 139           HE2      PHE 139 -15.545 -15.667   1.764
 1133    HZ   PHE 139           HZ       PHE 139 -14.279 -16.927   0.032
 1134    H    LYS 140           H        LYS 140 -12.091 -14.787   7.574
 1135    HA   LYS 140           HA       LYS 140  -9.324 -14.015   8.306
 1136    HB2  LYS 140           HB2      LYS 140 -12.058 -13.161   9.279
 1137    HB3  LYS 140           HB3      LYS 140 -10.666 -13.001  10.341
 1138    HG2  LYS 140           HG2      LYS 140 -10.808 -10.926   9.286
 1139    HG3  LYS 140           HG3      LYS 140  -9.448 -11.745   8.541
 1140    HD2  LYS 140           HD2      LYS 140 -10.649 -10.596   6.830
 1141    HD3  LYS 140           HD3      LYS 140 -10.930 -12.324   6.582
 1142    HE2  LYS 140           HE2      LYS 140 -13.139 -12.193   7.591
 1143    HE3  LYS 140           HE3      LYS 140 -12.846 -10.542   8.150
 1144    HZ1  LYS 140           HZ1      LYS 140 -14.218 -10.527   6.148
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.799  -9.790   5.845
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.069 -11.303   5.272
 1147    H    ARG 141           H        ARG 141 -11.882 -16.175   9.525
 1148    HA   ARG 141           HA       ARG 141 -10.652 -17.005  11.949
 1149    HB2  ARG 141           HB2      ARG 141 -12.174 -18.674   9.896
 1150    HB3  ARG 141           HB3      ARG 141 -11.554 -19.363  11.390
 1151    HG2  ARG 141           HG2      ARG 141 -12.957 -18.058  12.759
 1152    HG3  ARG 141           HG3      ARG 141 -13.416 -17.000  11.423
 1153    HD2  ARG 141           HD2      ARG 141 -15.229 -18.554  12.006
 1154    HD3  ARG 141           HD3      ARG 141 -14.671 -18.770  10.349
 1155    HE   ARG 141           HE       ARG 141 -13.651 -20.498  12.563
 1156   HH11  ARG 141          HH11      ARG 141 -15.572 -20.343   9.534
 1157   HH12  ARG 141          HH12      ARG 141 -15.658 -22.051   9.377
 1158   HH21  ARG 141          HH21      ARG 141 -13.804 -22.764  12.308
 1159   HH22  ARG 141          HH22      ARG 141 -14.662 -23.444  10.978
 1160    H    ASP 142           H        ASP 142  -9.908 -18.250   8.630
 1161    HA   ASP 142           HA       ASP 142  -8.029 -20.167   9.560
 1162    HB2  ASP 142           HB2      ASP 142  -9.006 -20.188   7.287
 1163    HB3  ASP 142           HB3      ASP 142  -8.053 -18.760   6.866
 1164    H    VAL 143           H        VAL 143  -7.508 -16.770   8.461
 1165    HA   VAL 143           HA       VAL 143  -4.663 -16.919   8.878
 1166    HB   VAL 143           HB       VAL 143  -6.584 -14.550   8.711
 1167   HG11  VAL 143          HG11      VAL 143  -4.624 -13.114   8.357
 1168   HG12  VAL 143          HG12      VAL 143  -4.510 -13.863   9.952
 1169   HG13  VAL 143          HG13      VAL 143  -3.540 -14.501   8.603
 1170   HG21  VAL 143          HG21      VAL 143  -6.384 -15.838   6.621
 1171   HG22  VAL 143          HG22      VAL 143  -5.523 -14.296   6.462
 1172   HG23  VAL 143          HG23      VAL 143  -4.616 -15.800   6.729
 1173    H    TYR 144           H        TYR 144  -7.332 -15.616  10.959
 1174    HA   TYR 144           HA       TYR 144  -5.468 -14.871  12.960
 1175    HB2  TYR 144           HB2      TYR 144  -8.472 -15.140  13.024
 1176    HB3  TYR 144           HB3      TYR 144  -7.538 -14.421  14.314
 1177    HD1  TYR 144           HD1      TYR 144  -5.518 -13.085  11.961
 1178    HD2  TYR 144           HD2      TYR 144  -9.711 -12.991  12.969
 1179    HE1  TYR 144           HE1      TYR 144  -5.754 -10.978  10.756
 1180    HE2  TYR 144           HE2      TYR 144  -9.922 -10.794  11.828
 1181    HH   TYR 144           HH       TYR 144  -8.872  -9.257  10.378
 1182    H    ARG 145           H        ARG 145  -7.199 -17.992  12.591
 1183    HA   ARG 145           HA       ARG 145  -6.236 -18.876  15.183
 1184    HB2  ARG 145           HB2      ARG 145  -6.894 -21.047  14.633
 1185    HB3  ARG 145           HB3      ARG 145  -8.073 -19.984  13.865
 1186    HG2  ARG 145           HG2      ARG 145  -6.719 -20.233  11.731
 1187    HG3  ARG 145           HG3      ARG 145  -5.816 -21.532  12.519
 1188    HD2  ARG 145           HD2      ARG 145  -8.814 -21.427  12.057
 1189    HD3  ARG 145           HD3      ARG 145  -7.627 -22.285  11.048
 1190    HE   ARG 145           HE       ARG 145  -7.308 -23.174  13.729
 1191   HH11  ARG 145          HH11      ARG 145  -9.657 -23.491  11.073
 1192   HH12  ARG 145          HH12      ARG 145 -10.251 -25.023  11.604
 1193   HH21  ARG 145          HH21      ARG 145  -8.134 -25.185  14.455
 1194   HH22  ARG 145          HH22      ARG 145  -9.376 -25.996  13.578
 1195    H    ARG 146           H        ARG 146  -4.773 -19.033  11.836
 1196    HA   ARG 146           HA       ARG 146  -2.385 -20.299  12.699
 1197    HB2  ARG 146           HB2      ARG 146  -3.147 -18.533  10.333
 1198    HB3  ARG 146           HB3      ARG 146  -1.448 -18.732  10.721
 1199    HG2  ARG 146           HG2      ARG 146  -1.736 -20.428   9.234
 1200    HG3  ARG 146           HG3      ARG 146  -1.865 -21.249  10.783
 1201    HD2  ARG 146           HD2      ARG 146  -4.377 -21.199  10.512
 1202    HD3  ARG 146           HD3      ARG 146  -4.128 -20.498   8.903
 1203    HE   ARG 146           HE       ARG 146  -3.253 -23.205   9.827
 1204   HH11  ARG 146          HH21      ARG 146  -4.450 -21.236   7.088
 1205   HH12  ARG 146          HH22      ARG 146  -3.838 -22.317   5.894
 1206   HH21  ARG 146          HH11      ARG 146  -2.692 -24.738   8.218
 1207   HH22  ARG 146          HH12      ARG 146  -3.001 -24.421   6.553
 1208    H    VAL 147           H        VAL 147  -3.141 -16.765  12.605
 1209    HA   VAL 147           HA       VAL 147  -0.694 -15.845  13.564
 1210    HB   VAL 147           HB       VAL 147  -3.525 -14.768  13.916
 1211   HG11  VAL 147          HG11      VAL 147  -2.497 -12.508  14.186
 1212   HG12  VAL 147          HG12      VAL 147  -2.195 -13.566  15.555
 1213   HG13  VAL 147          HG13      VAL 147  -0.905 -13.281  14.362
 1214   HG21  VAL 147          HG21      VAL 147  -2.844 -13.281  12.026
 1215   HG22  VAL 147          HG22      VAL 147  -1.273 -14.127  11.984
 1216   HG23  VAL 147          HG23      VAL 147  -2.737 -14.967  11.549
 1217    H    MET 148           H        MET 148  -3.114 -17.601  15.365
 1218    HA   MET 148           HA       MET 148  -1.997 -16.759  17.983
 1219    HB2  MET 148           HB2      MET 148  -4.300 -18.627  17.329
 1220    HB3  MET 148           HB3      MET 148  -3.746 -18.205  18.959
 1221    HG2  MET 148           HG2      MET 148  -4.767 -16.178  16.947
 1222    HG3  MET 148           HG3      MET 148  -5.778 -17.000  18.119
 1223    HE1  MET 148           HE1      MET 148  -3.657 -14.201  17.191
 1224    HE2  MET 148           HE2      MET 148  -3.375 -13.268  18.668
 1225    HE3  MET 148           HE3      MET 148  -2.287 -14.621  18.252
 1226    H    LYS 149           H        LYS 149  -2.568 -19.803  16.114
 1227    HA   LYS 149           HA       LYS 149  -1.067 -21.445  17.850
 1228    HB2  LYS 149           HB2      LYS 149  -2.727 -22.276  16.476
 1229    HB3  LYS 149           HB3      LYS 149  -1.999 -21.699  14.983
 1230    HG2  LYS 149           HG2      LYS 149  -0.782 -23.888  16.738
 1231    HG3  LYS 149           HG3      LYS 149  -1.956 -24.184  15.453
 1232    HD2  LYS 149           HD2      LYS 149  -0.272 -22.844  13.930
 1233    HD3  LYS 149           HD3      LYS 149   0.916 -23.266  15.169
 1234    HE2  LYS 149           HE2      LYS 149  -0.856 -25.232  13.655
 1235    HE3  LYS 149           HE3      LYS 149   0.812 -24.838  13.225
 1236    HZ1  LYS 149           HZ1      LYS 149  -0.027 -26.154  15.758
 1237    HZ2  LYS 149           HZ2      LYS 149   0.714 -26.875  14.499
 1238    HZ3  LYS 149           HZ3      LYS 149   1.523 -25.763  15.372
 1239    H    GLU 150           H        GLU 150   0.124 -19.499  15.046
 1240    HA   GLU 150           HA       GLU 150   2.561 -20.695  14.791
 1241    HB2  GLU 150           HB2      GLU 150   1.410 -18.839  13.367
 1242    HB3  GLU 150           HB3      GLU 150   2.024 -17.700  14.544
 1243    HG2  GLU 150           HG2      GLU 150   3.665 -17.671  13.014
 1244    HG3  GLU 150           HG3      GLU 150   4.351 -18.866  14.069
 1245    H    PHE 151           H        PHE 151   1.497 -18.340  17.210
 1246    HA   PHE 151           HA       PHE 151   4.206 -18.347  18.485
 1247    HB2  PHE 151           HB2      PHE 151   2.069 -16.326  19.069
 1248    HB3  PHE 151           HB3      PHE 151   3.825 -16.245  19.255
 1249    HD1  PHE 151           HD2      PHE 151   5.106 -16.716  16.767
 1250    HD2  PHE 151           HD1      PHE 151   1.299 -14.762  17.510
 1251    HE1  PHE 151           HE2      PHE 151   5.102 -15.779  14.534
 1252    HE2  PHE 151           HE1      PHE 151   1.448 -13.662  15.317
 1253    HZ   PHE 151           HZ       PHE 151   3.367 -14.176  13.808
 1254    H    ALA 152           H        ALA 152   1.090 -19.698  18.933
 1255    HA   ALA 152           HA       ALA 152   0.437 -19.183  21.549
 1256    HB1  ALA 152           HB1      ALA 152  -1.042 -20.400  19.987
 1257    HB2  ALA 152           HB2      ALA 152   0.071 -21.783  19.966
 1258    HB3  ALA 152           HB3      ALA 152  -0.801 -21.356  21.456
 1259    H    SER 153           H        SER 153   2.646 -21.676  20.347
 1260    HA   SER 153           HA       SER 153   3.089 -22.954  22.856
 1261    HB2  SER 153           HB2      SER 153   4.953 -22.844  20.453
 1262    HB3  SER 153           HB3      SER 153   4.889 -24.106  21.698
 1263    HG   SER 153           HG       SER 153   3.751 -24.762  19.824
 1264    H    VAL 154           H        VAL 154   4.540 -20.108  21.318
 1265    HA   VAL 154           HA       VAL 154   6.763 -19.897  23.193
 1266    HB   VAL 154           HB       VAL 154   5.550 -17.754  21.404
 1267   HG11  VAL 154          HG11      VAL 154   7.756 -16.656  21.611
 1268   HG12  VAL 154          HG12      VAL 154   6.999 -16.844  23.203
 1269   HG13  VAL 154          HG13      VAL 154   8.303 -17.942  22.704
 1270   HG21  VAL 154          HG21      VAL 154   6.281 -19.619  19.971
 1271   HG22  VAL 154          HG22      VAL 154   7.441 -18.303  19.838
 1272   HG23  VAL 154          HG23      VAL 154   7.827 -19.710  20.843
 1273    H    VAL 155           H        VAL 155   3.459 -18.525  22.847
 1274    HA   VAL 155           HA       VAL 155   3.605 -16.734  24.993
 1275    HB   VAL 155           HB       VAL 155   1.142 -18.287  24.109
 1276   HG11  VAL 155          HG11      VAL 155   1.465 -15.724  25.766
 1277   HG12  VAL 155          HG12      VAL 155  -0.079 -16.277  25.062
 1278   HG13  VAL 155          HG13      VAL 155   0.732 -17.251  26.297
 1279   HG21  VAL 155          HG21      VAL 155   2.058 -15.490  23.325
 1280   HG22  VAL 155          HG22      VAL 155   2.192 -16.922  22.286
 1281   HG23  VAL 155          HG23      VAL 155   0.597 -16.364  22.754
 1282    H    MET 156           H        MET 156   2.760 -20.285  25.139
 1283    HA   MET 156           HA       MET 156   2.033 -20.336  27.798
 1284    HB2  MET 156           HB2      MET 156   3.745 -22.432  26.344
 1285    HB3  MET 156           HB3      MET 156   2.744 -22.730  27.765
 1286    HG2  MET 156           HG2      MET 156   1.833 -22.083  24.955
 1287    HG3  MET 156           HG3      MET 156   1.622 -23.598  25.800
 1288    HE1  MET 156           HE1      MET 156  -0.446 -21.034  24.308
 1289    HE2  MET 156           HE2      MET 156  -0.665 -22.803  24.312
 1290    HE3  MET 156           HE3      MET 156  -1.907 -21.753  25.020
 1291    H    SER 157           H        SER 157   5.230 -20.949  26.412
 1292    HA   SER 157           HA       SER 157   6.594 -21.271  28.869
 1293    HB2  SER 157           HB2      SER 157   7.303 -20.857  25.962
 1294    HB3  SER 157           HB3      SER 157   8.573 -21.135  27.208
 1295    HG   SER 157           HG       SER 157   7.879 -23.099  26.205
 1296    H    LEU 158           H        LEU 158   5.863 -18.410  26.928
 1297    HA   LEU 158           HA       LEU 158   7.732 -16.589  28.031
 1298    HB2  LEU 158           HB2      LEU 158   6.661 -16.490  25.905
 1299    HB3  LEU 158           HB3      LEU 158   5.070 -16.380  26.613
 1300    HG   LEU 158           HG       LEU 158   6.292 -14.463  25.491
 1301   HD11  LEU 158          HD11      LEU 158   4.842 -12.853  26.517
 1302   HD12  LEU 158          HD12      LEU 158   4.017 -14.415  26.449
 1303   HD13  LEU 158          HD13      LEU 158   4.701 -13.887  27.996
 1304   HD21  LEU 158          HD21      LEU 158   7.408 -12.844  26.916
 1305   HD22  LEU 158          HD22      LEU 158   7.361 -14.007  28.261
 1306   HD23  LEU 158          HD23      LEU 158   8.291 -14.378  26.779
 1307    H    GLN 159           H        GLN 159   4.464 -17.657  29.116
 1308    HA   GLN 159           HA       GLN 159   4.375 -15.819  31.399
 1309    HB2  GLN 159           HB2      GLN 159   3.145 -18.602  31.382
 1310    HB3  GLN 159           HB3      GLN 159   2.518 -17.155  32.154
 1311    HG2  GLN 159           HG2      GLN 159   1.747 -16.331  29.910
 1312    HG3  GLN 159           HG3      GLN 159   2.457 -17.781  29.191
 1313   HE21  GLN 159          HE22      GLN 159   0.144 -17.205  31.937
 1314   HE22  GLN 159          HE21      GLN 159  -0.914 -18.523  31.448
 1315    H    GLU 160           H        GLU 160   6.061 -18.811  30.811
 1316    HA   GLU 160           HA       GLU 160   6.443 -19.410  33.651
 1317    HB2  GLU 160           HB2      GLU 160   7.242 -20.938  31.140
 1318    HB3  GLU 160           HB3      GLU 160   7.509 -21.497  32.794
 1319    HG2  GLU 160           HG2      GLU 160   5.056 -21.359  33.232
 1320    HG3  GLU 160           HG3      GLU 160   4.800 -20.937  31.548
 1321    H    ASN 161           H        ASN 161   7.716 -17.333  31.673
 1322    HA   ASN 161           HA       ASN 161  10.570 -17.660  32.599
 1323    HB2  ASN 161           HB2      ASN 161   9.580 -17.061  29.798
 1324    HB3  ASN 161           HB3      ASN 161  11.094 -16.367  30.375
 1325   HD21  ASN 161          HD22      ASN 161   9.413 -19.530  29.948
 1326   HD22  ASN 161          HD21      ASN 161  10.893 -20.472  29.843
 1327    H    THR 162           H        THR 162   8.114 -15.363  31.322
 1328    HA   THR 162           HA       THR 162   9.233 -13.209  32.992
 1329    HB   THR 162           HB       THR 162   7.801 -11.808  31.731
 1330    HG1  THR 162           HG1      THR 162   6.714 -14.130  30.531
 1331   HG21  THR 162          HG21      THR 162   9.138 -13.721  29.807
 1332   HG22  THR 162          HG22      THR 162   8.694 -12.036  29.518
 1333   HG23  THR 162          HG23      THR 162   9.938 -12.422  30.713
 1334    HA   PRO 163           HA       PRO 163   6.623 -13.906  36.322
 1335    HB2  PRO 163           HB2      PRO 163   5.568 -11.581  37.154
 1336    HB3  PRO 163           HB3      PRO 163   7.307 -11.653  36.738
 1337    HG2  PRO 163           HG2      PRO 163   5.009 -10.753  34.979
 1338    HG3  PRO 163           HG3      PRO 163   6.551  -9.878  35.297
 1339    HD2  PRO 163           HD2      PRO 163   6.063 -11.615  33.118
 1340    HD3  PRO 163           HD3      PRO 163   7.698 -11.201  33.780
 1341    H    LYS 164           H        LYS 164   4.147 -13.044  37.356
 1342    HA   LYS 164           HA       LYS 164   2.184 -14.330  35.536
 1343    HB2  LYS 164           HB2      LYS 164   1.742 -13.237  38.333
 1344    HB3  LYS 164           HB3      LYS 164   0.675 -14.300  37.425
 1345    HG2  LYS 164           HG2      LYS 164   3.391 -15.035  38.621
 1346    HG3  LYS 164           HG3      LYS 164   1.810 -15.465  39.236
 1347    HD2  LYS 164           HD2      LYS 164   2.557 -17.417  38.240
 1348    HD3  LYS 164           HD3      LYS 164   1.413 -16.765  37.064
 1349    HE2  LYS 164           HE2      LYS 164   3.264 -15.931  35.671
 1350    HE3  LYS 164           HE3      LYS 164   4.441 -16.368  36.914
 1351    HZ1  LYS 164           HZ1      LYS 164   2.761 -18.337  35.455
 1352    HZ2  LYS 164           HZ2      LYS 164   4.309 -17.946  35.060
 1353    HZ3  LYS 164           HZ3      LYS 164   3.982 -18.682  36.502
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1  -0.693   0.307   0.448
    2    H2   MET   1           H2       MET   1  -0.406   1.885   0.072
    3    H3   MET   1           H3       MET   1  -1.626   1.072  -0.652
    4    HA   MET   1           HA       MET   1   0.155   1.310  -2.192
    5    HB2  MET   1           HB2      MET   1   2.371   0.600  -1.839
    6    HB3  MET   1           HB3      MET   1   1.943   1.437  -0.364
    7    HG2  MET   1           HG2      MET   1   3.159  -0.422   0.344
    8    HG3  MET   1           HG3      MET   1   1.496  -0.850   0.691
    9    HE1  MET   1           HE1      MET   1   4.252  -2.895  -2.421
   10    HE2  MET   1           HE2      MET   1   3.834  -1.186  -2.644
   11    HE3  MET   1           HE3      MET   1   4.776  -1.702  -1.215
   12    H    ILE   2           H        ILE   2   0.660  -0.379  -3.796
   13    HA   ILE   2           HA       ILE   2  -0.092  -3.156  -3.167
   14    HB   ILE   2           HB       ILE   2  -1.191  -1.520  -5.447
   15   HG12  ILE   2          HG12      ILE   2  -2.298  -2.451  -2.975
   16   HG13  ILE   2          HG13      ILE   2  -3.034  -1.456  -4.226
   17   HG21  ILE   2          HG21      ILE   2  -1.257  -4.539  -5.260
   18   HG22  ILE   2          HG22      ILE   2  -2.075  -3.552  -6.476
   19   HG23  ILE   2          HG23      ILE   2  -0.310  -3.604  -6.446
   20   HD11  ILE   2          HD11      ILE   2  -3.969  -3.532  -5.252
   21   HD12  ILE   2          HD12      ILE   2  -3.134  -4.481  -3.953
   22   HD13  ILE   2          HD13      ILE   2  -4.416  -3.334  -3.559
   23    H    ASP   3           H        ASP   3   1.336  -4.568  -4.146
   24    HA   ASP   3           HA       ASP   3   3.909  -3.555  -4.473
   25    HB2  ASP   3           HB2      ASP   3   3.346  -5.821  -3.638
   26    HB3  ASP   3           HB3      ASP   3   2.840  -6.264  -5.280
   27    H    ASP   4           H        ASP   4   1.685  -4.862  -6.955
   28    HA   ASP   4           HA       ASP   4   3.228  -3.579  -9.057
   29    HB2  ASP   4           HB2      ASP   4   4.236  -5.836  -8.685
   30    HB3  ASP   4           HB3      ASP   4   2.648  -6.551  -8.998
   31    H    ASP   5           H        ASP   5   1.327  -5.975 -10.338
   32    HA   ASP   5           HA       ASP   5  -0.819  -4.209 -11.097
   33    HB2  ASP   5           HB2      ASP   5   0.175  -5.836 -12.660
   34    HB3  ASP   5           HB3      ASP   5  -0.310  -7.165 -11.597
   35    H    GLY   6           H        GLY   6  -0.196  -6.365  -8.523
   36    HA2  GLY   6           HA2      GLY   6  -2.624  -5.951  -7.144
   37    HA3  GLY   6           HA3      GLY   6  -2.657  -7.556  -7.892
   38    H    TYR   7           H        TYR   7  -2.726  -7.757  -5.391
   39    HA   TYR   7           HA       TYR   7  -2.015  -8.359  -3.424
   40    HB2  TYR   7           HB2      TYR   7   0.637  -9.202  -4.599
   41    HB3  TYR   7           HB3      TYR   7  -0.130  -9.763  -3.115
   42    HD1  TYR   7           HD2      TYR   7  -2.245 -11.133  -3.222
   43    HD2  TYR   7           HD1      TYR   7   0.086 -10.203  -6.723
   44    HE1  TYR   7           HE2      TYR   7  -3.331 -12.999  -4.437
   45    HE2  TYR   7           HE1      TYR   7  -0.951 -12.098  -7.933
   46    HH   TYR   7           HH       TYR   7  -2.519 -13.845  -7.845
   47    H    ARG   8           H        ARG   8  -0.753  -7.826  -1.516
   48    HA   ARG   8           HA       ARG   8   1.227  -5.699  -1.853
   49    HB2  ARG   8           HB2      ARG   8   0.150  -4.135  -0.323
   50    HB3  ARG   8           HB3      ARG   8  -0.841  -4.397  -1.760
   51    HG2  ARG   8           HG2      ARG   8  -1.559  -6.063   0.622
   52    HG3  ARG   8           HG3      ARG   8  -1.833  -4.329   0.726
   53    HD2  ARG   8           HD2      ARG   8  -3.158  -4.362  -1.355
   54    HD3  ARG   8           HD3      ARG   8  -2.837  -6.072  -1.562
   55    HE   ARG   8           HE       ARG   8  -4.451  -6.610  -0.058
   56   HH11  ARG   8          HH21      ARG   8  -3.880  -3.106   0.312
   57   HH12  ARG   8          HH22      ARG   8  -5.131  -2.896   1.484
   58   HH21  ARG   8          HH12      ARG   8  -5.994  -6.351   1.596
   59   HH22  ARG   8          HH11      ARG   8  -6.400  -4.772   2.188
   60    HA   PRO   9           HA       PRO   9   2.656  -8.212   1.607
   61    HB2  PRO   9           HB2      PRO   9   4.950  -6.899   2.289
   62    HB3  PRO   9           HB3      PRO   9   4.805  -7.873   0.799
   63    HG2  PRO   9           HG2      PRO   9   4.480  -4.856   1.077
   64    HG3  PRO   9           HG3      PRO   9   5.479  -5.764  -0.101
   65    HD2  PRO   9           HD2      PRO   9   2.984  -4.847  -0.688
   66    HD3  PRO   9           HD3      PRO   9   3.589  -6.396  -1.339
   67    H    ASN  10           H        ASN  10   2.251  -8.144   3.809
   68    HA   ASN  10           HA       ASN  10   1.470  -5.537   5.036
   69    HB2  ASN  10           HB2      ASN  10  -0.474  -6.506   3.909
   70    HB3  ASN  10           HB3      ASN  10  -0.155  -8.068   4.640
   71   HD21  ASN  10          HD22      ASN  10  -1.939  -5.125   4.986
   72   HD22  ASN  10          HD21      ASN  10  -2.525  -5.459   6.598
   73    H    VAL  11           H        VAL  11   1.303  -5.653   7.372
   74    HA   VAL  11           HA       VAL  11   2.639  -7.949   8.659
   75    HB   VAL  11           HB       VAL  11   3.781  -6.245  10.181
   76   HG11  VAL  11          HG11      VAL  11   4.615  -6.898   7.410
   77   HG12  VAL  11          HG12      VAL  11   5.626  -5.795   8.386
   78   HG13  VAL  11          HG13      VAL  11   5.274  -7.411   8.972
   79   HG21  VAL  11          HG21      VAL  11   2.570  -4.193   9.459
   80   HG22  VAL  11          HG22      VAL  11   4.308  -4.054   9.277
   81   HG23  VAL  11          HG23      VAL  11   3.313  -4.326   7.846
   82    H    GLY  12           H        GLY  12   1.605  -8.565  10.430
   83    HA2  GLY  12           HA2      GLY  12  -0.408  -6.765  11.674
   84    HA3  GLY  12           HA3      GLY  12  -0.631  -8.489  11.447
   85    H    ILE  13           H        ILE  13  -0.674  -7.079  13.904
   86    HA   ILE  13           HA       ILE  13   1.814  -7.900  15.330
   87    HB   ILE  13           HB       ILE  13  -0.006  -5.472  15.413
   88   HG12  ILE  13          HG12      ILE  13   2.925  -5.081  15.620
   89   HG13  ILE  13          HG13      ILE  13   2.441  -5.938  14.149
   90   HG21  ILE  13          HG21      ILE  13   1.204  -4.672  17.404
   91   HG22  ILE  13          HG22      ILE  13   0.213  -6.079  17.755
   92   HG23  ILE  13          HG23      ILE  13   1.969  -6.272  17.562
   93   HD11  ILE  13          HD11      ILE  13   0.785  -4.141  13.654
   94   HD12  ILE  13          HD12      ILE  13   1.416  -3.236  15.060
   95   HD13  ILE  13          HD13      ILE  13   2.471  -3.594  13.676
   96    H    VAL  14           H        VAL  14   1.549  -8.979  17.227
   97    HA   VAL  14           HA       VAL  14  -1.191  -9.267  18.355
   98    HB   VAL  14           HB       VAL  14   0.956 -11.437  18.435
   99   HG11  VAL  14          HG11      VAL  14  -0.723 -11.551  20.235
  100   HG12  VAL  14          HG12      VAL  14  -2.033 -11.452  19.046
  101   HG13  VAL  14          HG13      VAL  14  -0.962 -12.872  19.101
  102   HG21  VAL  14          HG21      VAL  14  -0.370 -12.679  16.746
  103   HG22  VAL  14          HG22      VAL  14  -1.322 -11.202  16.440
  104   HG23  VAL  14          HG23      VAL  14   0.430 -11.246  16.089
  105    H    ILE  15           H        ILE  15  -1.169  -8.835  20.599
  106    HA   ILE  15           HA       ILE  15   1.479  -8.665  21.882
  107    HB   ILE  15           HB       ILE  15  -0.762  -6.784  22.724
  108   HG12  ILE  15          HG12      ILE  15  -0.025  -6.131  20.402
  109   HG13  ILE  15          HG13      ILE  15   0.274  -4.936  21.651
  110   HG21  ILE  15          HG21      ILE  15   0.774  -7.258  24.469
  111   HG22  ILE  15          HG22      ILE  15   2.179  -6.988  23.402
  112   HG23  ILE  15          HG23      ILE  15   1.107  -5.630  23.820
  113   HD11  ILE  15          HD11      ILE  15   2.639  -5.465  21.736
  114   HD12  ILE  15          HD12      ILE  15   2.402  -6.876  20.686
  115   HD13  ILE  15          HD13      ILE  15   2.176  -5.238  20.036
  116    H    CYS  16           H        CYS  16   1.559  -9.961  23.735
  117    HA   CYS  16           HA       CYS  16  -1.096 -10.731  24.831
  118    HB2  CYS  16           HB2      CYS  16  -0.437 -12.999  25.260
  119    HB3  CYS  16           HB3      CYS  16  -0.187 -12.659  23.534
  120    HG   CYS  16           HG       CYS  16   1.683 -14.208  24.719
  121    H    ASN  17           H        ASN  17  -1.146 -11.392  27.029
  122    HA   ASN  17           HA       ASN  17   1.010 -10.201  28.713
  123    HB2  ASN  17           HB2      ASN  17  -0.636  -9.689  30.379
  124    HB3  ASN  17           HB3      ASN  17  -1.182  -9.026  28.851
  125   HD21  ASN  17          HD22      ASN  17  -3.252  -8.977  30.280
  126   HD22  ASN  17          HD21      ASN  17  -4.254 -10.405  30.215
  127    H    ARG  18           H        ARG  18   1.078 -11.516  30.973
  128    HA   ARG  18           HA       ARG  18   1.529 -14.298  30.184
  129    HB2  ARG  18           HB2      ARG  18   1.984 -12.732  32.774
  130    HB3  ARG  18           HB3      ARG  18   2.050 -14.495  32.763
  131    HG2  ARG  18           HG2      ARG  18   4.211 -14.147  32.341
  132    HG3  ARG  18           HG3      ARG  18   3.601 -14.235  30.703
  133    HD2  ARG  18           HD2      ARG  18   5.065 -12.506  30.632
  134    HD3  ARG  18           HD3      ARG  18   3.526 -11.636  30.777
  135    HE   ARG  18           HE       ARG  18   4.101 -11.575  33.298
  136   HH11  ARG  18          HH11      ARG  18   6.438 -11.071  30.632
  137   HH12  ARG  18          HH12      ARG  18   7.731 -10.606  31.709
  138   HH21  ARG  18          HH21      ARG  18   5.709 -10.565  34.620
  139   HH22  ARG  18          HH22      ARG  18   7.217 -10.086  33.937
  140    H    GLN  19           H        GLN  19  -1.340 -12.866  30.910
  141    HA   GLN  19           HA       GLN  19  -2.462 -15.194  32.285
  142    HB2  GLN  19           HB2      GLN  19  -4.050 -12.975  30.978
  143    HB3  GLN  19           HB3      GLN  19  -4.560 -14.066  32.256
  144    HG2  GLN  19           HG2      GLN  19  -2.590 -11.768  32.446
  145    HG3  GLN  19           HG3      GLN  19  -4.198 -11.830  33.134
  146   HE21  GLN  19          HE22      GLN  19  -1.549 -11.403  34.532
  147   HE22  GLN  19          HE21      GLN  19  -1.460 -12.659  35.740
  148    H    GLY  20           H        GLY  20  -1.433 -14.475  29.106
  149    HA2  GLY  20           HA2      GLY  20  -1.654 -15.737  27.202
  150    HA3  GLY  20           HA3      GLY  20  -2.856 -16.774  27.993
  151    H    GLN  21           H        GLN  21  -3.306 -13.237  28.158
  152    HA   GLN  21           HA       GLN  21  -5.576 -13.554  26.293
  153    HB2  GLN  21           HB2      GLN  21  -4.914 -11.187  28.069
  154    HB3  GLN  21           HB3      GLN  21  -6.335 -11.378  27.051
  155    HG2  GLN  21           HG2      GLN  21  -5.669 -13.132  29.456
  156    HG3  GLN  21           HG3      GLN  21  -6.786 -11.780  29.460
  157   HE21  GLN  21          HE22      GLN  21  -8.845 -11.979  28.195
  158   HE22  GLN  21          HE21      GLN  21  -9.484 -13.594  27.992
  159    H    VAL  22           H        VAL  22  -5.709 -12.126  24.488
  160    HA   VAL  22           HA       VAL  22  -3.134 -10.986  23.582
  161    HB   VAL  22           HB       VAL  22  -3.655 -11.658  21.339
  162   HG11  VAL  22          HG11      VAL  22  -3.283 -14.050  21.539
  163   HG12  VAL  22          HG12      VAL  22  -2.372 -13.183  22.784
  164   HG13  VAL  22          HG13      VAL  22  -3.855 -14.045  23.237
  165   HG21  VAL  22          HG21      VAL  22  -5.517 -13.221  20.815
  166   HG22  VAL  22          HG22      VAL  22  -6.192 -12.950  22.438
  167   HG23  VAL  22          HG23      VAL  22  -6.086 -11.612  21.276
  168    H    MET  23           H        MET  23  -3.204  -9.086  22.450
  169    HA   MET  23           HA       MET  23  -5.330  -7.189  22.842
  170    HB2  MET  23           HB2      MET  23  -3.092  -6.413  22.547
  171    HB3  MET  23           HB3      MET  23  -2.846  -7.371  21.091
  172    HG2  MET  23           HG2      MET  23  -3.018  -5.023  20.530
  173    HG3  MET  23           HG3      MET  23  -4.307  -5.955  19.788
  174    HE1  MET  23           HE1      MET  23  -4.777  -2.914  23.214
  175    HE2  MET  23           HE2      MET  23  -4.102  -4.510  23.599
  176    HE3  MET  23           HE3      MET  23  -3.229  -3.423  22.501
  177    H    TRP  24           H        TRP  24  -7.231  -7.023  21.705
  178    HA   TRP  24           HA       TRP  24  -7.320  -7.693  18.844
  179    HB2  TRP  24           HB2      TRP  24  -8.035  -9.695  20.252
  180    HB3  TRP  24           HB3      TRP  24  -9.357  -8.703  20.848
  181    HD1  TRP  24           HD1      TRP  24  -8.091  -9.515  17.246
  182    HE1  TRP  24           HE1      TRP  24 -10.039 -10.479  15.900
  183    HE3  TRP  24           HE3      TRP  24 -11.718  -9.295  20.825
  184    HZ2  TRP  24           HZ2      TRP  24 -12.769 -11.271  16.382
  185    HZ3  TRP  24           HZ3      TRP  24 -14.024 -10.073  20.329
  186    HH2  TRP  24           HH2      TRP  24 -14.562 -11.024  18.111
  187    H    ALA  25           H        ALA  25  -8.799  -6.111  17.815
  188    HA   ALA  25           HA       ALA  25 -10.122  -4.206  19.671
  189    HB1  ALA  25           HB1      ALA  25  -7.990  -3.439  17.650
  190    HB2  ALA  25           HB2      ALA  25  -8.888  -2.330  18.728
  191    HB3  ALA  25           HB3      ALA  25  -7.754  -3.506  19.397
  192    H    ARG  26           H        ARG  26 -11.645  -2.841  18.836
  193    HA   ARG  26           HA       ARG  26 -13.101  -3.842  16.474
  194    HB2  ARG  26           HB2      ARG  26 -14.297  -3.466  18.610
  195    HB3  ARG  26           HB3      ARG  26 -13.768  -1.786  18.612
  196    HG2  ARG  26           HG2      ARG  26 -15.019  -1.528  16.375
  197    HG3  ARG  26           HG3      ARG  26 -15.724  -3.119  16.677
  198    HD2  ARG  26           HD2      ARG  26 -15.831  -0.824  18.672
  199    HD3  ARG  26           HD3      ARG  26 -17.044  -1.008  17.402
  200    HE   ARG  26           HE       ARG  26 -16.996  -3.463  18.704
  201   HH11  ARG  26          HH11      ARG  26 -17.511  -0.066  19.703
  202   HH12  ARG  26          HH12      ARG  26 -18.676  -0.464  20.920
  203   HH21  ARG  26          HH21      ARG  26 -18.626  -3.966  20.298
  204   HH22  ARG  26          HH22      ARG  26 -19.277  -2.721  21.294
  205    H    ARG  27           H        ARG  27 -12.814  -2.697  14.429
  206    HA   ARG  27           HA       ARG  27 -11.003  -0.381  14.635
  207    HB2  ARG  27           HB2      ARG  27 -10.658  -2.211  12.984
  208    HB3  ARG  27           HB3      ARG  27 -12.092  -1.665  12.113
  209    HG2  ARG  27           HG2      ARG  27 -11.010   0.597  11.829
  210    HG3  ARG  27           HG3      ARG  27  -9.638   0.007  12.780
  211    HD2  ARG  27           HD2      ARG  27  -9.521  -1.843  10.878
  212    HD3  ARG  27           HD3      ARG  27 -10.401  -0.639   9.944
  213    HE   ARG  27           HE       ARG  27  -8.585   0.846  10.091
  214   HH11  ARG  27          HH11      ARG  27  -7.650  -2.313  11.578
  215   HH12  ARG  27          HH12      ARG  27  -6.093  -1.683  12.099
  216   HH21  ARG  27          HH21      ARG  27  -6.576   1.584  10.926
  217   HH22  ARG  27          HH22      ARG  27  -5.495   0.446  11.677
  218    H    PHE  28           H        PHE  28 -11.441   1.693  13.857
  219    HA   PHE  28           HA       PHE  28 -13.603   2.970  14.854
  220    HB2  PHE  28           HB2      PHE  28 -11.512   3.984  14.026
  221    HB3  PHE  28           HB3      PHE  28 -12.009   3.711  12.367
  222    HD1  PHE  28           HD1      PHE  28 -12.490   5.768  15.393
  223    HD2  PHE  28           HD2      PHE  28 -13.736   5.134  11.309
  224    HE1  PHE  28           HE1      PHE  28 -13.471   8.044  15.338
  225    HE2  PHE  28           HE2      PHE  28 -14.748   7.398  11.273
  226    HZ   PHE  28           HZ       PHE  28 -14.617   8.859  13.284
  227    H    GLY  29           H        GLY  29 -15.724   2.796  14.498
  228    HA2  GLY  29           HA2      GLY  29 -17.743   2.914  13.473
  229    HA3  GLY  29           HA3      GLY  29 -16.919   3.330  11.973
  230    H    GLN  30           H        GLN  30 -15.665   0.302  12.889
  231    HA   GLN  30           HA       GLN  30 -17.200  -0.879  10.694
  232    HB2  GLN  30           HB2      GLN  30 -15.041  -2.160  12.417
  233    HB3  GLN  30           HB3      GLN  30 -15.678  -2.764  10.894
  234    HG2  GLN  30           HG2      GLN  30 -13.937  -0.331  11.350
  235    HG3  GLN  30           HG3      GLN  30 -13.557  -1.793  10.462
  236   HE21  GLN  30          HE22      GLN  30 -14.649   1.445  10.110
  237   HE22  GLN  30          HE21      GLN  30 -15.227   1.319   8.458
  238    H    HIS  31           H        HIS  31 -17.179  -1.127  14.200
  239    HA   HIS  31           HA       HIS  31 -18.127  -2.513  15.699
  240    HB2  HIS  31           HB2      HIS  31 -20.400  -2.753  13.711
  241    HB3  HIS  31           HB3      HIS  31 -20.468  -3.068  15.440
  242    HD1  HIS  31           HD1      HIS  31 -20.480  -0.133  12.986
  243    HD2  HIS  31           HD2      HIS  31 -20.334  -0.917  17.125
  244    HE1  HIS  31           HE1      HIS  31 -20.964   2.071  14.149
  245    H    SER  32           H        SER  32 -16.208  -3.673  13.921
  246    HA   SER  32           HA       SER  32 -16.762  -6.527  14.376
  247    HB2  SER  32           HB2      SER  32 -15.633  -5.370  11.782
  248    HB3  SER  32           HB3      SER  32 -15.759  -7.091  12.187
  249    HG   SER  32           HG       SER  32 -17.512  -6.328  10.852
  250    H    TRP  33           H        TRP  33 -14.691  -7.724  14.640
  251    HA   TRP  33           HA       TRP  33 -12.681  -5.887  15.833
  252    HB2  TRP  33           HB2      TRP  33 -13.495  -8.707  16.456
  253    HB3  TRP  33           HB3      TRP  33 -12.234  -7.792  17.306
  254    HD1  TRP  33           HD1      TRP  33 -16.042  -7.984  16.885
  255    HE1  TRP  33           HE1      TRP  33 -17.196  -6.785  18.810
  256    HE3  TRP  33           HE3      TRP  33 -11.905  -6.167  19.248
  257    HZ2  TRP  33           HZ2      TRP  33 -16.410  -5.069  21.045
  258    HZ3  TRP  33           HZ3      TRP  33 -12.137  -4.682  21.231
  259    HH2  TRP  33           HH2      TRP  33 -14.380  -4.111  22.114
  260    H    GLN  34           H        GLN  34 -10.462  -6.372  15.706
  261    HA   GLN  34           HA       GLN  34  -9.507  -8.231  13.599
  262    HB2  GLN  34           HB2      GLN  34  -8.968  -5.218  13.776
  263    HB3  GLN  34           HB3      GLN  34  -8.146  -6.327  12.681
  264    HG2  GLN  34           HG2      GLN  34 -10.306  -6.754  11.509
  265    HG3  GLN  34           HG3      GLN  34 -11.081  -5.546  12.544
  266   HE21  GLN  34          HE22      GLN  34 -11.181  -5.117   9.816
  267   HE22  GLN  34          HE21      GLN  34 -10.082  -3.847   9.350
  268    H    PHE  35           H        PHE  35  -7.161  -8.460  13.643
  269    HA   PHE  35           HA       PHE  35  -5.883  -7.808  16.253
  270    HB2  PHE  35           HB2      PHE  35  -4.929  -9.431  13.865
  271    HB3  PHE  35           HB3      PHE  35  -3.975  -9.102  15.315
  272    HD1  PHE  35           HD1      PHE  35  -5.493  -9.698  17.587
  273    HD2  PHE  35           HD2      PHE  35  -5.450 -11.727  13.753
  274    HE1  PHE  35           HE1      PHE  35  -6.243 -11.780  18.684
  275    HE2  PHE  35           HE2      PHE  35  -6.158 -13.804  14.891
  276    HZ   PHE  35           HZ       PHE  35  -6.603 -13.842  17.320
  277    HA   PRO  36           HA       PRO  36  -4.570  -4.066  14.305
  278    HB2  PRO  36           HB2      PRO  36  -2.091  -3.568  15.504
  279    HB3  PRO  36           HB3      PRO  36  -3.687  -3.291  16.271
  280    HG2  PRO  36           HG2      PRO  36  -1.874  -5.682  16.583
  281    HG3  PRO  36           HG3      PRO  36  -2.736  -4.765  17.850
  282    HD2  PRO  36           HD2      PRO  36  -3.699  -7.102  16.870
  283    HD3  PRO  36           HD3      PRO  36  -4.813  -5.749  17.243
  284    H    GLN  37           H        GLN  37  -3.643  -3.552  12.282
  285    HA   GLN  37           HA       GLN  37  -1.253  -4.909  11.347
  286    HB2  GLN  37           HB2      GLN  37  -2.286  -6.311   9.644
  287    HB3  GLN  37           HB3      GLN  37  -2.967  -6.733  11.205
  288    HG2  GLN  37           HG2      GLN  37  -4.903  -5.069  10.568
  289    HG3  GLN  37           HG3      GLN  37  -4.243  -5.179   8.937
  290   HE21  GLN  37          HE22      GLN  37  -5.838  -6.963  11.582
  291   HE22  GLN  37          HE21      GLN  37  -6.450  -8.269  10.575
  292    H    GLY  38           H        GLY  38  -0.660  -4.365   9.101
  293    HA2  GLY  38           HA2      GLY  38  -2.161  -2.534   7.498
  294    HA3  GLY  38           HA3      GLY  38  -0.944  -1.648   8.409
  295    H    GLY  39           H        GLY  39  -0.417  -1.388   5.834
  296    HA2  GLY  39           HA2      GLY  39   0.760  -3.668   4.550
  297    HA3  GLY  39           HA3      GLY  39   0.597  -2.037   3.928
  298    H    ILE  40           H        ILE  40   2.833  -3.795   3.849
  299    HA   ILE  40           HA       ILE  40   5.020  -2.444   5.367
  300    HB   ILE  40           HB       ILE  40   4.946  -4.682   3.306
  301   HG12  ILE  40          HG12      ILE  40   6.190  -4.850   6.052
  302   HG13  ILE  40          HG13      ILE  40   4.456  -5.107   5.856
  303   HG21  ILE  40          HG21      ILE  40   7.446  -4.869   3.596
  304   HG22  ILE  40          HG22      ILE  40   6.943  -3.395   2.801
  305   HG23  ILE  40          HG23      ILE  40   7.403  -3.363   4.518
  306   HD11  ILE  40          HD11      ILE  40   4.743  -7.042   4.582
  307   HD12  ILE  40          HD12      ILE  40   6.442  -6.694   4.189
  308   HD13  ILE  40          HD13      ILE  40   6.016  -7.206   5.813
  309    H    ASN  41           H        ASN  41   6.010  -0.613   4.473
  310    HA   ASN  41           HA       ASN  41   4.877   0.490   2.016
  311    HB2  ASN  41           HB2      ASN  41   7.145   1.408   3.836
  312    HB3  ASN  41           HB3      ASN  41   6.701   2.252   2.364
  313   HD21  ASN  41          HD22      ASN  41   5.501   1.257   5.556
  314   HD22  ASN  41          HD21      ASN  41   4.124   2.369   5.587
  315    HA   PRO  42           HA       PRO  42   7.787  -1.342  -0.821
  316    HB2  PRO  42           HB2      PRO  42   8.432   0.726  -2.547
  317    HB3  PRO  42           HB3      PRO  42   6.916  -0.222  -2.611
  318    HG2  PRO  42           HG2      PRO  42   7.376   2.466  -1.282
  319    HG3  PRO  42           HG3      PRO  42   6.034   1.977  -2.365
  320    HD2  PRO  42           HD2      PRO  42   5.735   1.980   0.321
  321    HD3  PRO  42           HD3      PRO  42   5.025   0.669  -0.664
  322    H    GLY  43           H        GLY  43   9.846  -1.823  -0.221
  323    HA2  GLY  43           HA2      GLY  43  12.116  -1.467   0.119
  324    HA3  GLY  43           HA3      GLY  43  11.845   0.267   0.297
  325    H    GLU  44           H        GLU  44   9.550  -1.034   2.393
  326    HA   GLU  44           HA       GLU  44  11.282  -0.785   4.716
  327    HB2  GLU  44           HB2      GLU  44   8.393  -0.847   4.237
  328    HB3  GLU  44           HB3      GLU  44   8.846  -1.958   5.523
  329    HG2  GLU  44           HG2      GLU  44   9.920  -0.234   6.784
  330    HG3  GLU  44           HG3      GLU  44   9.674   0.943   5.477
  331    H    SER  45           H        SER  45  11.579  -2.492   6.236
  332    HA   SER  45           HA       SER  45  11.542  -5.254   5.124
  333    HB2  SER  45           HB2      SER  45  12.984  -4.216   7.592
  334    HB3  SER  45           HB3      SER  45  13.131  -5.820   6.854
  335    HG   SER  45           HG       SER  45  14.861  -4.436   6.227
  336    H    ALA  46           H        ALA  46  10.558  -6.911   6.531
  337    HA   ALA  46           HA       ALA  46   7.972  -6.174   7.217
  338    HB1  ALA  46           HB1      ALA  46   7.835  -8.442   8.243
  339    HB2  ALA  46           HB2      ALA  46   8.604  -8.460   6.638
  340    HB3  ALA  46           HB3      ALA  46   9.596  -8.596   8.125
  341    H    GLU  47           H        GLU  47  10.698  -6.695   9.474
  342    HA   GLU  47           HA       GLU  47   9.158  -6.274  11.850
  343    HB2  GLU  47           HB2      GLU  47  11.241  -7.520  11.678
  344    HB3  GLU  47           HB3      GLU  47  12.131  -6.056  11.244
  345    HG2  GLU  47           HG2      GLU  47  11.490  -5.093  13.492
  346    HG3  GLU  47           HG3      GLU  47  10.761  -6.653  13.888
  347    H    GLN  48           H        GLN  48  10.850  -4.062   9.620
  348    HA   GLN  48           HA       GLN  48  10.820  -1.792  11.371
  349    HB2  GLN  48           HB2      GLN  48  11.041  -1.888   8.359
  350    HB3  GLN  48           HB3      GLN  48  11.333  -0.466   9.356
  351    HG2  GLN  48           HG2      GLN  48  12.813  -3.092   9.726
  352    HG3  GLN  48           HG3      GLN  48  13.387  -1.826   8.638
  353   HE21  GLN  48          HE22      GLN  48  14.884  -2.953  10.785
  354   HE22  GLN  48          HE21      GLN  48  15.200  -1.677  11.927
  355    H    ALA  49           H        ALA  49   8.647  -3.056   8.765
  356    HA   ALA  49           HA       ALA  49   6.741  -0.906   8.894
  357    HB1  ALA  49           HB1      ALA  49   6.452  -3.798   7.999
  358    HB2  ALA  49           HB2      ALA  49   5.324  -2.475   7.642
  359    HB3  ALA  49           HB3      ALA  49   6.963  -2.454   6.955
  360    H    MET  50           H        MET  50   7.085  -4.084  10.566
  361    HA   MET  50           HA       MET  50   4.580  -4.096  11.893
  362    HB2  MET  50           HB2      MET  50   5.984  -6.043  11.875
  363    HB3  MET  50           HB3      MET  50   7.316  -5.202  12.646
  364    HG2  MET  50           HG2      MET  50   4.650  -5.676  13.989
  365    HG3  MET  50           HG3      MET  50   6.020  -6.776  14.078
  366    HE1  MET  50           HE1      MET  50   8.643  -5.093  16.278
  367    HE2  MET  50           HE2      MET  50   8.249  -6.404  15.149
  368    HE3  MET  50           HE3      MET  50   8.624  -4.777  14.536
  369    H    TYR  51           H        TYR  51   7.761  -2.644  12.991
  370    HA   TYR  51           HA       TYR  51   6.536  -1.627  15.328
  371    HB2  TYR  51           HB2      TYR  51   8.998  -0.687  13.802
  372    HB3  TYR  51           HB3      TYR  51   8.466   0.034  15.324
  373    HD1  TYR  51           HD1      TYR  51   7.936  -1.756  17.275
  374    HD2  TYR  51           HD2      TYR  51  10.725  -2.269  14.025
  375    HE1  TYR  51           HE1      TYR  51   9.371  -3.171  18.717
  376    HE2  TYR  51           HE2      TYR  51  12.152  -3.664  15.452
  377    HH   TYR  51           HH       TYR  51  12.481  -4.564  17.609
  378    H    ARG  52           H        ARG  52   6.759  -0.119  11.935
  379    HA   ARG  52           HA       ARG  52   5.739   2.421  12.764
  380    HB2  ARG  52           HB2      ARG  52   6.783   2.037  10.589
  381    HB3  ARG  52           HB3      ARG  52   5.547   0.843  10.174
  382    HG2  ARG  52           HG2      ARG  52   3.805   2.701  10.319
  383    HG3  ARG  52           HG3      ARG  52   5.141   3.856  10.495
  384    HD2  ARG  52           HD2      ARG  52   4.934   1.795   8.274
  385    HD3  ARG  52           HD3      ARG  52   4.227   3.414   8.100
  386    HE   ARG  52           HE       ARG  52   7.016   2.569   7.998
  387   HH11  ARG  52          HH11      ARG  52   4.950   5.465   8.361
  388   HH12  ARG  52          HH12      ARG  52   6.196   6.562   7.892
  389   HH21  ARG  52          HH21      ARG  52   8.631   4.013   7.400
  390   HH22  ARG  52          HH22      ARG  52   8.349   5.719   7.330
  391    H    GLU  53           H        GLU  53   4.070  -0.618  11.683
  392    HA   GLU  53           HA       GLU  53   1.510   0.599  11.869
  393    HB2  GLU  53           HB2      GLU  53   2.356  -2.289  11.677
  394    HB3  GLU  53           HB3      GLU  53   0.658  -1.782  11.770
  395    HG2  GLU  53           HG2      GLU  53   2.694  -0.866   9.719
  396    HG3  GLU  53           HG3      GLU  53   1.402  -2.035   9.423
  397    H    LEU  54           H        LEU  54   3.569  -0.954  14.274
  398    HA   LEU  54           HA       LEU  54   1.593  -1.236  16.304
  399    HB2  LEU  54           HB2      LEU  54   3.899  -2.226  16.223
  400    HB3  LEU  54           HB3      LEU  54   4.556  -0.605  16.522
  401    HG   LEU  54           HG       LEU  54   3.095  -0.672  18.688
  402   HD11  LEU  54          HD11      LEU  54   3.410  -3.649  18.013
  403   HD12  LEU  54          HD12      LEU  54   2.772  -2.976  19.542
  404   HD13  LEU  54          HD13      LEU  54   1.890  -2.733  18.026
  405   HD21  LEU  54          HD21      LEU  54   5.579  -0.673  18.618
  406   HD22  LEU  54          HD22      LEU  54   4.951  -1.716  19.894
  407   HD23  LEU  54          HD23      LEU  54   5.562  -2.441  18.380
  408    H    PHE  55           H        PHE  55   3.706   1.559  15.369
  409    HA   PHE  55           HA       PHE  55   2.640   3.303  17.388
  410    HB2  PHE  55           HB2      PHE  55   4.761   3.700  16.171
  411    HB3  PHE  55           HB3      PHE  55   3.866   3.971  14.684
  412    HD1  PHE  55           HD2      PHE  55   4.455   5.288  18.128
  413    HD2  PHE  55           HD1      PHE  55   2.845   6.109  14.207
  414    HE1  PHE  55           HE2      PHE  55   4.244   7.692  18.712
  415    HE2  PHE  55           HE1      PHE  55   2.637   8.512  14.800
  416    HZ   PHE  55           HZ       PHE  55   3.348   9.310  17.048
  417    H    GLU  56           H        GLU  56   1.594   2.542  14.021
  418    HA   GLU  56           HA       GLU  56  -0.368   4.543  13.932
  419    HB2  GLU  56           HB2      GLU  56   0.026   2.006  12.350
  420    HB3  GLU  56           HB3      GLU  56  -1.249   3.165  11.981
  421    HG2  GLU  56           HG2      GLU  56   1.661   4.005  12.162
  422    HG3  GLU  56           HG3      GLU  56   0.959   3.381  10.673
  423    H    GLU  57           H        GLU  57  -0.561   1.116  15.023
  424    HA   GLU  57           HA       GLU  57  -3.491   1.223  15.082
  425    HB2  GLU  57           HB2      GLU  57  -1.479  -0.999  15.624
  426    HB3  GLU  57           HB3      GLU  57  -3.222  -1.195  15.648
  427    HG2  GLU  57           HG2      GLU  57  -1.716  -0.335  13.152
  428    HG3  GLU  57           HG3      GLU  57  -2.059  -2.006  13.581
  429    H    VAL  58           H        VAL  58  -0.853   0.432  17.419
  430    HA   VAL  58           HA       VAL  58  -2.850   0.575  19.612
  431    HB   VAL  58           HB       VAL  58  -0.383  -0.297  20.690
  432   HG11  VAL  58          HG11      VAL  58  -1.507  -2.479  20.888
  433   HG12  VAL  58          HG12      VAL  58  -2.562  -1.165  21.366
  434   HG13  VAL  58          HG13      VAL  58  -2.778  -1.935  19.762
  435   HG21  VAL  58          HG21      VAL  58   0.645  -0.743  18.625
  436   HG22  VAL  58          HG22      VAL  58   0.184  -2.271  19.368
  437   HG23  VAL  58          HG23      VAL  58  -0.758  -1.654  17.997
  438    H    GLY  59           H        GLY  59  -0.405   2.518  18.176
  439    HA2  GLY  59           HA2      GLY  59   0.315   4.625  18.744
  440    HA3  GLY  59           HA3      GLY  59  -0.731   4.619  20.169
  441    H    LEU  60           H        LEU  60   1.443   1.907  19.655
  442    HA   LEU  60           HA       LEU  60   3.016   2.626  22.051
  443    HB2  LEU  60           HB2      LEU  60   1.448   0.768  22.116
  444    HB3  LEU  60           HB3      LEU  60   2.095   0.152  20.591
  445    HG   LEU  60           HG       LEU  60   4.241  -0.453  21.784
  446   HD11  LEU  60          HD11      LEU  60   4.119   1.082  23.691
  447   HD12  LEU  60          HD12      LEU  60   2.625   0.301  24.247
  448   HD13  LEU  60          HD13      LEU  60   4.151  -0.616  24.217
  449   HD21  LEU  60          HD21      LEU  60   1.567  -1.481  22.943
  450   HD22  LEU  60          HD22      LEU  60   2.129  -1.881  21.327
  451   HD23  LEU  60          HD23      LEU  60   3.065  -2.434  22.720
  452    H    SER  61           H        SER  61   5.260   2.165  21.971
  453    HA   SER  61           HA       SER  61   6.456   2.104  19.229
  454    HB2  SER  61           HB2      SER  61   7.370   3.839  21.555
  455    HB3  SER  61           HB3      SER  61   7.942   3.880  19.873
  456    HG   SER  61           HG       SER  61   6.398   5.550  20.378
  457    H    ARG  62           H        ARG  62   8.848   1.662  19.347
  458    HA   ARG  62           HA       ARG  62   9.349  -0.925  20.088
  459    HB2  ARG  62           HB2      ARG  62  11.533   1.206  20.010
  460    HB3  ARG  62           HB3      ARG  62  11.684  -0.527  19.737
  461    HG2  ARG  62           HG2      ARG  62   9.890  -0.029  17.814
  462    HG3  ARG  62           HG3      ARG  62  10.558   1.610  17.945
  463    HD2  ARG  62           HD2      ARG  62  12.837   0.660  17.604
  464    HD3  ARG  62           HD3      ARG  62  12.103  -0.958  17.414
  465    HE   ARG  62           HE       ARG  62  10.750   0.678  15.632
  466   HH11  ARG  62          HH11      ARG  62  14.096  -0.446  15.980
  467   HH12  ARG  62          HH12      ARG  62  14.489  -0.235  14.312
  468   HH21  ARG  62          HH21      ARG  62  11.289   1.055  13.439
  469   HH22  ARG  62          HH22      ARG  62  12.771   0.449  12.793
  470    H    LYS  63           H        LYS  63   9.827   1.952  22.104
  471    HA   LYS  63           HA       LYS  63  11.601   0.763  23.947
  472    HB2  LYS  63           HB2      LYS  63   9.648   3.021  24.581
  473    HB3  LYS  63           HB3      LYS  63  11.242   2.721  25.303
  474    HG2  LYS  63           HG2      LYS  63  10.649   3.782  22.527
  475    HG3  LYS  63           HG3      LYS  63  11.377   4.653  23.876
  476    HD2  LYS  63           HD2      LYS  63  12.604   2.157  22.706
  477    HD3  LYS  63           HD3      LYS  63  12.943   3.739  22.015
  478    HE2  LYS  63           HE2      LYS  63  13.421   3.062  24.956
  479    HE3  LYS  63           HE3      LYS  63  14.647   2.818  23.706
  480    HZ1  LYS  63           HZ1      LYS  63  13.461   5.450  24.426
  481    HZ2  LYS  63           HZ2      LYS  63  14.961   4.927  24.801
  482    HZ3  LYS  63           HZ3      LYS  63  14.573   5.206  23.242
  483    H    ASP  64           H        ASP  64   8.131   0.419  23.687
  484    HA   ASP  64           HA       ASP  64   8.250  -0.961  26.331
  485    HB2  ASP  64           HB2      ASP  64   6.950   1.242  26.241
  486    HB3  ASP  64           HB3      ASP  64   5.701   0.310  25.429
  487    H    VAL  65           H        VAL  65   8.742  -2.017  23.618
  488    HA   VAL  65           HA       VAL  65   7.064  -4.416  24.036
  489    HB   VAL  65           HB       VAL  65   7.008  -4.762  21.553
  490   HG11  VAL  65          HG11      VAL  65   5.447  -2.369  22.533
  491   HG12  VAL  65          HG12      VAL  65   4.979  -3.528  21.249
  492   HG13  VAL  65          HG13      VAL  65   5.054  -4.049  22.940
  493   HG21  VAL  65          HG21      VAL  65   8.735  -3.035  20.962
  494   HG22  VAL  65          HG22      VAL  65   7.235  -2.953  20.017
  495   HG23  VAL  65          HG23      VAL  65   7.527  -1.795  21.329
  496    H    ARG  66           H        ARG  66   7.992  -6.351  23.041
  497    HA   ARG  66           HA       ARG  66  10.830  -6.251  22.252
  498    HB2  ARG  66           HB2      ARG  66  11.489  -8.019  23.752
  499    HB3  ARG  66           HB3      ARG  66  10.773  -6.726  24.709
  500    HG2  ARG  66           HG2      ARG  66   8.538  -8.276  24.331
  501    HG3  ARG  66           HG3      ARG  66   9.762  -9.525  24.178
  502    HD2  ARG  66           HD2      ARG  66   9.304  -7.566  26.454
  503    HD3  ARG  66           HD3      ARG  66   8.919  -9.304  26.460
  504    HE   ARG  66           HE       ARG  66  11.671  -9.073  25.923
  505   HH11  ARG  66          HH21      ARG  66   9.577  -8.212  28.699
  506   HH12  ARG  66          HH22      ARG  66  10.891  -8.325  29.841
  507   HH21  ARG  66          HH11      ARG  66  13.304  -9.398  27.530
  508   HH22  ARG  66          HH12      ARG  66  12.921  -9.153  29.210
  509    H    ILE  67           H        ILE  67  11.179  -7.985  20.618
  510    HA   ILE  67           HA       ILE  67   8.643  -9.115  19.605
  511    HB   ILE  67           HB       ILE  67  11.455  -9.284  18.505
  512   HG12  ILE  67          HG12      ILE  67   9.236  -7.707  17.204
  513   HG13  ILE  67          HG13      ILE  67  10.291  -6.957  18.415
  514   HG21  ILE  67          HG21      ILE  67  10.088 -11.225  17.816
  515   HG22  ILE  67          HG22      ILE  67   8.788 -10.137  17.277
  516   HG23  ILE  67          HG23      ILE  67  10.348 -10.173  16.431
  517   HD11  ILE  67          HD11      ILE  67  12.262  -7.570  17.020
  518   HD12  ILE  67          HD12      ILE  67  11.149  -8.195  15.773
  519   HD13  ILE  67          HD13      ILE  67  11.119  -6.478  16.207
  520    H    LEU  68           H        LEU  68   7.960 -10.937  20.321
  521    HA   LEU  68           HA       LEU  68   9.840 -12.811  21.715
  522    HB2  LEU  68           HB2      LEU  68   6.807 -12.727  21.505
  523    HB3  LEU  68           HB3      LEU  68   7.742 -13.935  22.366
  524    HG   LEU  68           HG       LEU  68   7.571 -11.000  23.141
  525   HD11  LEU  68          HD11      LEU  68   5.536 -11.993  23.650
  526   HD12  LEU  68          HD12      LEU  68   6.263 -13.579  24.051
  527   HD13  LEU  68          HD13      LEU  68   6.480 -12.213  25.148
  528   HD21  LEU  68          HD21      LEU  68   9.782 -11.908  23.742
  529   HD22  LEU  68          HD22      LEU  68   8.779 -11.722  25.180
  530   HD23  LEU  68          HD23      LEU  68   9.011 -13.339  24.477
  531    H    ALA  69           H        ALA  69   7.739 -12.436  18.872
  532    HA   ALA  69           HA       ALA  69   8.741 -14.906  17.675
  533    HB1  ALA  69           HB1      ALA  69   5.771 -14.906  18.096
  534    HB2  ALA  69           HB2      ALA  69   6.857 -16.239  17.705
  535    HB3  ALA  69           HB3      ALA  69   6.832 -15.580  19.350
  536    H    SER  70           H        SER  70   7.879 -15.257  15.618
  537    HA   SER  70           HA       SER  70   6.257 -13.326  14.294
  538    HB2  SER  70           HB2      SER  70   8.032 -12.717  12.558
  539    HB3  SER  70           HB3      SER  70   8.172 -11.956  14.150
  540    HG   SER  70           HG       SER  70  10.205 -12.753  13.392
  541    H    THR  71           H        THR  71   5.716 -14.026  12.052
  542    HA   THR  71           HA       THR  71   5.251 -16.824  12.093
  543    HB   THR  71           HB       THR  71   4.630 -16.168   9.594
  544    HG1  THR  71           HG1      THR  71   5.431 -14.102   9.626
  545   HG21  THR  71          HG21      THR  71   2.841 -16.881  10.676
  546   HG22  THR  71          HG22      THR  71   3.119 -15.924  12.140
  547   HG23  THR  71          HG23      THR  71   2.429 -15.165  10.667
  548    H    ARG  72           H        ARG  72   5.929 -18.511  11.006
  549    HA   ARG  72           HA       ARG  72   8.700 -18.488  10.057
  550    HB2  ARG  72           HB2      ARG  72   6.609 -20.695  10.068
  551    HB3  ARG  72           HB3      ARG  72   8.341 -20.937   9.889
  552    HG2  ARG  72           HG2      ARG  72   8.781 -20.684  12.152
  553    HG3  ARG  72           HG3      ARG  72   7.525 -19.485  12.396
  554    HD2  ARG  72           HD2      ARG  72   5.876 -21.465  11.903
  555    HD3  ARG  72           HD3      ARG  72   7.232 -22.491  12.386
  556    HE   ARG  72           HE       ARG  72   5.442 -20.886  13.946
  557   HH11  ARG  72          HH11      ARG  72   8.741 -22.220  14.039
  558   HH12  ARG  72          HH12      ARG  72   8.932 -22.049  15.745
  559   HH21  ARG  72          HH21      ARG  72   5.742 -20.527  16.254
  560   HH22  ARG  72          HH22      ARG  72   7.169 -21.119  17.023
  561    H    ASN  73           H        ASN  73   5.489 -18.481   8.637
  562    HA   ASN  73           HA       ASN  73   6.547 -18.349   5.918
  563    HB2  ASN  73           HB2      ASN  73   5.029 -19.949   5.103
  564    HB3  ASN  73           HB3      ASN  73   5.635 -20.680   6.594
  565   HD21  ASN  73          HD22      ASN  73   4.143 -20.418   8.616
  566   HD22  ASN  73          HD21      ASN  73   2.429 -20.316   8.323
  567    H    TRP  74           H        TRP  74   5.047 -17.135   4.472
  568    HA   TRP  74           HA       TRP  74   3.679 -15.011   5.975
  569    HB2  TRP  74           HB2      TRP  74   3.933 -15.547   2.974
  570    HB3  TRP  74           HB3      TRP  74   3.125 -14.163   3.679
  571    HD1  TRP  74           HD1      TRP  74   6.701 -15.646   3.429
  572    HE1  TRP  74           HE1      TRP  74   8.372 -13.717   3.311
  573    HE3  TRP  74           HE3      TRP  74   3.497 -11.728   4.211
  574    HZ2  TRP  74           HZ2      TRP  74   8.314 -10.859   3.345
  575    HZ3  TRP  74           HZ3      TRP  74   4.324  -9.394   4.096
  576    HH2  TRP  74           HH2      TRP  74   6.736  -8.945   3.643
  577    H    LEU  75           H        LEU  75   1.537 -14.693   6.207
  578    HA   LEU  75           HA       LEU  75  -0.212 -16.994   5.529
  579    HB2  LEU  75           HB2      LEU  75  -0.900 -14.550   7.204
  580    HB3  LEU  75           HB3      LEU  75  -1.756 -16.082   7.092
  581    HG   LEU  75           HG       LEU  75   0.891 -15.504   8.473
  582   HD11  LEU  75          HD11      LEU  75  -1.164 -15.003   9.709
  583   HD12  LEU  75          HD12      LEU  75  -1.761 -16.649   9.472
  584   HD13  LEU  75          HD13      LEU  75  -0.302 -16.352  10.455
  585   HD21  LEU  75          HD21      LEU  75   0.973 -17.918   9.113
  586   HD22  LEU  75          HD22      LEU  75  -0.297 -18.246   7.900
  587   HD23  LEU  75          HD23      LEU  75   1.308 -17.618   7.412
  588    H    ARG  76           H        ARG  76  -0.850 -16.806   3.395
  589    HA   ARG  76           HA       ARG  76  -1.609 -14.098   2.395
  590    HB2  ARG  76           HB2      ARG  76   0.254 -15.512   1.291
  591    HB3  ARG  76           HB3      ARG  76  -1.029 -16.627   0.805
  592    HG2  ARG  76           HG2      ARG  76  -2.106 -14.602  -0.410
  593    HG3  ARG  76           HG3      ARG  76  -0.573 -13.763  -0.083
  594    HD2  ARG  76           HD2      ARG  76   0.583 -15.775  -1.155
  595    HD3  ARG  76           HD3      ARG  76  -1.031 -16.286  -1.708
  596    HE   ARG  76           HE       ARG  76  -0.770 -13.628  -2.520
  597   HH11  ARG  76          HH11      ARG  76   0.966 -16.664  -3.167
  598   HH12  ARG  76          HH12      ARG  76   1.589 -16.155  -4.695
  599   HH21  ARG  76          HH21      ARG  76   0.045 -12.954  -4.595
  600   HH22  ARG  76          HH22      ARG  76   1.049 -14.011  -5.514
  601    H    TYR  77           H        TYR  77  -3.619 -13.836   1.381
  602    HA   TYR  77           HA       TYR  77  -5.278 -16.161   0.928
  603    HB2  TYR  77           HB2      TYR  77  -7.226 -15.607   2.030
  604    HB3  TYR  77           HB3      TYR  77  -5.941 -15.708   3.229
  605    HD1  TYR  77           HD2      TYR  77  -4.889 -13.446   4.014
  606    HD2  TYR  77           HD1      TYR  77  -8.658 -13.782   1.940
  607    HE1  TYR  77           HE2      TYR  77  -5.609 -11.324   4.993
  608    HE2  TYR  77           HE1      TYR  77  -9.391 -11.646   2.904
  609    HH   TYR  77           HH       TYR  77  -7.366  -9.735   5.207
  610    H    LYS  78           H        LYS  78  -6.856 -15.794  -0.649
  611    HA   LYS  78           HA       LYS  78  -6.674 -13.208  -2.118
  612    HB2  LYS  78           HB2      LYS  78  -7.645 -15.993  -2.878
  613    HB3  LYS  78           HB3      LYS  78  -8.256 -14.569  -3.707
  614    HG2  LYS  78           HG2      LYS  78  -6.491 -15.458  -4.996
  615    HG3  LYS  78           HG3      LYS  78  -6.012 -13.885  -4.359
  616    HD2  LYS  78           HD2      LYS  78  -4.438 -14.824  -2.860
  617    HD3  LYS  78           HD3      LYS  78  -5.164 -16.430  -2.909
  618    HE2  LYS  78           HE2      LYS  78  -3.805 -15.131  -5.311
  619    HE3  LYS  78           HE3      LYS  78  -2.937 -16.132  -4.141
  620    HZ1  LYS  78           HZ1      LYS  78  -3.608 -17.432  -6.042
  621    HZ2  LYS  78           HZ2      LYS  78  -4.402 -17.991  -4.733
  622    HZ3  LYS  78           HZ3      LYS  78  -5.184 -17.075  -5.850
  623    H    LEU  79           H        LEU  79  -8.478 -11.999  -2.373
  624    HA   LEU  79           HA       LEU  79 -10.599 -12.118  -0.388
  625    HB2  LEU  79           HB2      LEU  79 -10.500 -10.531  -2.991
  626    HB3  LEU  79           HB3      LEU  79 -11.560 -10.246  -1.620
  627    HG   LEU  79           HG       LEU  79  -8.605  -9.666  -1.870
  628   HD11  LEU  79          HD11      LEU  79  -9.331  -7.376  -1.504
  629   HD12  LEU  79          HD12      LEU  79 -10.279  -8.084  -2.824
  630   HD13  LEU  79          HD13      LEU  79 -11.003  -7.910  -1.209
  631   HD21  LEU  79          HD21      LEU  79 -10.293  -9.641   0.661
  632   HD22  LEU  79          HD22      LEU  79  -8.849 -10.627   0.316
  633   HD23  LEU  79          HD23      LEU  79  -8.697  -8.863   0.490
  634    HA   PRO  80           HA       PRO  80 -13.504 -14.365  -3.077
  635    HB2  PRO  80           HB2      PRO  80 -15.898 -13.420  -2.044
  636    HB3  PRO  80           HB3      PRO  80 -14.914 -14.655  -1.205
  637    HG2  PRO  80           HG2      PRO  80 -14.964 -11.677  -0.776
  638    HG3  PRO  80           HG3      PRO  80 -15.095 -12.958   0.469
  639    HD2  PRO  80           HD2      PRO  80 -12.717 -11.751  -0.025
  640    HD3  PRO  80           HD3      PRO  80 -12.780 -13.514   0.250
  641    H    LYS  81           H        LYS  81 -14.592 -13.568  -5.096
  642    HA   LYS  81           HA       LYS  81 -13.465 -11.058  -5.759
  643    HB2  LYS  81           HB2      LYS  81 -15.377 -12.611  -7.477
  644    HB3  LYS  81           HB3      LYS  81 -14.303 -11.249  -7.941
  645    HG2  LYS  81           HG2      LYS  81 -12.325 -12.512  -7.612
  646    HG3  LYS  81           HG3      LYS  81 -13.194 -13.841  -6.842
  647    HD2  LYS  81           HD2      LYS  81 -12.551 -14.405  -9.123
  648    HD3  LYS  81           HD3      LYS  81 -14.310 -14.416  -8.916
  649    HE2  LYS  81           HE2      LYS  81 -14.468 -12.213 -10.047
  650    HE3  LYS  81           HE3      LYS  81 -12.701 -12.181 -10.238
  651    HZ1  LYS  81           HZ1      LYS  81 -12.879 -14.160 -11.635
  652    HZ2  LYS  81           HZ2      LYS  81 -14.510 -14.196 -11.462
  653    HZ3  LYS  81           HZ3      LYS  81 -13.798 -12.957 -12.249
  654    H    ARG  82           H        ARG  82 -16.538 -11.633  -4.337
  655    HA   ARG  82           HA       ARG  82 -17.876  -9.323  -5.207
  656    HB2  ARG  82           HB2      ARG  82 -19.148  -9.394  -3.146
  657    HB3  ARG  82           HB3      ARG  82 -18.977 -10.993  -3.876
  658    HG2  ARG  82           HG2      ARG  82 -17.050 -11.352  -2.166
  659    HG3  ARG  82           HG3      ARG  82 -17.642  -9.891  -1.368
  660    HD2  ARG  82           HD2      ARG  82 -19.303 -12.365  -1.972
  661    HD3  ARG  82           HD3      ARG  82 -18.539 -12.023  -0.408
  662    HE   ARG  82           HE       ARG  82 -20.065  -9.763  -0.968
  663   HH11  ARG  82          HH21      ARG  82 -20.738 -13.221  -0.452
  664   HH12  ARG  82          HH22      ARG  82 -22.341 -12.965   0.145
  665   HH21  ARG  82          HH11      ARG  82 -22.200  -9.424  -0.179
  666   HH22  ARG  82          HH12      ARG  82 -23.178 -10.756   0.316
  667    H    LEU  83           H        LEU  83 -15.153  -9.529  -2.996
  668    HA   LEU  83           HA       LEU  83 -15.514  -6.754  -2.117
  669    HB2  LEU  83           HB2      LEU  83 -13.292  -8.714  -1.508
  670    HB3  LEU  83           HB3      LEU  83 -13.575  -7.186  -0.684
  671    HG   LEU  83           HG       LEU  83 -15.397  -9.613  -0.651
  672   HD11  LEU  83          HD11      LEU  83 -13.277  -9.814   0.653
  673   HD12  LEU  83          HD12      LEU  83 -13.795  -8.428   1.634
  674   HD13  LEU  83          HD13      LEU  83 -14.747  -9.938   1.626
  675   HD21  LEU  83          HD21      LEU  83 -16.833  -7.690  -0.494
  676   HD22  LEU  83          HD22      LEU  83 -16.702  -8.439   1.096
  677   HD23  LEU  83          HD23      LEU  83 -15.784  -6.951   0.746
  678    H    VAL  84           H        VAL  84 -13.763  -8.474  -4.557
  679    HA   VAL  84           HA       VAL  84 -11.489  -6.783  -4.813
  680    HB   VAL  84           HB       VAL  84 -12.866  -8.571  -6.872
  681   HG11  VAL  84          HG11      VAL  84 -10.070  -7.389  -6.767
  682   HG12  VAL  84          HG12      VAL  84 -10.539  -8.722  -7.843
  683   HG13  VAL  84          HG13      VAL  84 -11.310  -7.145  -8.025
  684   HG21  VAL  84          HG21      VAL  84 -11.420 -10.343  -6.289
  685   HG22  VAL  84          HG22      VAL  84 -10.461  -9.323  -5.176
  686   HG23  VAL  84          HG23      VAL  84 -12.107  -9.796  -4.753
  687    H    ARG  85           H        ARG  85 -11.222  -4.853  -5.935
  688    HA   ARG  85           HA       ARG  85 -13.459  -3.895  -7.635
  689    HB2  ARG  85           HB2      ARG  85 -11.672  -2.589  -5.662
  690    HB3  ARG  85           HB3      ARG  85 -11.714  -1.731  -7.206
  691    HG2  ARG  85           HG2      ARG  85 -14.195  -2.638  -5.760
  692    HG3  ARG  85           HG3      ARG  85 -13.450  -1.021  -5.572
  693    HD2  ARG  85           HD2      ARG  85 -13.601  -0.877  -8.163
  694    HD3  ARG  85           HD3      ARG  85 -14.733  -2.214  -8.078
  695    HE   ARG  85           HE       ARG  85 -15.070   0.583  -7.222
  696   HH11  ARG  85          HH21      ARG  85 -16.518  -2.675  -6.975
  697   HH12  ARG  85          HH22      ARG  85 -18.092  -2.082  -6.582
  698   HH21  ARG  85          HH11      ARG  85 -17.163   1.343  -6.669
  699   HH22  ARG  85          HH12      ARG  85 -18.460   0.242  -6.394
  700    H    TRP  86           H        TRP  86 -13.020  -5.040  -9.379
  701    HA   TRP  86           HA       TRP  86 -10.499  -5.128 -10.722
  702    HB2  TRP  86           HB2      TRP  86 -13.375  -5.480 -11.655
  703    HB3  TRP  86           HB3      TRP  86 -11.963  -5.878 -12.643
  704    HD1  TRP  86           HD1      TRP  86 -14.264  -7.407 -10.210
  705    HE1  TRP  86           HE1      TRP  86 -13.428  -9.677  -9.396
  706    HE3  TRP  86           HE3      TRP  86  -9.480  -7.179 -12.002
  707    HZ2  TRP  86           HZ2      TRP  86 -10.916 -11.154  -9.369
  708    HZ3  TRP  86           HZ3      TRP  86  -7.883  -9.042 -11.575
  709    HH2  TRP  86           HH2      TRP  86  -8.595 -11.024 -10.260
  710    H    ASP  87           H        ASP  87 -13.069  -2.728 -10.588
  711    HA   ASP  87           HA       ASP  87 -12.687  -1.559 -13.154
  712    HB2  ASP  87           HB2      ASP  87 -14.771  -1.424 -11.874
  713    HB3  ASP  87           HB3      ASP  87 -13.965  -0.475 -10.616
  714    H    THR  88           H        THR  88 -10.939  -1.114 -10.158
  715    HA   THR  88           HA       THR  88  -9.630   1.290 -11.259
  716    HB   THR  88           HB       THR  88 -11.059   1.576  -9.154
  717    HG1  THR  88           HG1      THR  88  -9.675   3.159  -8.512
  718   HG21  THR  88          HG21      THR  88 -10.103   1.033  -7.032
  719   HG22  THR  88          HG22      THR  88 -10.101  -0.468  -7.974
  720   HG23  THR  88          HG23      THR  88  -8.589   0.444  -7.793
  721    H    LYS  89           H        LYS  89  -7.316   1.460 -10.645
  722    HA   LYS  89           HA       LYS  89  -6.005  -1.184 -10.762
  723    HB2  LYS  89           HB2      LYS  89  -5.258   1.147 -12.545
  724    HB3  LYS  89           HB3      LYS  89  -4.636  -0.493 -12.617
  725    HG2  LYS  89           HG2      LYS  89  -7.456   0.414 -13.326
  726    HG3  LYS  89           HG3      LYS  89  -6.159   0.059 -14.466
  727    HD2  LYS  89           HD2      LYS  89  -6.170  -2.317 -13.814
  728    HD3  LYS  89           HD3      LYS  89  -7.453  -2.001 -12.630
  729    HE2  LYS  89           HE2      LYS  89  -8.847  -1.042 -14.548
  730    HE3  LYS  89           HE3      LYS  89  -7.604  -1.642 -15.653
  731    HZ1  LYS  89           HZ1      LYS  89  -9.379  -3.233 -15.486
  732    HZ2  LYS  89           HZ2      LYS  89  -8.080  -3.902 -14.765
  733    HZ3  LYS  89           HZ3      LYS  89  -9.315  -3.283 -13.852
  734    HA   PRO  90           HA       PRO  90  -4.146  -2.087 -10.549
  735    HB2  PRO  90           HB2      PRO  90  -2.478  -3.087  -8.734
  736    HB3  PRO  90           HB3      PRO  90  -1.934  -2.030 -10.084
  737    HG2  PRO  90           HG2      PRO  90  -2.558  -1.211  -7.215
  738    HG3  PRO  90           HG3      PRO  90  -1.048  -0.869  -8.139
  739    HD2  PRO  90           HD2      PRO  90  -3.119   0.909  -7.968
  740    HD3  PRO  90           HD3      PRO  90  -2.170   0.740  -9.476
  741    H    VAL  91           H        VAL  91  -5.190  -3.990  -9.743
  742    HA   VAL  91           HA       VAL  91  -7.231  -3.366  -7.798
  743    HB   VAL  91           HB       VAL  91  -7.979  -4.284  -9.822
  744   HG11  VAL  91          HG11      VAL  91  -7.273  -6.496 -10.738
  745   HG12  VAL  91          HG12      VAL  91  -5.989  -5.293 -10.779
  746   HG13  VAL  91          HG13      VAL  91  -5.972  -6.554  -9.529
  747   HG21  VAL  91          HG21      VAL  91  -9.057  -5.252  -7.771
  748   HG22  VAL  91          HG22      VAL  91  -9.163  -6.299  -9.198
  749   HG23  VAL  91          HG23      VAL  91  -7.999  -6.659  -7.916
  750    H    CYS  92           H        CYS  92  -7.607  -4.194  -5.827
  751    HA   CYS  92           HA       CYS  92  -5.510  -5.815  -4.549
  752    HB2  CYS  92           HB2      CYS  92  -6.596  -3.932  -3.327
  753    HB3  CYS  92           HB3      CYS  92  -8.167  -4.749  -3.479
  754    HG   CYS  92           HG       CYS  92  -7.302  -5.062  -1.055
  755    H    ILE  93           H        ILE  93  -5.586  -7.935  -5.299
  756    HA   ILE  93           HA       ILE  93  -8.198  -9.348  -5.093
  757    HB   ILE  93           HB       ILE  93  -7.462 -11.016  -6.501
  758   HG12  ILE  93          HG12      ILE  93  -5.202 -11.480  -5.788
  759   HG13  ILE  93          HG13      ILE  93  -5.285 -11.276  -7.525
  760   HG21  ILE  93          HG21      ILE  93  -6.969  -9.876  -8.603
  761   HG22  ILE  93          HG22      ILE  93  -8.157  -8.977  -7.651
  762   HG23  ILE  93          HG23      ILE  93  -6.468  -8.418  -7.747
  763   HD11  ILE  93          HD11      ILE  93  -3.293 -10.198  -6.823
  764   HD12  ILE  93          HD12      ILE  93  -4.392  -8.888  -7.194
  765   HD13  ILE  93          HD13      ILE  93  -4.099  -9.361  -5.493
  766    H    GLY  94           H        GLY  94  -5.299  -8.902  -3.261
  767    HA2  GLY  94           HA2      GLY  94  -6.017 -10.685  -1.228
  768    HA3  GLY  94           HA3      GLY  94  -4.878 -11.520  -2.302
  769    H    GLN  95           H        GLN  95  -3.711 -11.340  -0.107
  770    HA   GLN  95           HA       GLN  95  -1.643  -9.313  -0.317
  771    HB2  GLN  95           HB2      GLN  95  -1.889  -8.614   2.092
  772    HB3  GLN  95           HB3      GLN  95  -3.099  -7.980   1.008
  773    HG2  GLN  95           HG2      GLN  95  -3.659 -10.451   2.681
  774    HG3  GLN  95           HG3      GLN  95  -3.831  -8.830   3.338
  775   HE21  GLN  95          HE22      GLN  95  -5.522 -11.294   1.589
  776   HE22  GLN  95          HE21      GLN  95  -6.856 -10.278   1.123
  777    H    LYS  96           H        LYS  96   0.177  -9.829   1.107
  778    HA   LYS  96           HA       LYS  96   0.103 -12.614   2.213
  779    HB2  LYS  96           HB2      LYS  96   2.506 -12.800   1.776
  780    HB3  LYS  96           HB3      LYS  96   1.576 -12.624   0.296
  781    HG2  LYS  96           HG2      LYS  96   2.207 -10.215   0.185
  782    HG3  LYS  96           HG3      LYS  96   3.215 -10.422   1.623
  783    HD2  LYS  96           HD2      LYS  96   3.606 -11.976  -0.967
  784    HD3  LYS  96           HD3      LYS  96   4.408 -10.445  -0.605
  785    HE2  LYS  96           HE2      LYS  96   5.461 -11.442   1.417
  786    HE3  LYS  96           HE3      LYS  96   4.683 -12.993   1.062
  787    HZ1  LYS  96           HZ1      LYS  96   6.955 -12.951   0.243
  788    HZ2  LYS  96           HZ2      LYS  96   5.942 -13.068  -1.031
  789    HZ3  LYS  96           HZ3      LYS  96   6.672 -11.642  -0.694
  790    H    GLN  97           H        GLN  97   0.281 -12.599   4.438
  791    HA   GLN  97           HA       GLN  97   1.012  -9.976   5.660
  792    HB2  GLN  97           HB2      GLN  97  -0.802 -12.117   6.803
  793    HB3  GLN  97           HB3      GLN  97  -0.503 -10.493   7.427
  794    HG2  GLN  97           HG2      GLN  97  -1.554  -9.642   5.222
  795    HG3  GLN  97           HG3      GLN  97  -2.065 -11.307   4.948
  796   HE21  GLN  97          HE22      GLN  97  -2.297  -8.535   7.280
  797   HE22  GLN  97          HE21      GLN  97  -3.903  -8.951   7.833
  798    H    LYS  98           H        LYS  98   2.651  -9.897   7.031
  799    HA   LYS  98           HA       LYS  98   3.880 -12.377   8.194
  800    HB2  LYS  98           HB2      LYS  98   4.464  -9.365   8.288
  801    HB3  LYS  98           HB3      LYS  98   5.236 -10.478   9.415
  802    HG2  LYS  98           HG2      LYS  98   5.430 -11.047   6.499
  803    HG3  LYS  98           HG3      LYS  98   6.365  -9.707   7.215
  804    HD2  LYS  98           HD2      LYS  98   7.548 -11.143   8.669
  805    HD3  LYS  98           HD3      LYS  98   6.467 -12.520   8.342
  806    HE2  LYS  98           HE2      LYS  98   7.273 -12.705   6.044
  807    HE3  LYS  98           HE3      LYS  98   8.250 -11.241   6.218
  808    HZ1  LYS  98           HZ1      LYS  98   9.622 -12.425   7.864
  809    HZ2  LYS  98           HZ2      LYS  98   8.713 -13.782   7.706
  810    HZ3  LYS  98           HZ3      LYS  98   9.604 -13.238   6.455
  811    H    TRP  99           H        TRP  99   3.809 -12.574  10.527
  812    HA   TRP  99           HA       TRP  99   2.196 -10.542  11.954
  813    HB2  TRP  99           HB2      TRP  99   1.697 -13.511  12.052
  814    HB3  TRP  99           HB3      TRP  99   1.136 -12.366  13.272
  815    HD1  TRP  99           HD1      TRP  99   0.596 -13.271   9.586
  816    HE1  TRP  99           HE1      TRP  99  -1.664 -12.322   8.829
  817    HE3  TRP  99           HE3      TRP  99  -0.530 -10.509  13.732
  818    HZ2  TRP  99           HZ2      TRP  99  -3.607 -10.421   9.818
  819    HZ3  TRP  99           HZ3      TRP  99  -2.495  -9.021  13.745
  820    HH2  TRP  99           HH2      TRP  99  -4.061  -8.987  11.809
  821    H    PHE 100           H        PHE 100   2.993 -10.004  13.920
  822    HA   PHE 100           HA       PHE 100   5.426 -11.437  14.907
  823    HB2  PHE 100           HB2      PHE 100   4.746  -8.489  14.621
  824    HB3  PHE 100           HB3      PHE 100   6.041  -9.072  15.646
  825    HD1  PHE 100           HD1      PHE 100   4.910  -9.108  11.985
  826    HD2  PHE 100           HD2      PHE 100   8.194  -9.341  14.823
  827    HE1  PHE 100           HE1      PHE 100   6.568  -8.873  10.168
  828    HE2  PHE 100           HE2      PHE 100   9.807  -9.195  12.967
  829    HZ   PHE 100           HZ       PHE 100   9.000  -8.965  10.630
  830    H    LEU 101           H        LEU 101   5.332 -11.928  17.074
  831    HA   LEU 101           HA       LEU 101   3.085 -10.835  18.710
  832    HB2  LEU 101           HB2      LEU 101   3.085 -13.230  18.894
  833    HB3  LEU 101           HB3      LEU 101   4.850 -13.267  19.022
  834    HG   LEU 101           HG       LEU 101   4.723 -12.206  21.248
  835   HD11  LEU 101          HD11      LEU 101   2.747 -11.860  22.435
  836   HD12  LEU 101          HD12      LEU 101   2.477 -11.066  20.911
  837   HD13  LEU 101          HD13      LEU 101   1.731 -12.664  21.198
  838   HD21  LEU 101          HD21      LEU 101   4.027 -14.137  22.503
  839   HD22  LEU 101          HD22      LEU 101   3.069 -14.761  21.146
  840   HD23  LEU 101          HD23      LEU 101   4.840 -14.701  21.042
  841    H    LEU 102           H        LEU 102   3.638  -9.190  20.067
  842    HA   LEU 102           HA       LEU 102   6.462  -9.120  20.990
  843    HB2  LEU 102           HB2      LEU 102   4.624  -6.709  21.006
  844    HB3  LEU 102           HB3      LEU 102   6.328  -6.782  21.290
  845    HG   LEU 102           HG       LEU 102   5.910  -5.603  19.330
  846   HD11  LEU 102          HD11      LEU 102   7.930  -6.971  19.278
  847   HD12  LEU 102          HD12      LEU 102   7.026  -8.301  18.489
  848   HD13  LEU 102          HD13      LEU 102   7.250  -6.730  17.664
  849   HD21  LEU 102          HD21      LEU 102   4.762  -6.190  17.415
  850   HD22  LEU 102          HD22      LEU 102   4.656  -7.912  17.858
  851   HD23  LEU 102          HD23      LEU 102   3.714  -6.707  18.751
  852    H    GLN 103           H        GLN 103   6.635  -8.845  23.369
  853    HA   GLN 103           HA       GLN 103   3.950  -9.000  24.732
  854    HB2  GLN 103           HB2      GLN 103   5.102 -10.660  25.561
  855    HB3  GLN 103           HB3      GLN 103   6.674  -9.843  25.611
  856    HG2  GLN 103           HG2      GLN 103   6.152  -8.820  27.687
  857    HG3  GLN 103           HG3      GLN 103   4.435  -8.685  27.313
  858   HE21  GLN 103          HE22      GLN 103   3.055 -10.634  27.339
  859   HE22  GLN 103          HE21      GLN 103   3.481 -11.926  28.451
  860    H    LEU 104           H        LEU 104   3.189  -7.230  25.646
  861    HA   LEU 104           HA       LEU 104   4.316  -4.644  25.431
  862    HB2  LEU 104           HB2      LEU 104   1.873  -5.605  25.832
  863    HB3  LEU 104           HB3      LEU 104   2.265  -5.584  27.510
  864    HG   LEU 104           HG       LEU 104   2.076  -3.337  27.678
  865   HD11  LEU 104          HD11      LEU 104   3.784  -2.547  26.289
  866   HD12  LEU 104          HD12      LEU 104   2.897  -2.995  24.801
  867   HD13  LEU 104          HD13      LEU 104   2.319  -1.674  25.846
  868   HD21  LEU 104          HD21      LEU 104   0.131  -2.580  26.347
  869   HD22  LEU 104          HD22      LEU 104   0.373  -3.889  25.169
  870   HD23  LEU 104          HD23      LEU 104  -0.078  -4.266  26.842
  871    H    VAL 105           H        VAL 105   5.752  -3.546  26.819
  872    HA   VAL 105           HA       VAL 105   7.052  -5.288  28.757
  873    HB   VAL 105           HB       VAL 105   7.747  -2.576  27.636
  874   HG11  VAL 105          HG11      VAL 105   8.849  -2.758  29.809
  875   HG12  VAL 105          HG12      VAL 105   9.453  -4.381  29.399
  876   HG13  VAL 105          HG13      VAL 105  10.038  -2.953  28.516
  877   HG21  VAL 105          HG21      VAL 105   9.289  -3.676  26.199
  878   HG22  VAL 105          HG22      VAL 105   9.165  -5.217  27.089
  879   HG23  VAL 105          HG23      VAL 105   7.826  -4.653  26.089
  880    H    SER 106           H        SER 106   5.204  -2.207  28.904
  881    HA   SER 106           HA       SER 106   5.437  -2.258  31.873
  882    HB2  SER 106           HB2      SER 106   4.159  -0.266  29.973
  883    HB3  SER 106           HB3      SER 106   4.225  -0.101  31.734
  884    HG   SER 106           HG       SER 106   6.337  -0.062  29.864
  885    H    GLY 107           H        GLY 107   3.142  -3.122  29.379
  886    HA2  GLY 107           HA2      GLY 107   1.310  -4.652  29.945
  887    HA3  GLY 107           HA3      GLY 107   1.098  -3.789  31.466
  888    H    ASP 108           H        ASP 108  -1.143  -3.826  30.407
  889    HA   ASP 108           HA       ASP 108  -1.778  -2.594  28.056
  890    HB2  ASP 108           HB2      ASP 108  -3.982  -2.936  28.662
  891    HB3  ASP 108           HB3      ASP 108  -3.112  -4.149  29.598
  892    H    ALA 109           H        ALA 109  -1.101  -1.064  31.041
  893    HA   ALA 109           HA       ALA 109  -2.309   1.456  30.854
  894    HB1  ALA 109           HB1      ALA 109   0.535   0.769  31.730
  895    HB2  ALA 109           HB2      ALA 109  -0.332   2.263  32.125
  896    HB3  ALA 109           HB3      ALA 109  -0.917   0.711  32.763
  897    H    GLU 110           H        GLU 110   0.378   0.181  28.918
  898    HA   GLU 110           HA       GLU 110   0.937   2.839  27.899
  899    HB2  GLU 110           HB2      GLU 110   2.474   0.255  27.912
  900    HB3  GLU 110           HB3      GLU 110   2.922   1.501  26.741
  901    HG2  GLU 110           HG2      GLU 110   2.703   1.969  29.730
  902    HG3  GLU 110           HG3      GLU 110   4.203   1.608  28.873
  903    H    ILE 111           H        ILE 111  -1.437   1.353  27.131
  904    HA   ILE 111           HA       ILE 111  -1.140   1.314  24.161
  905    HB   ILE 111           HB       ILE 111  -3.576   0.512  25.811
  906   HG12  ILE 111          HG12      ILE 111  -1.895  -1.404  24.154
  907   HG13  ILE 111          HG13      ILE 111  -1.450  -1.072  25.839
  908   HG21  ILE 111          HG21      ILE 111  -4.219   1.332  23.654
  909   HG22  ILE 111          HG22      ILE 111  -2.912   0.419  22.843
  910   HG23  ILE 111          HG23      ILE 111  -4.315  -0.413  23.581
  911   HD11  ILE 111          HD11      ILE 111  -3.589  -1.864  26.665
  912   HD12  ILE 111          HD12      ILE 111  -4.207  -2.077  25.049
  913   HD13  ILE 111          HD13      ILE 111  -2.877  -3.103  25.613
  914    H    ASN 112           H        ASN 112  -2.106   2.936  22.913
  915    HA   ASN 112           HA       ASN 112  -3.540   5.133  24.378
  916    HB2  ASN 112           HB2      ASN 112  -1.264   5.873  23.948
  917    HB3  ASN 112           HB3      ASN 112  -1.381   5.406  22.257
  918   HD21  ASN 112          HD22      ASN 112  -1.052   7.545  21.392
  919   HD22  ASN 112          HD21      ASN 112  -2.263   8.787  21.578
  920    H    MET 113           H        MET 113  -2.918   3.736  21.124
  921    HA   MET 113           HA       MET 113  -4.187   3.253  19.376
  922    HB2  MET 113           HB2      MET 113  -6.759   3.718  20.872
  923    HB3  MET 113           HB3      MET 113  -6.419   2.672  19.498
  924    HG2  MET 113           HG2      MET 113  -4.704   1.566  21.219
  925    HG3  MET 113           HG3      MET 113  -5.812   2.284  22.397
  926    HE1  MET 113           HE1      MET 113  -5.020  -0.346  19.866
  927    HE2  MET 113           HE2      MET 113  -4.992  -0.966  21.540
  928    HE3  MET 113           HE3      MET 113  -6.141  -1.650  20.371
  929    H    GLN 114           H        GLN 114  -3.683   6.313  20.182
  930    HA   GLN 114           HA       GLN 114  -5.109   7.380  17.917
  931    HB2  GLN 114           HB2      GLN 114  -6.140   9.213  19.170
  932    HB3  GLN 114           HB3      GLN 114  -6.919   7.632  19.290
  933    HG2  GLN 114           HG2      GLN 114  -6.081   7.254  21.519
  934    HG3  GLN 114           HG3      GLN 114  -5.115   8.724  21.475
  935   HE21  GLN 114          HE22      GLN 114  -6.316  10.851  21.319
  936   HE22  GLN 114          HE21      GLN 114  -7.914  10.951  22.022
  937    H    THR 115           H        THR 115  -2.939   7.269  17.548
  938    HA   THR 115           HA       THR 115  -1.097   9.345  18.422
  939    HB   THR 115           HB       THR 115  -0.068   8.364  16.160
  940    HG1  THR 115           HG1      THR 115  -0.657   6.053  16.156
  941   HG21  THR 115          HG21      THR 115   1.007   6.595  17.631
  942   HG22  THR 115          HG22      THR 115   0.884   8.145  18.473
  943   HG23  THR 115          HG23      THR 115  -0.298   6.860  18.827
  944    H    SER 116           H        SER 116  -2.772   8.446  15.467
  945    HA   SER 116           HA       SER 116  -2.917  11.025  14.226
  946    HB2  SER 116           HB2      SER 116  -4.854   8.680  13.971
  947    HB3  SER 116           HB3      SER 116  -4.614   9.980  12.797
  948    HG   SER 116           HG       SER 116  -2.517   9.186  12.402
  949    H    SER 117           H        SER 117  -4.940  12.359  13.972
  950    HA   SER 117           HA       SER 117  -6.004  13.105  16.477
  951    HB2  SER 117           HB2      SER 117  -7.173  13.701  13.732
  952    HB3  SER 117           HB3      SER 117  -7.325  14.674  15.206
  953    HG   SER 117           HG       SER 117  -5.711  15.513  13.790
  954    H    THR 118           H        THR 118  -7.229  10.929  13.942
  955    HA   THR 118           HA       THR 118  -9.656  10.286  15.418
  956    HB   THR 118           HB       THR 118  -9.370   8.519  13.365
  957    HG1  THR 118           HG1      THR 118  -8.935   9.770  11.538
  958   HG21  THR 118          HG21      THR 118 -11.278   9.749  12.418
  959   HG22  THR 118          HG22      THR 118 -11.401   9.517  14.172
  960   HG23  THR 118          HG23      THR 118 -10.929  11.111  13.524
  961    HA   PRO 119           HA       PRO 119  -7.499   6.781  17.280
  962    HB2  PRO 119           HB2      PRO 119 -10.303   5.902  17.902
  963    HB3  PRO 119           HB3      PRO 119  -8.902   6.053  19.008
  964    HG2  PRO 119           HG2      PRO 119 -10.967   7.871  19.008
  965    HG3  PRO 119           HG3      PRO 119  -9.268   8.391  19.262
  966    HD2  PRO 119           HD2      PRO 119 -10.925   8.516  16.733
  967    HD3  PRO 119           HD3      PRO 119  -9.801   9.727  17.428
  968    H    GLU 120           H        GLU 120  -6.954   4.925  16.093
  969    HA   GLU 120           HA       GLU 120  -8.523   4.235  13.736
  970    HB2  GLU 120           HB2      GLU 120  -6.056   3.016  15.019
  971    HB3  GLU 120           HB3      GLU 120  -6.879   2.230  13.674
  972    HG2  GLU 120           HG2      GLU 120  -5.738   5.051  13.608
  973    HG3  GLU 120           HG3      GLU 120  -4.991   3.619  12.907
  974    H    PHE 121           H        PHE 121  -8.591   3.206  17.070
  975    HA   PHE 121           HA       PHE 121 -10.492   1.045  16.316
  976    HB2  PHE 121           HB2      PHE 121  -8.700   1.176  18.752
  977    HB3  PHE 121           HB3      PHE 121  -9.911  -0.055  18.424
  978    HD1  PHE 121           HD1      PHE 121  -9.675  -1.214  15.989
  979    HD2  PHE 121           HD2      PHE 121  -6.478   0.597  18.215
  980    HE1  PHE 121           HE1      PHE 121  -8.041  -2.541  14.688
  981    HE2  PHE 121           HE2      PHE 121  -4.859  -0.848  17.040
  982    HZ   PHE 121           HZ       PHE 121  -5.626  -2.366  15.220
  983    H    ASP 122           H        ASP 122 -12.430   0.991  17.258
  984    HA   ASP 122           HA       ASP 122 -13.368   3.364  18.767
  985    HB2  ASP 122           HB2      ASP 122 -14.757   2.550  16.945
  986    HB3  ASP 122           HB3      ASP 122 -14.765   0.920  17.622
  987    H    GLY 123           H        GLY 123 -12.223   0.081  19.315
  988    HA2  GLY 123           HA2      GLY 123 -12.437   0.364  22.184
  989    HA3  GLY 123           HA3      GLY 123 -13.567  -0.839  21.494
  990    H    TRP 124           H        TRP 124 -11.341  -1.481  23.265
  991    HA   TRP 124           HA       TRP 124 -10.269  -3.552  21.533
  992    HB2  TRP 124           HB2      TRP 124  -8.094  -3.221  21.707
  993    HB3  TRP 124           HB3      TRP 124  -8.532  -1.548  21.947
  994    HD1  TRP 124           HD1      TRP 124  -7.309  -4.665  23.762
  995    HE1  TRP 124           HE1      TRP 124  -6.312  -4.083  26.023
  996    HE3  TRP 124           HE3      TRP 124  -8.403   0.334  23.826
  997    HZ2  TRP 124           HZ2      TRP 124  -6.013  -1.703  27.695
  998    HZ3  TRP 124           HZ3      TRP 124  -7.711   1.743  25.745
  999    HH2  TRP 124           HH2      TRP 124  -6.523   0.737  27.683
 1000    H    ARG 125           H        ARG 125  -9.604  -5.451  22.746
 1001    HA   ARG 125           HA       ARG 125 -10.393  -5.522  25.574
 1002    HB2  ARG 125           HB2      ARG 125 -11.944  -7.410  25.266
 1003    HB3  ARG 125           HB3      ARG 125 -12.515  -5.930  24.499
 1004    HG2  ARG 125           HG2      ARG 125 -11.579  -6.850  22.284
 1005    HG3  ARG 125           HG3      ARG 125 -11.356  -8.378  23.102
 1006    HD2  ARG 125           HD2      ARG 125 -14.015  -6.888  22.871
 1007    HD3  ARG 125           HD3      ARG 125 -13.477  -8.164  21.776
 1008    HE   ARG 125           HE       ARG 125 -13.502  -8.927  24.607
 1009   HH11  ARG 125          HH11      ARG 125 -15.617  -8.588  21.767
 1010   HH12  ARG 125          HH12      ARG 125 -16.636  -9.921  22.203
 1011   HH21  ARG 125          HH21      ARG 125 -14.941 -10.642  25.226
 1012   HH22  ARG 125          HH22      ARG 125 -16.246 -11.084  24.191
 1013    H    TRP 126           H        TRP 126  -9.481  -7.296  26.676
 1014    HA   TRP 126           HA       TRP 126  -7.230  -8.627  25.247
 1015    HB2  TRP 126           HB2      TRP 126  -7.828  -8.061  28.167
 1016    HB3  TRP 126           HB3      TRP 126  -6.592  -9.180  27.653
 1017    HD1  TRP 126           HD1      TRP 126  -7.220  -5.479  28.052
 1018    HE1  TRP 126           HE1      TRP 126  -5.009  -4.269  27.935
 1019    HE3  TRP 126           HE3      TRP 126  -4.357  -9.239  26.082
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.302  -4.823  27.097
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.958  -8.848  25.615
 1022    HH2  TRP 126           HH2      TRP 126  -0.897  -6.660  26.186
 1023    H    VAL 127           H        VAL 127  -8.160 -10.358  24.228
 1024    HA   VAL 127           HA       VAL 127 -10.143 -12.074  25.667
 1025    HB   VAL 127           HB       VAL 127 -10.381 -13.004  23.234
 1026   HG11  VAL 127          HG11      VAL 127 -11.436 -10.341  24.237
 1027   HG12  VAL 127          HG12      VAL 127 -12.078 -11.150  22.787
 1028   HG13  VAL 127          HG13      VAL 127 -12.175 -11.950  24.369
 1029   HG21  VAL 127          HG21      VAL 127  -8.484 -11.831  22.231
 1030   HG22  VAL 127          HG22      VAL 127 -10.020 -11.460  21.432
 1031   HG23  VAL 127          HG23      VAL 127  -9.294 -10.266  22.520
 1032    H    SER 128           H        SER 128  -9.923 -14.520  24.999
 1033    HA   SER 128           HA       SER 128  -7.240 -15.430  25.607
 1034    HB2  SER 128           HB2      SER 128  -8.245 -17.617  25.318
 1035    HB3  SER 128           HB3      SER 128  -9.376 -16.563  26.208
 1036    HG   SER 128           HG       SER 128 -10.513 -17.670  24.630
 1037    H    TYR 129           H        TYR 129  -6.065 -16.950  23.963
 1038    HA   TYR 129           HA       TYR 129  -5.779 -15.570  21.462
 1039    HB2  TYR 129           HB2      TYR 129  -4.601 -18.038  21.035
 1040    HB3  TYR 129           HB3      TYR 129  -3.835 -16.570  21.588
 1041    HD1  TYR 129           HD1      TYR 129  -5.675 -19.550  22.935
 1042    HD2  TYR 129           HD2      TYR 129  -2.564 -16.623  23.601
 1043    HE1  TYR 129           HE1      TYR 129  -5.083 -20.668  25.068
 1044    HE2  TYR 129           HE2      TYR 129  -1.948 -17.766  25.700
 1045    HH   TYR 129           HH       TYR 129  -2.446 -19.504  27.216
 1046    H    TRP 130           H        TRP 130  -7.901 -18.312  22.391
 1047    HA   TRP 130           HA       TRP 130  -8.314 -18.888  19.534
 1048    HB2  TRP 130           HB2      TRP 130  -9.455 -20.250  21.974
 1049    HB3  TRP 130           HB3      TRP 130  -9.590 -20.807  20.306
 1050    HD1  TRP 130           HD1      TRP 130  -7.790 -21.756  23.162
 1051    HE1  TRP 130           HE1      TRP 130  -5.472 -22.734  22.704
 1052    HE3  TRP 130           HE3      TRP 130  -7.177 -20.249  18.272
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.565 -22.790  20.574
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.100 -20.816  17.058
 1055    HH2  TRP 130           HH2      TRP 130  -3.280 -22.068  18.195
 1056    H    TYR 131           H        TYR 131 -10.200 -17.323  22.132
 1057    HA   TYR 131           HA       TYR 131 -12.713 -17.403  20.910
 1058    HB2  TYR 131           HB2      TYR 131 -12.435 -16.719  23.147
 1059    HB3  TYR 131           HB3      TYR 131 -11.432 -15.341  22.693
 1060    HD1  TYR 131           HD2      TYR 131 -14.895 -16.653  22.857
 1061    HD2  TYR 131           HD1      TYR 131 -12.422 -13.293  21.763
 1062    HE1  TYR 131           HE2      TYR 131 -16.893 -15.197  22.828
 1063    HE2  TYR 131           HE1      TYR 131 -14.411 -11.826  21.767
 1064    HH   TYR 131           HH       TYR 131 -17.717 -13.013  22.534
 1065    HA   PRO 132           HA       PRO 132 -11.902 -13.249  18.614
 1066    HB2  PRO 132           HB2      PRO 132  -9.379 -12.771  17.573
 1067    HB3  PRO 132           HB3      PRO 132  -9.956 -12.185  19.163
 1068    HG2  PRO 132           HG2      PRO 132  -8.338 -14.681  18.616
 1069    HG3  PRO 132           HG3      PRO 132  -8.011 -13.374  19.810
 1070    HD2  PRO 132           HD2      PRO 132  -9.230 -15.587  20.566
 1071    HD3  PRO 132           HD3      PRO 132  -9.883 -14.030  21.141
 1072    H    VAL 133           H        VAL 133 -10.525 -16.346  17.769
 1073    HA   VAL 133           HA       VAL 133 -10.547 -15.975  14.883
 1074    HB   VAL 133           HB       VAL 133 -10.593 -18.582  16.442
 1075   HG11  VAL 133          HG11      VAL 133  -9.432 -17.925  13.688
 1076   HG12  VAL 133          HG12      VAL 133  -9.471 -19.512  14.479
 1077   HG13  VAL 133          HG13      VAL 133 -10.978 -18.759  13.974
 1078   HG21  VAL 133          HG21      VAL 133  -8.670 -17.291  17.313
 1079   HG22  VAL 133          HG22      VAL 133  -8.102 -18.588  16.268
 1080   HG23  VAL 133          HG23      VAL 133  -8.143 -16.918  15.657
 1081    H    ARG 134           H        ARG 134 -12.843 -16.941  17.444
 1082    HA   ARG 134           HA       ARG 134 -14.650 -18.399  15.798
 1083    HB2  ARG 134           HB2      ARG 134 -15.301 -16.788  18.303
 1084    HB3  ARG 134           HB3      ARG 134 -16.207 -18.160  17.659
 1085    HG2  ARG 134           HG2      ARG 134 -13.396 -18.350  18.798
 1086    HG3  ARG 134           HG3      ARG 134 -14.863 -18.616  19.730
 1087    HD2  ARG 134           HD2      ARG 134 -14.156 -20.169  17.229
 1088    HD3  ARG 134           HD3      ARG 134 -13.713 -20.673  18.886
 1089    HE   ARG 134           HE       ARG 134 -16.475 -20.191  18.902
 1090   HH11  ARG 134          HH11      ARG 134 -14.255 -22.513  17.365
 1091   HH12  ARG 134          HH12      ARG 134 -15.430 -23.772  17.259
 1092   HH21  ARG 134          HH21      ARG 134 -18.038 -21.865  18.744
 1093   HH22  ARG 134          HH22      ARG 134 -17.627 -23.392  18.052
 1094    H    GLN 135           H        GLN 135 -14.423 -14.899  16.520
 1095    HA   GLN 135           HA       GLN 135 -17.083 -14.402  15.477
 1096    HB2  GLN 135           HB2      GLN 135 -14.832 -12.630  16.456
 1097    HB3  GLN 135           HB3      GLN 135 -16.210 -11.916  15.643
 1098    HG2  GLN 135           HG2      GLN 135 -16.636 -11.864  18.028
 1099    HG3  GLN 135           HG3      GLN 135 -17.776 -12.947  17.238
 1100   HE21  GLN 135          HE22      GLN 135 -14.524 -13.088  18.895
 1101   HE22  GLN 135          HE21      GLN 135 -14.799 -14.643  19.612
 1102    H    VAL 136           H        VAL 136 -13.919 -14.463  13.888
 1103    HA   VAL 136           HA       VAL 136 -14.849 -12.698  11.778
 1104    HB   VAL 136           HB       VAL 136 -12.588 -13.137  10.859
 1105   HG11  VAL 136          HG11      VAL 136 -12.634 -12.141  13.732
 1106   HG12  VAL 136          HG12      VAL 136 -11.468 -11.711  12.461
 1107   HG13  VAL 136          HG13      VAL 136 -13.150 -11.198  12.316
 1108   HG21  VAL 136          HG21      VAL 136 -10.842 -14.158  12.104
 1109   HG22  VAL 136          HG22      VAL 136 -11.902 -14.461  13.495
 1110   HG23  VAL 136          HG23      VAL 136 -12.136 -15.355  11.976
 1111    H    VAL 137           H        VAL 137 -14.536 -13.364   9.445
 1112    HA   VAL 137           HA       VAL 137 -16.246 -15.670   8.934
 1113    HB   VAL 137           HB       VAL 137 -16.497 -14.809   6.765
 1114   HG11  VAL 137          HG11      VAL 137 -16.012 -12.253   8.352
 1115   HG12  VAL 137          HG12      VAL 137 -17.100 -12.510   6.981
 1116   HG13  VAL 137          HG13      VAL 137 -17.442 -13.299   8.530
 1117   HG21  VAL 137          HG21      VAL 137 -13.782 -13.495   7.153
 1118   HG22  VAL 137          HG22      VAL 137 -14.350 -14.636   5.911
 1119   HG23  VAL 137          HG23      VAL 137 -14.915 -12.957   5.872
 1120    H    SER 138           H        SER 138 -15.551 -17.027   6.843
 1121    HA   SER 138           HA       SER 138 -13.609 -18.808   7.640
 1122    HB2  SER 138           HB2      SER 138 -14.536 -18.263   4.799
 1123    HB3  SER 138           HB3      SER 138 -13.949 -19.808   5.456
 1124    HG   SER 138           HG       SER 138 -16.252 -19.727   5.406
 1125    H    PHE 139           H        PHE 139 -13.165 -16.333   5.025
 1126    HA   PHE 139           HA       PHE 139 -10.533 -16.991   4.349
 1127    HB2  PHE 139           HB2      PHE 139 -11.926 -14.271   4.304
 1128    HB3  PHE 139           HB3      PHE 139 -10.394 -14.612   3.524
 1129    HD1  PHE 139           HD2      PHE 139 -10.230 -16.188   1.608
 1130    HD2  PHE 139           HD1      PHE 139 -14.034 -14.967   3.247
 1131    HE1  PHE 139           HE2      PHE 139 -11.380 -17.038  -0.420
 1132    HE2  PHE 139           HE1      PHE 139 -15.175 -15.829   1.224
 1133    HZ   PHE 139           HZ       PHE 139 -13.858 -16.878  -0.609
 1134    H    LYS 140           H        LYS 140 -11.696 -14.873   6.968
 1135    HA   LYS 140           HA       LYS 140  -8.931 -14.034   7.620
 1136    HB2  LYS 140           HB2      LYS 140 -11.608 -13.307   8.846
 1137    HB3  LYS 140           HB3      LYS 140 -10.037 -12.619   9.338
 1138    HG2  LYS 140           HG2      LYS 140  -9.663 -11.848   6.989
 1139    HG3  LYS 140           HG3      LYS 140 -11.259 -12.436   6.535
 1140    HD2  LYS 140           HD2      LYS 140 -10.647 -10.204   8.507
 1141    HD3  LYS 140           HD3      LYS 140 -11.292 -10.050   6.858
 1142    HE2  LYS 140           HE2      LYS 140 -13.317 -11.334   7.543
 1143    HE3  LYS 140           HE3      LYS 140 -12.708 -11.379   9.207
 1144    HZ1  LYS 140           HZ1      LYS 140 -14.289  -9.516   8.858
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.811  -8.910   9.215
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.361  -8.894   7.672
 1147    H    ARG 141           H        ARG 141 -11.521 -16.010   9.092
 1148    HA   ARG 141           HA       ARG 141 -10.238 -16.997  11.401
 1149    HB2  ARG 141           HB2      ARG 141 -11.854 -18.516   9.288
 1150    HB3  ARG 141           HB3      ARG 141 -11.221 -19.309  10.725
 1151    HG2  ARG 141           HG2      ARG 141 -12.474 -17.877  12.174
 1152    HG3  ARG 141           HG3      ARG 141 -13.114 -16.961  10.795
 1153    HD2  ARG 141           HD2      ARG 141 -14.249 -18.988   9.964
 1154    HD3  ARG 141           HD3      ARG 141 -13.560 -19.922  11.315
 1155    HE   ARG 141           HE       ARG 141 -15.071 -17.569  12.129
 1156   HH11  ARG 141          HH11      ARG 141 -15.576 -20.908  11.016
 1157   HH12  ARG 141          HH12      ARG 141 -17.039 -21.130  11.909
 1158   HH21  ARG 141          HH21      ARG 141 -16.882 -17.945  13.496
 1159   HH22  ARG 141          HH22      ARG 141 -17.844 -19.374  13.286
 1160    H    ASP 142           H        ASP 142  -9.722 -18.125   8.036
 1161    HA   ASP 142           HA       ASP 142  -8.004 -20.248   8.643
 1162    HB2  ASP 142           HB2      ASP 142  -9.145 -19.838   6.470
 1163    HB3  ASP 142           HB3      ASP 142  -8.074 -18.464   6.175
 1164    H    VAL 143           H        VAL 143  -7.222 -16.830   8.126
 1165    HA   VAL 143           HA       VAL 143  -4.326 -17.237   8.554
 1166    HB   VAL 143           HB       VAL 143  -6.172 -14.802   8.277
 1167   HG11  VAL 143          HG11      VAL 143  -4.323 -14.055   9.713
 1168   HG12  VAL 143          HG12      VAL 143  -3.151 -14.756   8.574
 1169   HG13  VAL 143          HG13      VAL 143  -4.167 -13.378   8.100
 1170   HG21  VAL 143          HG21      VAL 143  -4.992 -14.480   6.118
 1171   HG22  VAL 143          HG22      VAL 143  -4.076 -15.973   6.385
 1172   HG23  VAL 143          HG23      VAL 143  -5.835 -16.025   6.170
 1173    H    TYR 144           H        TYR 144  -7.072 -15.854  10.472
 1174    HA   TYR 144           HA       TYR 144  -5.446 -15.006  12.592
 1175    HB2  TYR 144           HB2      TYR 144  -8.401 -15.573  12.326
 1176    HB3  TYR 144           HB3      TYR 144  -7.718 -15.107  13.865
 1177    HD1  TYR 144           HD1      TYR 144  -6.167 -13.545  10.873
 1178    HD2  TYR 144           HD2      TYR 144  -9.248 -13.157  13.873
 1179    HE1  TYR 144           HE1      TYR 144  -6.367 -11.164  10.343
 1180    HE2  TYR 144           HE2      TYR 144  -9.486 -10.761  13.302
 1181    HH   TYR 144           HH       TYR 144  -8.911  -9.083  11.692
 1182    H    ARG 145           H        ARG 145  -6.935 -18.239  12.125
 1183    HA   ARG 145           HA       ARG 145  -6.057 -19.205  14.706
 1184    HB2  ARG 145           HB2      ARG 145  -6.498 -21.402  13.890
 1185    HB3  ARG 145           HB3      ARG 145  -7.734 -20.318  13.260
 1186    HG2  ARG 145           HG2      ARG 145  -6.248 -20.183  11.125
 1187    HG3  ARG 145           HG3      ARG 145  -5.448 -21.635  11.756
 1188    HD2  ARG 145           HD2      ARG 145  -8.424 -21.281  11.254
 1189    HD3  ARG 145           HD3      ARG 145  -7.268 -22.051  10.133
 1190    HE   ARG 145           HE       ARG 145  -6.990 -23.394  12.582
 1191   HH11  ARG 145          HH11      ARG 145  -9.536 -23.033  10.110
 1192   HH12  ARG 145          HH12      ARG 145 -10.270 -24.556  10.464
 1193   HH21  ARG 145          HH21      ARG 145  -8.005 -25.395  13.067
 1194   HH22  ARG 145          HH22      ARG 145  -9.381 -25.922  12.170
 1195    H    ARG 146           H        ARG 146  -4.301 -19.065  11.532
 1196    HA   ARG 146           HA       ARG 146  -1.944 -20.292  12.616
 1197    HB2  ARG 146           HB2      ARG 146  -2.519 -18.590  10.146
 1198    HB3  ARG 146           HB3      ARG 146  -0.848 -18.803  10.689
 1199    HG2  ARG 146           HG2      ARG 146  -0.990 -20.563   9.250
 1200    HG3  ARG 146           HG3      ARG 146  -1.438 -21.367  10.765
 1201    HD2  ARG 146           HD2      ARG 146  -3.852 -20.996  10.172
 1202    HD3  ARG 146           HD3      ARG 146  -3.311 -20.273   8.642
 1203    HE   ARG 146           HE       ARG 146  -2.228 -22.924   8.969
 1204   HH11  ARG 146          HH11      ARG 146  -5.130 -21.120   8.134
 1205   HH12  ARG 146          HH12      ARG 146  -5.831 -22.310   7.104
 1206   HH21  ARG 146          HH21      ARG 146  -3.126 -24.632   7.626
 1207   HH22  ARG 146          HH22      ARG 146  -4.668 -24.420   6.874
 1208    H    VAL 147           H        VAL 147  -2.924 -16.822  12.402
 1209    HA   VAL 147           HA       VAL 147  -0.603 -15.696  13.440
 1210    HB   VAL 147           HB       VAL 147  -3.508 -14.857  13.907
 1211   HG11  VAL 147          HG11      VAL 147  -2.090 -13.581  15.444
 1212   HG12  VAL 147          HG12      VAL 147  -0.984 -13.172  14.116
 1213   HG13  VAL 147          HG13      VAL 147  -2.654 -12.546  14.139
 1214   HG21  VAL 147          HG21      VAL 147  -1.475 -14.080  11.802
 1215   HG22  VAL 147          HG22      VAL 147  -2.936 -15.004  11.502
 1216   HG23  VAL 147          HG23      VAL 147  -3.078 -13.316  11.983
 1217    H    MET 148           H        MET 148  -3.064 -17.494  15.151
 1218    HA   MET 148           HA       MET 148  -2.103 -16.688  17.778
 1219    HB2  MET 148           HB2      MET 148  -4.401 -18.482  16.957
 1220    HB3  MET 148           HB3      MET 148  -3.968 -18.102  18.634
 1221    HG2  MET 148           HG2      MET 148  -4.668 -15.982  16.561
 1222    HG3  MET 148           HG3      MET 148  -5.825 -16.730  17.632
 1223    HE1  MET 148           HE1      MET 148  -2.382 -14.436  17.779
 1224    HE2  MET 148           HE2      MET 148  -3.837 -13.862  16.930
 1225    HE3  MET 148           HE3      MET 148  -3.361 -13.112  18.463
 1226    H    LYS 149           H        LYS 149  -2.458 -19.777  15.898
 1227    HA   LYS 149           HA       LYS 149  -1.131 -21.343  17.797
 1228    HB2  LYS 149           HB2      LYS 149  -1.192 -23.066  16.331
 1229    HB3  LYS 149           HB3      LYS 149  -2.500 -22.036  15.758
 1230    HG2  LYS 149           HG2      LYS 149  -1.569 -22.673  13.787
 1231    HG3  LYS 149           HG3      LYS 149  -0.731 -21.141  14.068
 1232    HD2  LYS 149           HD2      LYS 149   1.255 -22.340  14.866
 1233    HD3  LYS 149           HD3      LYS 149   0.408 -23.882  14.746
 1234    HE2  LYS 149           HE2      LYS 149   0.306 -23.783  12.384
 1235    HE3  LYS 149           HE3      LYS 149   0.676 -22.051  12.338
 1236    HZ1  LYS 149           HZ1      LYS 149   2.946 -22.482  12.901
 1237    HZ2  LYS 149           HZ2      LYS 149   2.659 -24.086  13.225
 1238    HZ3  LYS 149           HZ3      LYS 149   2.568 -23.518  11.699
 1239    H    GLU 150           H        GLU 150   0.242 -19.391  15.207
 1240    HA   GLU 150           HA       GLU 150   2.759 -20.448  15.063
 1241    HB2  GLU 150           HB2      GLU 150   1.560 -17.709  14.601
 1242    HB3  GLU 150           HB3      GLU 150   3.321 -17.867  14.488
 1243    HG2  GLU 150           HG2      GLU 150   1.434 -19.565  12.915
 1244    HG3  GLU 150           HG3      GLU 150   2.171 -18.027  12.407
 1245    H    PHE 151           H        PHE 151   1.533 -18.039  17.318
 1246    HA   PHE 151           HA       PHE 151   4.190 -17.905  18.681
 1247    HB2  PHE 151           HB2      PHE 151   1.996 -15.895  19.009
 1248    HB3  PHE 151           HB3      PHE 151   3.739 -15.731  19.206
 1249    HD1  PHE 151           HD1      PHE 151   4.761 -16.785  16.468
 1250    HD2  PHE 151           HD2      PHE 151   1.406 -14.224  17.480
 1251    HE1  PHE 151           HE1      PHE 151   4.741 -15.894  14.249
 1252    HE2  PHE 151           HE2      PHE 151   1.482 -13.279  15.232
 1253    HZ   PHE 151           HZ       PHE 151   3.151 -14.141  13.578
 1254    H    ALA 152           H        ALA 152   0.967 -19.129  19.106
 1255    HA   ALA 152           HA       ALA 152   0.451 -18.881  21.809
 1256    HB1  ALA 152           HB1      ALA 152   0.029 -21.271  19.936
 1257    HB2  ALA 152           HB2      ALA 152  -0.714 -21.110  21.536
 1258    HB3  ALA 152           HB3      ALA 152  -1.122 -19.955  20.263
 1259    H    SER 153           H        SER 153   2.666 -21.154  20.203
 1260    HA   SER 153           HA       SER 153   3.242 -22.731  22.488
 1261    HB2  SER 153           HB2      SER 153   5.035 -22.188  20.082
 1262    HB3  SER 153           HB3      SER 153   5.065 -23.612  21.138
 1263    HG   SER 153           HG       SER 153   3.896 -24.051  19.215
 1264    H    VAL 154           H        VAL 154   4.537 -19.607  21.392
 1265    HA   VAL 154           HA       VAL 154   6.693 -19.580  23.382
 1266    HB   VAL 154           HB       VAL 154   5.438 -17.324  21.756
 1267   HG11  VAL 154          HG11      VAL 154   7.439 -16.047  22.357
 1268   HG12  VAL 154          HG12      VAL 154   6.477 -16.425  23.800
 1269   HG13  VAL 154          HG13      VAL 154   7.965 -17.346  23.451
 1270   HG21  VAL 154          HG21      VAL 154   7.577 -17.465  20.433
 1271   HG22  VAL 154          HG22      VAL 154   8.001 -18.930  21.336
 1272   HG23  VAL 154          HG23      VAL 154   6.581 -18.915  20.272
 1273    H    VAL 155           H        VAL 155   3.351 -18.309  23.016
 1274    HA   VAL 155           HA       VAL 155   3.375 -16.827  25.386
 1275    HB   VAL 155           HB       VAL 155   0.940 -18.167  24.150
 1276   HG11  VAL 155          HG11      VAL 155   1.329 -15.888  26.161
 1277   HG12  VAL 155          HG12      VAL 155  -0.216 -16.169  25.271
 1278   HG13  VAL 155          HG13      VAL 155   0.417 -17.393  26.384
 1279   HG21  VAL 155          HG21      VAL 155   1.843 -16.777  22.437
 1280   HG22  VAL 155          HG22      VAL 155   0.615 -15.791  23.192
 1281   HG23  VAL 155          HG23      VAL 155   2.346 -15.532  23.581
 1282    H    MET 156           H        MET 156   2.516 -20.365  25.029
 1283    HA   MET 156           HA       MET 156   1.541 -20.717  27.569
 1284    HB2  MET 156           HB2      MET 156   3.487 -22.563  26.062
 1285    HB3  MET 156           HB3      MET 156   2.468 -23.072  27.415
 1286    HG2  MET 156           HG2      MET 156   1.552 -22.230  24.660
 1287    HG3  MET 156           HG3      MET 156   1.449 -23.825  25.365
 1288    HE1  MET 156           HE1      MET 156  -0.608 -20.967  24.272
 1289    HE2  MET 156           HE2      MET 156  -0.929 -22.675  23.875
 1290    HE3  MET 156           HE3      MET 156  -2.131 -21.729  24.778
 1291    H    SER 157           H        SER 157   4.915 -20.890  26.523
 1292    HA   SER 157           HA       SER 157   5.955 -21.379  29.149
 1293    HB2  SER 157           HB2      SER 157   7.001 -20.861  26.364
 1294    HB3  SER 157           HB3      SER 157   8.133 -21.069  27.744
 1295    HG   SER 157           HG       SER 157   7.688 -23.061  26.646
 1296    H    LEU 158           H        LEU 158   5.340 -18.496  27.233
 1297    HA   LEU 158           HA       LEU 158   6.873 -16.622  28.718
 1298    HB2  LEU 158           HB2      LEU 158   5.699 -16.335  26.439
 1299    HB3  LEU 158           HB3      LEU 158   4.167 -16.273  27.323
 1300    HG   LEU 158           HG       LEU 158   5.057 -14.252  28.563
 1301   HD11  LEU 158          HD11      LEU 158   6.846 -12.996  27.397
 1302   HD12  LEU 158          HD12      LEU 158   7.446 -14.545  28.002
 1303   HD13  LEU 158          HD13      LEU 158   7.082 -14.371  26.277
 1304   HD21  LEU 158          HD21      LEU 158   4.504 -12.868  26.435
 1305   HD22  LEU 158          HD22      LEU 158   4.450 -14.410  25.586
 1306   HD23  LEU 158          HD23      LEU 158   3.339 -14.128  26.950
 1307    H    GLN 159           H        GLN 159   3.533 -17.856  29.061
 1308    HA   GLN 159           HA       GLN 159   2.830 -16.367  31.386
 1309    HB2  GLN 159           HB2      GLN 159   1.871 -19.205  30.817
 1310    HB3  GLN 159           HB3      GLN 159   1.117 -17.995  31.837
 1311    HG2  GLN 159           HG2      GLN 159   0.826 -16.592  29.638
 1312    HG3  GLN 159           HG3      GLN 159   1.233 -18.106  28.824
 1313   HE21  GLN 159          HE22      GLN 159  -0.942 -17.308  31.602
 1314   HE22  GLN 159          HE21      GLN 159  -2.286 -18.263  30.978
 1315    H    GLU 160           H        GLU 160   4.510 -19.483  31.099
 1316    HA   GLU 160           HA       GLU 160   4.460 -20.006  33.881
 1317    HB2  GLU 160           HB2      GLU 160   6.072 -21.226  31.608
 1318    HB3  GLU 160           HB3      GLU 160   6.129 -21.827  33.272
 1319    HG2  GLU 160           HG2      GLU 160   3.658 -22.122  33.245
 1320    HG3  GLU 160           HG3      GLU 160   3.640 -21.658  31.550
 1321    H    ASN 161           H        ASN 161   6.812 -18.311  31.870
 1322    HA   ASN 161           HA       ASN 161   8.930 -18.647  33.934
 1323    HB2  ASN 161           HB2      ASN 161   8.899 -17.659  31.067
 1324    HB3  ASN 161           HB3      ASN 161  10.260 -17.353  32.143
 1325   HD21  ASN 161          HD22      ASN 161   8.410 -19.976  30.582
 1326   HD22  ASN 161          HD21      ASN 161   9.656 -21.202  30.791
 1327    H    THR 162           H        THR 162   6.552 -16.275  32.944
 1328    HA   THR 162           HA       THR 162   6.424 -14.075  32.950
 1329    HB   THR 162           HB       THR 162   6.140 -13.340  35.109
 1330    HG1  THR 162           HG1      THR 162   7.929 -15.369  35.994
 1331   HG21  THR 162          HG21      THR 162   4.663 -15.180  34.418
 1332   HG22  THR 162          HG22      THR 162   5.713 -16.329  35.271
 1333   HG23  THR 162          HG23      THR 162   4.840 -15.073  36.177
 1334    HA   PRO 163           HA       PRO 163  10.894 -13.842  32.447
 1335    HB2  PRO 163           HB2      PRO 163  10.370 -12.672  29.717
 1336    HB3  PRO 163           HB3      PRO 163  11.650 -13.814  30.257
 1337    HG2  PRO 163           HG2      PRO 163   9.440 -14.764  28.992
 1338    HG3  PRO 163           HG3      PRO 163  10.067 -15.600  30.445
 1339    HD2  PRO 163           HD2      PRO 163   7.849 -13.503  30.342
 1340    HD3  PRO 163           HD3      PRO 163   7.787 -15.146  31.043
 1341    H    LYS 164           H        LYS 164  12.473 -11.954  32.112
 1342    HA   LYS 164           HA       LYS 164  11.171  -9.605  33.323
 1343    HB2  LYS 164           HB2      LYS 164  14.137 -10.243  33.329
 1344    HB3  LYS 164           HB3      LYS 164  13.240  -9.209  34.435
 1345    HG2  LYS 164           HG2      LYS 164  13.086 -12.257  34.230
 1346    HG3  LYS 164           HG3      LYS 164  13.897 -11.339  35.499
 1347    HD2  LYS 164           HD2      LYS 164  11.752 -10.465  36.323
 1348    HD3  LYS 164           HD3      LYS 164  10.893 -11.217  34.972
 1349    HE2  LYS 164           HE2      LYS 164  11.887 -13.461  35.792
 1350    HE3  LYS 164           HE3      LYS 164  12.309 -12.605  37.280
 1351    HZ1  LYS 164           HZ1      LYS 164   9.578 -12.929  36.141
 1352    HZ2  LYS 164           HZ2      LYS 164  10.159 -13.695  37.469
 1353    HZ3  LYS 164           HZ3      LYS 164   9.913 -12.079  37.518
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1  -0.522   1.821  -1.812
    2    H2   MET   1           H2       MET   1  -1.403   1.386  -3.117
    3    H3   MET   1           H3       MET   1  -1.289   0.373  -1.831
    4    HA   MET   1           HA       MET   1   0.909   1.203  -3.605
    5    HB2  MET   1           HB2      MET   1   1.568   0.776  -1.192
    6    HB3  MET   1           HB3      MET   1   1.159  -0.915  -1.405
    7    HG2  MET   1           HG2      MET   1   3.175   0.616  -3.101
    8    HG3  MET   1           HG3      MET   1   3.559  -0.271  -1.627
    9    HE1  MET   1           HE1      MET   1   4.011  -3.819  -2.520
   10    HE2  MET   1           HE2      MET   1   4.812  -2.430  -1.758
   11    HE3  MET   1           HE3      MET   1   3.143  -2.835  -1.303
   12    H    ILE   2           H        ILE   2   0.157  -2.141  -2.641
   13    HA   ILE   2           HA       ILE   2  -0.193  -3.988  -3.729
   14    HB   ILE   2           HB       ILE   2  -1.694  -2.615  -5.935
   15   HG12  ILE   2          HG12      ILE   2  -2.353  -2.991  -3.058
   16   HG13  ILE   2          HG13      ILE   2  -2.983  -1.827  -4.248
   17   HG21  ILE   2          HG21      ILE   2  -1.881  -5.420  -4.740
   18   HG22  ILE   2          HG22      ILE   2  -2.788  -4.806  -6.131
   19   HG23  ILE   2          HG23      ILE   2  -1.041  -5.028  -6.258
   20   HD11  ILE   2          HD11      ILE   2  -4.718  -3.164  -3.395
   21   HD12  ILE   2          HD12      ILE   2  -4.485  -3.645  -5.090
   22   HD13  ILE   2          HD13      ILE   2  -3.846  -4.673  -3.755
   23    H    ASP   3           H        ASP   3   1.341  -5.191  -4.701
   24    HA   ASP   3           HA       ASP   3   3.585  -3.909  -5.716
   25    HB2  ASP   3           HB2      ASP   3   3.660  -6.040  -4.515
   26    HB3  ASP   3           HB3      ASP   3   2.863  -6.835  -5.883
   27    H    ASP   4           H        ASP   4   1.670  -6.332  -7.528
   28    HA   ASP   4           HA       ASP   4   1.712  -4.773  -9.941
   29    HB2  ASP   4           HB2      ASP   4   4.023  -5.598 -10.024
   30    HB3  ASP   4           HB3      ASP   4   3.460  -7.245  -9.745
   31    H    ASP   5           H        ASP   5   1.523  -8.148  -8.827
   32    HA   ASP   5           HA       ASP   5  -0.386  -8.774 -10.893
   33    HB2  ASP   5           HB2      ASP   5   1.578 -10.195 -10.305
   34    HB3  ASP   5           HB3      ASP   5   0.777 -10.611  -8.792
   35    H    GLY   6           H        GLY   6  -1.095  -7.142  -8.407
   36    HA2  GLY   6           HA2      GLY   6  -3.193  -6.672  -7.533
   37    HA3  GLY   6           HA3      GLY   6  -3.795  -8.262  -8.003
   38    H    TYR   7           H        TYR   7  -0.877  -8.738  -6.396
   39    HA   TYR   7           HA       TYR   7  -2.198  -8.964  -3.750
   40    HB2  TYR   7           HB2      TYR   7   0.344 -10.389  -4.553
   41    HB3  TYR   7           HB3      TYR   7  -0.612 -10.590  -3.087
   42    HD1  TYR   7           HD2      TYR   7  -0.481 -11.296  -6.737
   43    HD2  TYR   7           HD1      TYR   7  -2.559 -12.043  -3.029
   44    HE1  TYR   7           HE2      TYR   7  -1.777 -13.088  -7.830
   45    HE2  TYR   7           HE1      TYR   7  -3.873 -13.831  -4.121
   46    HH   TYR   7           HH       TYR   7  -4.312 -14.999  -6.142
   47    H    ARG   8           H        ARG   8  -0.594  -8.564  -1.911
   48    HA   ARG   8           HA       ARG   8   1.234  -6.319  -2.402
   49    HB2  ARG   8           HB2      ARG   8  -0.109  -4.780  -0.956
   50    HB3  ARG   8           HB3      ARG   8  -1.042  -5.297  -2.371
   51    HG2  ARG   8           HG2      ARG   8  -2.112  -7.065  -0.989
   52    HG3  ARG   8           HG3      ARG   8  -1.411  -6.324   0.461
   53    HD2  ARG   8           HD2      ARG   8  -3.068  -4.816  -1.582
   54    HD3  ARG   8           HD3      ARG   8  -3.804  -5.771  -0.252
   55    HE   ARG   8           HE       ARG   8  -1.806  -3.942   0.755
   56   HH11  ARG   8          HH11      ARG   8  -5.192  -3.951  -0.386
   57   HH12  ARG   8          HH12      ARG   8  -5.624  -2.532   0.496
   58   HH21  ARG   8          HH21      ARG   8  -2.413  -2.049   1.921
   59   HH22  ARG   8          HH22      ARG   8  -4.029  -1.453   1.832
   60    HA   PRO   9           HA       PRO   9   2.721  -8.516   1.202
   61    HB2  PRO   9           HB2      PRO   9   4.971  -7.162   1.825
   62    HB3  PRO   9           HB3      PRO   9   4.782  -8.025   0.280
   63    HG2  PRO   9           HG2      PRO   9   4.440  -5.058   0.779
   64    HG3  PRO   9           HG3      PRO   9   5.337  -5.872  -0.536
   65    HD2  PRO   9           HD2      PRO   9   2.741  -4.911  -0.704
   66    HD3  PRO   9           HD3      PRO   9   3.402  -6.229  -1.719
   67    H    ASN  10           H        ASN  10   2.106  -8.550   3.347
   68    HA   ASN  10           HA       ASN  10   1.380  -5.996   4.724
   69    HB2  ASN  10           HB2      ASN  10  -0.689  -6.860   3.901
   70    HB3  ASN  10           HB3      ASN  10  -0.233  -8.519   4.250
   71   HD21  ASN  10          HD22      ASN  10  -1.845  -5.711   5.556
   72   HD22  ASN  10          HD21      ASN  10  -2.187  -6.440   7.104
   73    H    VAL  11           H        VAL  11   1.491  -6.107   7.008
   74    HA   VAL  11           HA       VAL  11   2.624  -8.535   8.166
   75    HB   VAL  11           HB       VAL  11   4.167  -7.243   9.601
   76   HG11  VAL  11          HG11      VAL  11   5.343  -8.313   8.111
   77   HG12  VAL  11          HG12      VAL  11   4.636  -7.485   6.716
   78   HG13  VAL  11          HG13      VAL  11   5.827  -6.652   7.748
   79   HG21  VAL  11          HG21      VAL  11   3.634  -4.907   7.711
   80   HG22  VAL  11          HG22      VAL  11   3.142  -4.982   9.421
   81   HG23  VAL  11          HG23      VAL  11   4.858  -4.999   8.991
   82    H    GLY  12           H        GLY  12   2.129  -8.717  10.459
   83    HA2  GLY  12           HA2      GLY  12  -0.045  -6.935  11.416
   84    HA3  GLY  12           HA3      GLY  12  -0.326  -8.663  11.273
   85    H    ILE  13           H        ILE  13  -0.487  -7.177  13.720
   86    HA   ILE  13           HA       ILE  13   1.919  -8.068  15.225
   87    HB   ILE  13           HB       ILE  13   0.225  -5.542  15.393
   88   HG12  ILE  13          HG12      ILE  13   3.062  -5.038  15.443
   89   HG13  ILE  13          HG13      ILE  13   2.759  -6.193  14.150
   90   HG21  ILE  13          HG21      ILE  13   1.636  -4.908  17.325
   91   HG22  ILE  13          HG22      ILE  13   0.608  -6.290  17.672
   92   HG23  ILE  13          HG23      ILE  13   2.346  -6.547  17.330
   93   HD11  ILE  13          HD11      ILE  13   2.650  -3.905  13.292
   94   HD12  ILE  13          HD12      ILE  13   1.052  -4.675  13.168
   95   HD13  ILE  13          HD13      ILE  13   1.377  -3.501  14.467
   96    H    VAL  14           H        VAL  14   1.556  -9.122  17.068
   97    HA   VAL  14           HA       VAL  14  -1.208  -9.250  18.182
   98    HB   VAL  14           HB       VAL  14   0.839 -11.522  18.178
   99   HG11  VAL  14          HG11      VAL  14  -1.057 -12.878  18.969
  100   HG12  VAL  14          HG12      VAL  14  -0.738 -11.542  20.069
  101   HG13  VAL  14          HG13      VAL  14  -2.112 -11.435  18.942
  102   HG21  VAL  14          HG21      VAL  14  -1.556 -11.174  16.333
  103   HG22  VAL  14          HG22      VAL  14   0.166 -11.313  15.877
  104   HG23  VAL  14          HG23      VAL  14  -0.671 -12.699  16.579
  105    H    ILE  15           H        ILE  15  -1.134  -8.769  20.458
  106    HA   ILE  15           HA       ILE  15   1.562  -8.772  21.669
  107    HB   ILE  15           HB       ILE  15  -0.569  -6.885  22.673
  108   HG12  ILE  15          HG12      ILE  15   0.015  -6.074  20.395
  109   HG13  ILE  15          HG13      ILE  15   0.528  -4.990  21.687
  110   HG21  ILE  15          HG21      ILE  15   2.412  -7.206  23.178
  111   HG22  ILE  15          HG22      ILE  15   1.435  -5.846  23.752
  112   HG23  ILE  15          HG23      ILE  15   1.076  -7.486  24.321
  113   HD11  ILE  15          HD11      ILE  15   2.218  -5.198  19.907
  114   HD12  ILE  15          HD12      ILE  15   2.834  -5.713  21.493
  115   HD13  ILE  15          HD13      ILE  15   2.344  -6.937  20.281
  116    H    CYS  16           H        CYS  16   1.679 -10.065  23.525
  117    HA   CYS  16           HA       CYS  16  -0.951 -10.845  24.674
  118    HB2  CYS  16           HB2      CYS  16  -0.299 -13.105  25.035
  119    HB3  CYS  16           HB3      CYS  16   0.007 -12.727  23.330
  120    HG   CYS  16           HG       CYS  16   2.123 -12.779  25.896
  121    H    ASN  17           H        ASN  17  -0.991 -11.412  26.880
  122    HA   ASN  17           HA       ASN  17   1.047  -9.963  28.514
  123    HB2  ASN  17           HB2      ASN  17  -0.658  -9.480  30.097
  124    HB3  ASN  17           HB3      ASN  17  -1.277  -9.037  28.520
  125   HD21  ASN  17          HD22      ASN  17  -3.286  -9.112  30.114
  126   HD22  ASN  17          HD21      ASN  17  -4.152 -10.634  30.134
  127    H    ARG  18           H        ARG  18   1.037 -11.063  30.924
  128    HA   ARG  18           HA       ARG  18   1.946 -13.793  30.379
  129    HB2  ARG  18           HB2      ARG  18   1.939 -12.236  33.008
  130    HB3  ARG  18           HB3      ARG  18   2.610 -13.858  32.774
  131    HG2  ARG  18           HG2      ARG  18   4.520 -12.851  32.328
  132    HG3  ARG  18           HG3      ARG  18   3.826 -12.628  30.717
  133    HD2  ARG  18           HD2      ARG  18   3.000 -10.382  31.425
  134    HD3  ARG  18           HD3      ARG  18   3.774 -10.634  33.018
  135    HE   ARG  18           HE       ARG  18   5.644 -11.018  30.857
  136   HH11  ARG  18          HH11      ARG  18   4.237  -8.532  32.996
  137   HH12  ARG  18          HH12      ARG  18   5.463  -7.364  32.666
  138   HH21  ARG  18          HH21      ARG  18   7.077  -9.375  30.215
  139   HH22  ARG  18          HH22      ARG  18   7.196  -7.892  31.129
  140    H    GLN  19           H        GLN  19  -1.081 -12.837  30.632
  141    HA   GLN  19           HA       GLN  19  -1.999 -15.032  32.367
  142    HB2  GLN  19           HB2      GLN  19  -3.789 -13.034  30.976
  143    HB3  GLN  19           HB3      GLN  19  -4.162 -14.025  32.372
  144    HG2  GLN  19           HG2      GLN  19  -2.300 -11.626  32.249
  145    HG3  GLN  19           HG3      GLN  19  -3.907 -11.660  32.947
  146   HE21  GLN  19          HE22      GLN  19  -1.637 -10.779  34.438
  147   HE22  GLN  19          HE21      GLN  19  -1.361 -11.922  35.734
  148    H    GLY  20           H        GLY  20  -1.129 -14.575  29.114
  149    HA2  GLY  20           HA2      GLY  20  -1.495 -15.956  27.298
  150    HA3  GLY  20           HA3      GLY  20  -2.637 -16.927  28.237
  151    H    GLN  21           H        GLN  21  -2.977 -13.364  28.058
  152    HA   GLN  21           HA       GLN  21  -5.332 -13.736  26.277
  153    HB2  GLN  21           HB2      GLN  21  -4.650 -11.318  27.969
  154    HB3  GLN  21           HB3      GLN  21  -6.098 -11.562  27.004
  155    HG2  GLN  21           HG2      GLN  21  -6.828 -13.395  28.473
  156    HG3  GLN  21           HG3      GLN  21  -5.342 -13.244  29.419
  157   HE21  GLN  21          HE22      GLN  21  -8.574 -11.902  28.980
  158   HE22  GLN  21          HE21      GLN  21  -8.408 -10.661  30.195
  159    H    VAL  22           H        VAL  22  -5.445 -12.391  24.456
  160    HA   VAL  22           HA       VAL  22  -2.950 -11.060  23.597
  161    HB   VAL  22           HB       VAL  22  -3.453 -11.672  21.337
  162   HG11  VAL  22          HG11      VAL  22  -3.795 -14.167  23.077
  163   HG12  VAL  22          HG12      VAL  22  -3.126 -14.080  21.425
  164   HG13  VAL  22          HG13      VAL  22  -2.266 -13.335  22.790
  165   HG21  VAL  22          HG21      VAL  22  -5.333 -13.159  20.696
  166   HG22  VAL  22          HG22      VAL  22  -6.013 -13.030  22.335
  167   HG23  VAL  22          HG23      VAL  22  -5.910 -11.601  21.285
  168    H    MET  23           H        MET  23  -3.266  -8.939  22.640
  169    HA   MET  23           HA       MET  23  -5.839  -7.708  23.379
  170    HB2  MET  23           HB2      MET  23  -4.960  -5.625  22.824
  171    HB3  MET  23           HB3      MET  23  -3.726  -6.489  23.732
  172    HG2  MET  23           HG2      MET  23  -2.577  -7.051  21.589
  173    HG3  MET  23           HG3      MET  23  -3.757  -6.063  20.716
  174    HE1  MET  23           HE1      MET  23  -4.288  -3.503  22.313
  175    HE2  MET  23           HE2      MET  23  -2.922  -2.463  21.845
  176    HE3  MET  23           HE3      MET  23  -3.753  -3.450  20.610
  177    H    TRP  24           H        TRP  24  -7.348  -6.827  21.937
  178    HA   TRP  24           HA       TRP  24  -7.223  -7.585  19.074
  179    HB2  TRP  24           HB2      TRP  24  -8.074  -9.484  20.467
  180    HB3  TRP  24           HB3      TRP  24  -9.329  -8.437  21.097
  181    HD1  TRP  24           HD1      TRP  24  -8.285  -9.279  17.423
  182    HE1  TRP  24           HE1      TRP  24 -10.340 -10.214  16.206
  183    HE3  TRP  24           HE3      TRP  24 -11.680  -8.981  21.222
  184    HZ2  TRP  24           HZ2      TRP  24 -13.023 -10.995  16.876
  185    HZ3  TRP  24           HZ3      TRP  24 -14.029  -9.705  20.862
  186    HH2  TRP  24           HH2      TRP  24 -14.712 -10.683  18.701
  187    H    ALA  25           H        ALA  25  -8.766  -6.118  17.842
  188    HA   ALA  25           HA       ALA  25 -10.007  -3.971  19.472
  189    HB1  ALA  25           HB1      ALA  25  -7.838  -3.463  17.386
  190    HB2  ALA  25           HB2      ALA  25  -8.698  -2.235  18.357
  191    HB3  ALA  25           HB3      ALA  25  -7.590  -3.366  19.129
  192    H    ARG  26           H        ARG  26 -11.571  -2.682  18.354
  193    HA   ARG  26           HA       ARG  26 -12.478  -3.911  15.808
  194    HB2  ARG  26           HB2      ARG  26 -14.703  -3.176  16.161
  195    HB3  ARG  26           HB3      ARG  26 -14.155  -4.131  17.524
  196    HG2  ARG  26           HG2      ARG  26 -13.765  -2.006  18.801
  197    HG3  ARG  26           HG3      ARG  26 -14.447  -1.111  17.430
  198    HD2  ARG  26           HD2      ARG  26 -16.528  -2.643  17.719
  199    HD3  ARG  26           HD3      ARG  26 -15.817  -3.095  19.278
  200    HE   ARG  26           HE       ARG  26 -16.171  -0.202  18.658
  201   HH11  ARG  26          HH11      ARG  26 -17.543  -2.961  20.474
  202   HH12  ARG  26          HH12      ARG  26 -18.507  -1.935  21.476
  203   HH21  ARG  26          HH21      ARG  26 -17.405   1.038  19.834
  204   HH22  ARG  26          HH22      ARG  26 -18.427   0.450  21.133
  205    H    ARG  27           H        ARG  27 -12.517  -2.702  13.884
  206    HA   ARG  27           HA       ARG  27 -10.751  -0.407  14.223
  207    HB2  ARG  27           HB2      ARG  27 -10.385  -2.211  12.565
  208    HB3  ARG  27           HB3      ARG  27 -11.788  -1.659  11.655
  209    HG2  ARG  27           HG2      ARG  27 -10.666   0.608  11.429
  210    HG3  ARG  27           HG3      ARG  27  -9.315  -0.040  12.383
  211    HD2  ARG  27           HD2      ARG  27  -9.123  -1.836  10.494
  212    HD3  ARG  27           HD3      ARG  27 -10.087  -0.703   9.544
  213    HE   ARG  27           HE       ARG  27  -8.361   0.904   9.664
  214   HH11  ARG  27          HH11      ARG  27  -7.303  -2.164  11.203
  215   HH12  ARG  27          HH12      ARG  27  -5.713  -1.546  11.574
  216   HH21  ARG  27          HH21      ARG  27  -6.307   1.702  10.374
  217   HH22  ARG  27          HH22      ARG  27  -5.135   0.554  10.979
  218    H    PHE  28           H        PHE  28 -11.125   1.709  13.516
  219    HA   PHE  28           HA       PHE  28 -13.621   2.717  14.384
  220    HB2  PHE  28           HB2      PHE  28 -11.424   3.855  14.525
  221    HB3  PHE  28           HB3      PHE  28 -11.407   4.045  12.779
  222    HD1  PHE  28           HD1      PHE  28 -13.093   5.071  15.941
  223    HD2  PHE  28           HD2      PHE  28 -12.617   5.865  11.722
  224    HE1  PHE  28           HE1      PHE  28 -14.225   7.257  16.221
  225    HE2  PHE  28           HE2      PHE  28 -13.744   8.059  12.015
  226    HZ   PHE  28           HZ       PHE  28 -14.553   8.757  14.261
  227    H    GLY  29           H        GLY  29 -15.414   3.393  13.327
  228    HA2  GLY  29           HA2      GLY  29 -16.966   3.670  11.677
  229    HA3  GLY  29           HA3      GLY  29 -15.679   3.601  10.467
  230    H    GLN  30           H        GLN  30 -15.137   0.773  12.081
  231    HA   GLN  30           HA       GLN  30 -16.849  -0.764  10.191
  232    HB2  GLN  30           HB2      GLN  30 -14.584  -1.969  11.770
  233    HB3  GLN  30           HB3      GLN  30 -15.299  -2.490  10.252
  234    HG2  GLN  30           HG2      GLN  30 -13.361  -0.227  10.760
  235    HG3  GLN  30           HG3      GLN  30 -13.094  -1.691   9.844
  236   HE21  GLN  30          HE22      GLN  30 -13.623   1.597   9.457
  237   HE22  GLN  30          HE21      GLN  30 -14.291   1.574   7.831
  238    H    HIS  31           H        HIS  31 -15.802  -0.592  13.590
  239    HA   HIS  31           HA       HIS  31 -16.510  -1.582  15.499
  240    HB2  HIS  31           HB2      HIS  31 -19.320  -1.426  14.403
  241    HB3  HIS  31           HB3      HIS  31 -18.792  -1.330  16.077
  242    HD1  HIS  31           HD1      HIS  31 -17.600   1.136  16.804
  243    HD2  HIS  31           HD2      HIS  31 -19.203   0.775  12.911
  244    HE1  HIS  31           HE1      HIS  31 -17.733   3.477  15.857
  245    H    SER  32           H        SER  32 -15.636  -3.320  13.397
  246    HA   SER  32           HA       SER  32 -16.740  -5.896  14.373
  247    HB2  SER  32           HB2      SER  32 -15.640  -5.297  11.586
  248    HB3  SER  32           HB3      SER  32 -16.144  -6.882  12.193
  249    HG   SER  32           HG       SER  32 -17.815  -4.578  11.842
  250    H    TRP  33           H        TRP  33 -14.962  -7.456  14.794
  251    HA   TRP  33           HA       TRP  33 -12.649  -5.925  15.754
  252    HB2  TRP  33           HB2      TRP  33 -13.721  -8.646  16.424
  253    HB3  TRP  33           HB3      TRP  33 -12.314  -7.856  17.160
  254    HD1  TRP  33           HD1      TRP  33 -16.142  -7.332  16.928
  255    HE1  TRP  33           HE1      TRP  33 -16.912  -5.960  18.924
  256    HE3  TRP  33           HE3      TRP  33 -11.595  -6.479  19.078
  257    HZ2  TRP  33           HZ2      TRP  33 -15.697  -4.707  21.268
  258    HZ3  TRP  33           HZ3      TRP  33 -11.416  -5.104  21.130
  259    HH2  TRP  33           HH2      TRP  33 -13.458  -4.209  22.232
  260    H    GLN  34           H        GLN  34 -10.513  -6.525  15.554
  261    HA   GLN  34           HA       GLN  34  -9.681  -8.408  13.445
  262    HB2  GLN  34           HB2      GLN  34  -9.105  -5.401  13.460
  263    HB3  GLN  34           HB3      GLN  34  -8.405  -6.574  12.342
  264    HG2  GLN  34           HG2      GLN  34 -10.654  -6.983  11.374
  265    HG3  GLN  34           HG3      GLN  34 -11.331  -5.747  12.451
  266   HE21  GLN  34          HE22      GLN  34 -11.821  -5.253   9.862
  267   HE22  GLN  34          HE21      GLN  34 -10.750  -4.031   9.219
  268    H    PHE  35           H        PHE  35  -7.282  -8.552  13.393
  269    HA   PHE  35           HA       PHE  35  -5.955  -7.780  15.951
  270    HB2  PHE  35           HB2      PHE  35  -5.067  -9.619  13.702
  271    HB3  PHE  35           HB3      PHE  35  -4.071  -9.169  15.090
  272    HD1  PHE  35           HD2      PHE  35  -5.677  -9.504  17.443
  273    HD2  PHE  35           HD1      PHE  35  -5.465 -11.927  13.860
  274    HE1  PHE  35           HE2      PHE  35  -6.382 -11.486  18.737
  275    HE2  PHE  35           HE1      PHE  35  -6.110 -13.906  15.189
  276    HZ   PHE  35           HZ       PHE  35  -6.583 -13.698  17.619
  277    HA   PRO  36           HA       PRO  36  -4.528  -4.220  13.782
  278    HB2  PRO  36           HB2      PRO  36  -2.152  -3.593  15.075
  279    HB3  PRO  36           HB3      PRO  36  -3.788  -3.321  15.756
  280    HG2  PRO  36           HG2      PRO  36  -1.906  -5.640  16.243
  281    HG3  PRO  36           HG3      PRO  36  -2.842  -4.705  17.448
  282    HD2  PRO  36           HD2      PRO  36  -3.695  -7.112  16.529
  283    HD3  PRO  36           HD3      PRO  36  -4.857  -5.783  16.844
  284    H    GLN  37           H        GLN  37  -3.370  -3.695  11.898
  285    HA   GLN  37           HA       GLN  37  -1.011  -5.207  11.125
  286    HB2  GLN  37           HB2      GLN  37  -2.054  -6.446   9.277
  287    HB3  GLN  37           HB3      GLN  37  -2.787  -6.895  10.807
  288    HG2  GLN  37           HG2      GLN  37  -4.644  -5.154  10.241
  289    HG3  GLN  37           HG3      GLN  37  -3.962  -5.148   8.615
  290   HE21  GLN  37          HE22      GLN  37  -5.686  -7.074  11.068
  291   HE22  GLN  37          HE21      GLN  37  -6.197  -8.337   9.953
  292    H    GLY  38           H        GLY  38  -0.349  -4.738   8.791
  293    HA2  GLY  38           HA2      GLY  38  -1.460  -2.370   7.528
  294    HA3  GLY  38           HA3      GLY  38   0.016  -2.048   8.442
  295    H    GLY  39           H        GLY  39   0.338  -1.525   5.841
  296    HA2  GLY  39           HA2      GLY  39   1.042  -3.920   4.289
  297    HA3  GLY  39           HA3      GLY  39   0.846  -2.275   3.693
  298    H    ILE  40           H        ILE  40   3.067  -4.211   3.559
  299    HA   ILE  40           HA       ILE  40   5.365  -2.823   4.840
  300    HB   ILE  40           HB       ILE  40   5.178  -5.089   2.816
  301   HG12  ILE  40          HG12      ILE  40   6.409  -5.331   5.558
  302   HG13  ILE  40          HG13      ILE  40   4.676  -5.548   5.358
  303   HG21  ILE  40          HG21      ILE  40   7.218  -3.780   2.362
  304   HG22  ILE  40          HG22      ILE  40   7.675  -3.884   4.076
  305   HG23  ILE  40          HG23      ILE  40   7.656  -5.326   3.056
  306   HD11  ILE  40          HD11      ILE  40   4.924  -7.489   4.087
  307   HD12  ILE  40          HD12      ILE  40   6.601  -7.134   3.613
  308   HD13  ILE  40          HD13      ILE  40   6.250  -7.635   5.259
  309    H    ASN  41           H        ASN  41   6.089  -0.960   3.911
  310    HA   ASN  41           HA       ASN  41   5.121  -0.119   1.254
  311    HB2  ASN  41           HB2      ASN  41   7.073   1.192   3.201
  312    HB3  ASN  41           HB3      ASN  41   6.550   1.891   1.677
  313   HD21  ASN  41          HD22      ASN  41   5.417   0.806   4.878
  314   HD22  ASN  41          HD21      ASN  41   3.888   1.691   4.843
  315    HA   PRO  42           HA       PRO  42   8.301  -2.156  -0.886
  316    HB2  PRO  42           HB2      PRO  42   9.114  -0.422  -2.906
  317    HB3  PRO  42           HB3      PRO  42   7.598  -1.375  -2.911
  318    HG2  PRO  42           HG2      PRO  42   7.976   1.508  -2.053
  319    HG3  PRO  42           HG3      PRO  42   6.711   0.824  -3.122
  320    HD2  PRO  42           HD2      PRO  42   6.211   1.297  -0.511
  321    HD3  PRO  42           HD3      PRO  42   5.597  -0.193  -1.295
  322    H    GLY  43           H        GLY  43  10.340  -2.509  -0.083
  323    HA2  GLY  43           HA2      GLY  43  12.636  -1.964   0.210
  324    HA3  GLY  43           HA3      GLY  43  12.224  -0.263   0.420
  325    H    GLU  44           H        GLU  44   9.874  -1.447   2.338
  326    HA   GLU  44           HA       GLU  44  11.458  -1.405   4.788
  327    HB2  GLU  44           HB2      GLU  44   8.517  -1.733   4.137
  328    HB3  GLU  44           HB3      GLU  44   9.123  -2.226   5.713
  329    HG2  GLU  44           HG2      GLU  44   9.762  -0.116   6.352
  330    HG3  GLU  44           HG3      GLU  44   9.738   0.529   4.694
  331    H    SER  45           H        SER  45  11.741  -3.265   6.185
  332    HA   SER  45           HA       SER  45  11.538  -5.906   4.839
  333    HB2  SER  45           HB2      SER  45  12.760  -6.713   6.829
  334    HB3  SER  45           HB3      SER  45  13.656  -5.447   5.971
  335    HG   SER  45           HG       SER  45  13.468  -5.274   8.361
  336    H    ALA  46           H        ALA  46  10.452  -7.626   6.318
  337    HA   ALA  46           HA       ALA  46   7.827  -6.806   6.922
  338    HB1  ALA  46           HB1      ALA  46   9.400  -9.218   7.944
  339    HB2  ALA  46           HB2      ALA  46   7.628  -9.057   7.960
  340    HB3  ALA  46           HB3      ALA  46   8.485  -9.128   6.410
  341    H    GLU  47           H        GLU  47  10.672  -7.150   9.023
  342    HA   GLU  47           HA       GLU  47   9.243  -6.703  11.487
  343    HB2  GLU  47           HB2      GLU  47  11.309  -7.988  11.237
  344    HB3  GLU  47           HB3      GLU  47  12.202  -6.516  10.791
  345    HG2  GLU  47           HG2      GLU  47  11.649  -5.558  13.043
  346    HG3  GLU  47           HG3      GLU  47  10.802  -7.056  13.433
  347    H    GLN  48           H        GLN  48  11.112  -4.546   9.270
  348    HA   GLN  48           HA       GLN  48  10.850  -2.226  10.980
  349    HB2  GLN  48           HB2      GLN  48  11.339  -2.525   7.987
  350    HB3  GLN  48           HB3      GLN  48  11.265  -0.955   8.804
  351    HG2  GLN  48           HG2      GLN  48  13.093  -1.594  10.311
  352    HG3  GLN  48           HG3      GLN  48  13.183  -3.189   9.559
  353   HE21  GLN  48          HE22      GLN  48  13.839  -3.297   7.256
  354   HE22  GLN  48          HE21      GLN  48  14.816  -2.016   6.552
  355    H    ALA  49           H        ALA  49   8.812  -3.610   8.331
  356    HA   ALA  49           HA       ALA  49   6.940  -1.434   8.338
  357    HB1  ALA  49           HB1      ALA  49   5.476  -3.008   7.178
  358    HB2  ALA  49           HB2      ALA  49   7.116  -3.015   6.497
  359    HB3  ALA  49           HB3      ALA  49   6.579  -4.350   7.576
  360    H    MET  50           H        MET  50   7.268  -4.470  10.259
  361    HA   MET  50           HA       MET  50   4.750  -4.296  11.552
  362    HB2  MET  50           HB2      MET  50   5.984  -6.330  11.639
  363    HB3  MET  50           HB3      MET  50   7.388  -5.583  12.387
  364    HG2  MET  50           HG2      MET  50   4.667  -5.635  13.663
  365    HG3  MET  50           HG3      MET  50   5.814  -6.947  13.842
  366    HE1  MET  50           HE1      MET  50   8.641  -5.556  15.995
  367    HE2  MET  50           HE2      MET  50   8.124  -6.777  14.815
  368    HE3  MET  50           HE3      MET  50   8.684  -5.180  14.266
  369    H    TYR  51           H        TYR  51   7.991  -3.000  12.686
  370    HA   TYR  51           HA       TYR  51   6.752  -1.718  14.922
  371    HB2  TYR  51           HB2      TYR  51   9.348  -1.100  13.472
  372    HB3  TYR  51           HB3      TYR  51   8.841  -0.346  14.991
  373    HD1  TYR  51           HD2      TYR  51   7.957  -2.210  16.826
  374    HD2  TYR  51           HD1      TYR  51  11.039  -2.675  13.835
  375    HE1  TYR  51           HE2      TYR  51   9.221  -3.685  18.350
  376    HE2  TYR  51           HE1      TYR  51  12.303  -4.133  15.356
  377    HH   TYR  51           HH       TYR  51  12.415  -5.095  17.511
  378    H    ARG  52           H        ARG  52   7.310  -0.592  11.585
  379    HA   ARG  52           HA       ARG  52   6.617   2.144  11.987
  380    HB2  ARG  52           HB2      ARG  52   7.870   1.252  10.111
  381    HB3  ARG  52           HB3      ARG  52   6.484   0.324   9.551
  382    HG2  ARG  52           HG2      ARG  52   6.064   3.280   9.826
  383    HG3  ARG  52           HG3      ARG  52   7.246   2.756   8.617
  384    HD2  ARG  52           HD2      ARG  52   5.518   1.192   7.657
  385    HD3  ARG  52           HD3      ARG  52   4.338   1.901   8.764
  386    HE   ARG  52           HE       ARG  52   5.866   3.275   6.601
  387   HH11  ARG  52          HH11      ARG  52   2.800   3.050   8.396
  388   HH12  ARG  52          HH12      ARG  52   2.344   4.703   8.132
  389   HH21  ARG  52          HH21      ARG  52   5.093   5.400   5.973
  390   HH22  ARG  52          HH22      ARG  52   3.556   5.960   6.533
  391    H    GLU  53           H        GLU  53   4.585  -0.723  11.141
  392    HA   GLU  53           HA       GLU  53   2.218   0.950  11.051
  393    HB2  GLU  53           HB2      GLU  53   2.563  -2.030  10.724
  394    HB3  GLU  53           HB3      GLU  53   1.025  -1.173  10.568
  395    HG2  GLU  53           HG2      GLU  53   3.475  -0.444   8.935
  396    HG3  GLU  53           HG3      GLU  53   2.277  -1.615   8.393
  397    H    LEU  54           H        LEU  54   3.795  -1.099  13.475
  398    HA   LEU  54           HA       LEU  54   1.721  -1.325  15.364
  399    HB2  LEU  54           HB2      LEU  54   3.922  -2.396  15.590
  400    HB3  LEU  54           HB3      LEU  54   4.695  -0.810  15.685
  401    HG   LEU  54           HG       LEU  54   3.231  -0.487  17.836
  402   HD11  LEU  54          HD11      LEU  54   1.934  -2.627  17.341
  403   HD12  LEU  54          HD12      LEU  54   3.414  -3.525  17.720
  404   HD13  LEU  54          HD13      LEU  54   2.635  -2.538  18.972
  405   HD21  LEU  54          HD21      LEU  54   5.687  -0.653  17.856
  406   HD22  LEU  54          HD22      LEU  54   4.995  -1.581  19.195
  407   HD23  LEU  54          HD23      LEU  54   5.582  -2.429  17.745
  408    H    PHE  55           H        PHE  55   3.885   1.498  14.634
  409    HA   PHE  55           HA       PHE  55   2.718   3.191  16.619
  410    HB2  PHE  55           HB2      PHE  55   4.843   3.681  15.455
  411    HB3  PHE  55           HB3      PHE  55   3.966   3.947  13.951
  412    HD1  PHE  55           HD1      PHE  55   4.214   5.140  17.511
  413    HD2  PHE  55           HD2      PHE  55   3.057   6.110  13.462
  414    HE1  PHE  55           HE1      PHE  55   3.798   7.490  18.188
  415    HE2  PHE  55           HE2      PHE  55   2.653   8.458  14.149
  416    HZ   PHE  55           HZ       PHE  55   3.024   9.157  16.503
  417    H    GLU  56           H        GLU  56   1.744   2.801  13.092
  418    HA   GLU  56           HA       GLU  56  -0.306   4.710  13.447
  419    HB2  GLU  56           HB2      GLU  56   0.031   2.563  11.321
  420    HB3  GLU  56           HB3      GLU  56  -1.292   3.738  11.358
  421    HG2  GLU  56           HG2      GLU  56   0.591   5.545  11.547
  422    HG3  GLU  56           HG3      GLU  56   1.671   4.262  10.999
  423    H    GLU  57           H        GLU  57  -0.339   1.195  14.037
  424    HA   GLU  57           HA       GLU  57  -3.253   1.098  14.162
  425    HB2  GLU  57           HB2      GLU  57  -1.042  -0.898  14.827
  426    HB3  GLU  57           HB3      GLU  57  -2.754  -1.266  14.928
  427    HG2  GLU  57           HG2      GLU  57  -1.302  -0.485  12.366
  428    HG3  GLU  57           HG3      GLU  57  -1.675  -2.123  12.884
  429    H    VAL  58           H        VAL  58  -0.554   0.908  16.500
  430    HA   VAL  58           HA       VAL  58  -2.483   0.639  18.746
  431    HB   VAL  58           HB       VAL  58   0.536   0.227  18.733
  432   HG11  VAL  58          HG11      VAL  58  -1.617  -1.107  20.383
  433   HG12  VAL  58          HG12      VAL  58   0.136  -1.299  20.552
  434   HG13  VAL  58          HG13      VAL  58  -0.599   0.268  20.925
  435   HG21  VAL  58          HG21      VAL  58  -1.599  -1.698  17.767
  436   HG22  VAL  58          HG22      VAL  58  -0.101  -1.167  16.947
  437   HG23  VAL  58          HG23      VAL  58  -0.018  -2.242  18.358
  438    H    GLY  59           H        GLY  59   0.095   2.643  17.453
  439    HA2  GLY  59           HA2      GLY  59   0.704   4.863  18.026
  440    HA3  GLY  59           HA3      GLY  59  -0.263   4.762  19.506
  441    H    LEU  60           H        LEU  60   1.466   1.913  19.230
  442    HA   LEU  60           HA       LEU  60   3.355   2.632  21.314
  443    HB2  LEU  60           HB2      LEU  60   1.748   0.735  21.292
  444    HB3  LEU  60           HB3      LEU  60   2.587   0.043  19.901
  445    HG   LEU  60           HG       LEU  60   4.561  -0.448  21.286
  446   HD11  LEU  60          HD11      LEU  60   4.261  -0.088  23.791
  447   HD12  LEU  60          HD12      LEU  60   4.696   1.333  22.836
  448   HD13  LEU  60          HD13      LEU  60   3.017   1.112  23.363
  449   HD21  LEU  60          HD21      LEU  60   1.823  -1.143  22.536
  450   HD22  LEU  60          HD22      LEU  60   2.574  -1.985  21.168
  451   HD23  LEU  60          HD23      LEU  60   3.336  -2.061  22.759
  452    H    SER  61           H        SER  61   5.626   2.063  21.137
  453    HA   SER  61           HA       SER  61   6.724   1.995  18.375
  454    HB2  SER  61           HB2      SER  61   8.407   3.681  19.247
  455    HB3  SER  61           HB3      SER  61   6.750   4.281  19.081
  456    HG   SER  61           HG       SER  61   7.635   4.902  21.091
  457    H    ARG  62           H        ARG  62   9.022   1.366  18.375
  458    HA   ARG  62           HA       ARG  62   9.640  -1.143  19.142
  459    HB2  ARG  62           HB2      ARG  62  11.415   1.306  18.730
  460    HB3  ARG  62           HB3      ARG  62  12.118  -0.255  19.171
  461    HG2  ARG  62           HG2      ARG  62  10.962  -1.327  17.299
  462    HG3  ARG  62           HG3      ARG  62  10.304   0.231  16.785
  463    HD2  ARG  62           HD2      ARG  62  12.178  -0.428  15.421
  464    HD3  ARG  62           HD3      ARG  62  12.633   1.000  16.395
  465    HE   ARG  62           HE       ARG  62  13.349  -1.532  17.640
  466   HH11  ARG  62          HH11      ARG  62  14.429   0.720  15.113
  467   HH12  ARG  62          HH12      ARG  62  16.093   0.275  15.219
  468   HH21  ARG  62          HH21      ARG  62  15.577  -2.122  17.799
  469   HH22  ARG  62          HH22      ARG  62  16.749  -1.386  16.770
  470    H    LYS  63           H        LYS  63  10.195   1.778  21.105
  471    HA   LYS  63           HA       LYS  63  11.982   0.603  22.951
  472    HB2  LYS  63           HB2      LYS  63  10.136   2.963  23.536
  473    HB3  LYS  63           HB3      LYS  63  11.746   2.647  24.212
  474    HG2  LYS  63           HG2      LYS  63  11.089   3.545  21.391
  475    HG3  LYS  63           HG3      LYS  63  11.850   4.500  22.655
  476    HD2  LYS  63           HD2      LYS  63  13.014   1.916  21.607
  477    HD3  LYS  63           HD3      LYS  63  13.369   3.488  20.865
  478    HE2  LYS  63           HE2      LYS  63  14.233   4.311  23.075
  479    HE3  LYS  63           HE3      LYS  63  13.977   2.703  23.763
  480    HZ1  LYS  63           HZ1      LYS  63  15.602   1.837  22.158
  481    HZ2  LYS  63           HZ2      LYS  63  15.835   3.337  21.532
  482    HZ3  LYS  63           HZ3      LYS  63  16.264   3.016  23.072
  483    H    ASP  64           H        ASP  64   8.487   0.535  22.902
  484    HA   ASP  64           HA       ASP  64   8.587  -0.601  25.665
  485    HB2  ASP  64           HB2      ASP  64   7.374   1.593  25.323
  486    HB3  ASP  64           HB3      ASP  64   6.114   0.645  24.561
  487    H    VAL  65           H        VAL  65   8.952  -1.959  22.981
  488    HA   VAL  65           HA       VAL  65   7.292  -4.286  23.780
  489    HB   VAL  65           HB       VAL  65   6.970  -4.826  21.358
  490   HG11  VAL  65          HG11      VAL  65   5.576  -2.314  22.341
  491   HG12  VAL  65          HG12      VAL  65   4.984  -3.419  21.079
  492   HG13  VAL  65          HG13      VAL  65   5.134  -3.977  22.758
  493   HG21  VAL  65          HG21      VAL  65   8.687  -3.196  20.470
  494   HG22  VAL  65          HG22      VAL  65   7.110  -3.087  19.661
  495   HG23  VAL  65          HG23      VAL  65   7.576  -1.887  20.870
  496    H    ARG  66           H        ARG  66   8.032  -6.335  22.877
  497    HA   ARG  66           HA       ARG  66  10.762  -6.369  21.759
  498    HB2  ARG  66           HB2      ARG  66  11.490  -8.204  23.121
  499    HB3  ARG  66           HB3      ARG  66  11.176  -6.776  24.086
  500    HG2  ARG  66           HG2      ARG  66   8.983  -8.876  23.935
  501    HG3  ARG  66           HG3      ARG  66  10.446  -9.269  24.811
  502    HD2  ARG  66           HD2      ARG  66   8.769  -6.793  25.385
  503    HD3  ARG  66           HD3      ARG  66   8.669  -8.302  26.285
  504    HE   ARG  66           HE       ARG  66  10.827  -6.296  26.341
  505   HH11  ARG  66          HH21      ARG  66   9.947  -9.610  27.382
  506   HH12  ARG  66          HH22      ARG  66  11.171  -9.667  28.593
  507   HH21  ARG  66          HH11      ARG  66  12.418  -6.411  27.978
  508   HH22  ARG  66          HH12      ARG  66  12.578  -7.825  28.946
  509    H    ILE  67           H        ILE  67  10.888  -7.934  20.063
  510    HA   ILE  67           HA       ILE  67   8.423  -9.278  19.303
  511    HB   ILE  67           HB       ILE  67  11.237  -9.520  18.161
  512   HG12  ILE  67          HG12      ILE  67   8.942  -7.860  17.036
  513   HG13  ILE  67          HG13      ILE  67  10.216  -7.168  18.030
  514   HG21  ILE  67          HG21      ILE  67   9.766 -11.444  17.597
  515   HG22  ILE  67          HG22      ILE  67   8.518 -10.333  16.998
  516   HG23  ILE  67          HG23      ILE  67  10.089 -10.483  16.171
  517   HD11  ILE  67          HD11      ILE  67  11.925  -7.968  16.396
  518   HD12  ILE  67          HD12      ILE  67  10.595  -8.483  15.324
  519   HD13  ILE  67          HD13      ILE  67  10.788  -6.776  15.751
  520    H    LEU  68           H        LEU  68   7.830 -11.075  20.241
  521    HA   LEU  68           HA       LEU  68   9.794 -12.842  21.630
  522    HB2  LEU  68           HB2      LEU  68   6.772 -12.886  21.470
  523    HB3  LEU  68           HB3      LEU  68   7.782 -13.934  22.459
  524    HG   LEU  68           HG       LEU  68   7.540 -10.904  22.870
  525   HD11  LEU  68          HD11      LEU  68   5.500 -11.713  23.475
  526   HD12  LEU  68          HD12      LEU  68   6.107 -13.333  23.926
  527   HD13  LEU  68          HD13      LEU  68   6.418 -11.962  24.985
  528   HD21  LEU  68          HD21      LEU  68   8.692 -11.380  25.003
  529   HD22  LEU  68          HD22      LEU  68   8.967 -13.060  24.485
  530   HD23  LEU  68          HD23      LEU  68   9.726 -11.709  23.613
  531    H    ALA  69           H        ALA  69   7.618 -12.681  18.775
  532    HA   ALA  69           HA       ALA  69   8.702 -15.126  17.637
  533    HB1  ALA  69           HB1      ALA  69   6.813 -15.822  19.330
  534    HB2  ALA  69           HB2      ALA  69   5.733 -15.176  18.080
  535    HB3  ALA  69           HB3      ALA  69   6.836 -16.493  17.689
  536    H    SER  70           H        SER  70   7.766 -15.478  15.535
  537    HA   SER  70           HA       SER  70   6.066 -13.592  14.330
  538    HB2  SER  70           HB2      SER  70   7.734 -12.725  12.604
  539    HB3  SER  70           HB3      SER  70   7.866 -12.064  14.244
  540    HG   SER  70           HG       SER  70   9.937 -12.662  13.353
  541    H    THR  71           H        THR  71   5.524 -14.228  12.022
  542    HA   THR  71           HA       THR  71   5.539 -17.099  12.078
  543    HB   THR  71           HB       THR  71   4.393 -16.810   9.774
  544    HG1  THR  71           HG1      THR  71   4.682 -14.820   9.130
  545   HG21  THR  71          HG21      THR  71   3.422 -16.692  12.402
  546   HG22  THR  71          HG22      THR  71   2.554 -15.421  11.503
  547   HG23  THR  71          HG23      THR  71   2.562 -17.097  10.916
  548    H    ARG  72           H        ARG  72   6.579 -18.587  11.036
  549    HA   ARG  72           HA       ARG  72   9.038 -17.858   9.581
  550    HB2  ARG  72           HB2      ARG  72   7.645 -20.563   9.814
  551    HB3  ARG  72           HB3      ARG  72   9.245 -20.274   9.154
  552    HG2  ARG  72           HG2      ARG  72  10.124 -20.551  11.173
  553    HG3  ARG  72           HG3      ARG  72   9.363 -19.056  11.699
  554    HD2  ARG  72           HD2      ARG  72   7.504 -21.357  11.772
  555    HD3  ARG  72           HD3      ARG  72   8.945 -21.640  12.735
  556    HE   ARG  72           HE       ARG  72   6.774 -19.732  13.192
  557   HH11  ARG  72          HH11      ARG  72  10.138 -20.507  14.118
  558   HH12  ARG  72          HH12      ARG  72   9.991 -19.858  15.709
  559   HH21  ARG  72          HH21      ARG  72   6.551 -18.978  15.233
  560   HH22  ARG  72          HH22      ARG  72   7.865 -18.965  16.403
  561    H    ASN  73           H        ASN  73   5.956 -19.353   8.754
  562    HA   ASN  73           HA       ASN  73   6.196 -19.078   5.899
  563    HB2  ASN  73           HB2      ASN  73   3.810 -19.811   5.907
  564    HB3  ASN  73           HB3      ASN  73   4.807 -20.857   6.895
  565   HD21  ASN  73          HD22      ASN  73   4.115 -21.186   9.064
  566   HD22  ASN  73          HD21      ASN  73   2.873 -20.231   9.825
  567    H    TRP  74           H        TRP  74   4.405 -17.950   4.677
  568    HA   TRP  74           HA       TRP  74   3.612 -15.309   5.840
  569    HB2  TRP  74           HB2      TRP  74   3.950 -16.214   2.933
  570    HB3  TRP  74           HB3      TRP  74   3.137 -14.740   3.424
  571    HD1  TRP  74           HD1      TRP  74   6.628 -16.265   3.147
  572    HE1  TRP  74           HE1      TRP  74   8.381 -14.399   3.203
  573    HE3  TRP  74           HE3      TRP  74   3.580 -12.301   4.252
  574    HZ2  TRP  74           HZ2      TRP  74   8.486 -11.607   3.814
  575    HZ3  TRP  74           HZ3      TRP  74   4.539 -10.050   4.626
  576    HH2  TRP  74           HH2      TRP  74   7.003  -9.733   4.589
  577    H    LEU  75           H        LEU  75   1.400 -15.367   6.348
  578    HA   LEU  75           HA       LEU  75  -0.246 -17.614   5.360
  579    HB2  LEU  75           HB2      LEU  75  -1.160 -15.148   6.914
  580    HB3  LEU  75           HB3      LEU  75  -2.085 -16.581   6.526
  581    HG   LEU  75           HG       LEU  75   0.208 -17.658   7.734
  582   HD11  LEU  75          HD11      LEU  75  -0.592 -15.161   9.215
  583   HD12  LEU  75          HD12      LEU  75   0.516 -16.431   9.818
  584   HD13  LEU  75          HD13      LEU  75   0.986 -15.472   8.409
  585   HD21  LEU  75          HD21      LEU  75  -1.228 -18.078   9.695
  586   HD22  LEU  75          HD22      LEU  75  -2.470 -17.019   9.044
  587   HD23  LEU  75          HD23      LEU  75  -2.028 -18.498   8.165
  588    H    ARG  76           H        ARG  76  -0.645 -17.509   3.175
  589    HA   ARG  76           HA       ARG  76  -0.942 -14.892   1.894
  590    HB2  ARG  76           HB2      ARG  76  -0.020 -16.998   0.755
  591    HB3  ARG  76           HB3      ARG  76  -1.705 -17.553   0.649
  592    HG2  ARG  76           HG2      ARG  76  -2.282 -15.441  -0.605
  593    HG3  ARG  76           HG3      ARG  76  -0.588 -14.924  -0.462
  594    HD2  ARG  76           HD2      ARG  76   0.060 -17.080  -1.616
  595    HD3  ARG  76           HD3      ARG  76  -1.670 -17.351  -1.939
  596    HE   ARG  76           HE       ARG  76  -1.149 -14.771  -2.869
  597   HH11  ARG  76          HH21      ARG  76   0.070 -18.019  -3.657
  598   HH12  ARG  76          HH22      ARG  76   0.601 -17.589  -5.244
  599   HH21  ARG  76          HH11      ARG  76  -0.462 -14.209  -5.004
  600   HH22  ARG  76          HH12      ARG  76   0.271 -15.388  -6.024
  601    H    TYR  77           H        TYR  77  -2.824 -13.962   1.316
  602    HA   TYR  77           HA       TYR  77  -5.300 -14.923   2.703
  603    HB2  TYR  77           HB2      TYR  77  -3.779 -12.941   3.579
  604    HB3  TYR  77           HB3      TYR  77  -4.452 -12.118   2.173
  605    HD1  TYR  77           HD1      TYR  77  -6.762 -11.310   2.124
  606    HD2  TYR  77           HD2      TYR  77  -5.018 -13.224   5.579
  607    HE1  TYR  77           HE1      TYR  77  -8.385 -10.154   3.575
  608    HE2  TYR  77           HE2      TYR  77  -6.655 -12.121   7.037
  609    HH   TYR  77           HH       TYR  77  -9.052  -9.721   5.775
  610    H    LYS  78           H        LYS  78  -7.116 -14.511   1.560
  611    HA   LYS  78           HA       LYS  78  -7.093 -13.217  -1.098
  612    HB2  LYS  78           HB2      LYS  78  -7.915 -16.084  -0.540
  613    HB3  LYS  78           HB3      LYS  78  -8.946 -15.117  -1.581
  614    HG2  LYS  78           HG2      LYS  78  -7.533 -16.297  -2.990
  615    HG3  LYS  78           HG3      LYS  78  -7.043 -14.605  -3.065
  616    HD2  LYS  78           HD2      LYS  78  -5.011 -14.983  -1.998
  617    HD3  LYS  78           HD3      LYS  78  -5.541 -16.469  -1.194
  618    HE2  LYS  78           HE2      LYS  78  -5.147 -16.201  -4.211
  619    HE3  LYS  78           HE3      LYS  78  -3.872 -16.727  -3.102
  620    HZ1  LYS  78           HZ1      LYS  78  -6.446 -18.159  -3.540
  621    HZ2  LYS  78           HZ2      LYS  78  -4.981 -18.625  -4.079
  622    HZ3  LYS  78           HZ3      LYS  78  -5.286 -18.625  -2.478
  623    H    LEU  79           H        LEU  79  -8.967 -12.030  -1.361
  624    HA   LEU  79           HA       LEU  79 -10.994 -12.130   0.818
  625    HB2  LEU  79           HB2      LEU  79 -11.330  -9.811   0.570
  626    HB3  LEU  79           HB3      LEU  79  -9.677 -10.233   0.986
  627    HG   LEU  79           HG       LEU  79  -8.910  -9.645  -1.257
  628   HD11  LEU  79          HD11      LEU  79 -11.871  -9.216  -1.727
  629   HD12  LEU  79          HD12      LEU  79 -10.654  -8.261  -2.632
  630   HD13  LEU  79          HD13      LEU  79 -10.669 -10.018  -2.756
  631   HD21  LEU  79          HD21      LEU  79  -9.009  -7.990   0.593
  632   HD22  LEU  79          HD22      LEU  79  -9.240  -7.220  -0.991
  633   HD23  LEU  79          HD23      LEU  79 -10.642  -7.514   0.062
  634    HA   PRO  80           HA       PRO  80 -13.887 -13.374  -2.260
  635    HB2  PRO  80           HB2      PRO  80 -16.258 -12.586  -1.158
  636    HB3  PRO  80           HB3      PRO  80 -15.238 -13.876  -0.431
  637    HG2  PRO  80           HG2      PRO  80 -15.435 -10.978   0.344
  638    HG3  PRO  80           HG3      PRO  80 -15.428 -12.415   1.413
  639    HD2  PRO  80           HD2      PRO  80 -13.188 -10.882   0.824
  640    HD3  PRO  80           HD3      PRO  80 -13.103 -12.625   1.249
  641    H    LYS  81           H        LYS  81 -15.403 -12.490  -3.957
  642    HA   LYS  81           HA       LYS  81 -14.207 -10.101  -4.847
  643    HB2  LYS  81           HB2      LYS  81 -16.582 -11.409  -6.135
  644    HB3  LYS  81           HB3      LYS  81 -15.421 -10.229  -6.829
  645    HG2  LYS  81           HG2      LYS  81 -13.573 -11.849  -6.470
  646    HG3  LYS  81           HG3      LYS  81 -14.748 -13.067  -5.964
  647    HD2  LYS  81           HD2      LYS  81 -14.750 -11.668  -8.674
  648    HD3  LYS  81           HD3      LYS  81 -14.022 -13.253  -8.343
  649    HE2  LYS  81           HE2      LYS  81 -16.261 -14.116  -7.639
  650    HE3  LYS  81           HE3      LYS  81 -16.986 -12.551  -8.035
  651    HZ1  LYS  81           HZ1      LYS  81 -16.310 -12.905 -10.354
  652    HZ2  LYS  81           HZ2      LYS  81 -15.652 -14.361  -9.981
  653    HZ3  LYS  81           HZ3      LYS  81 -17.259 -14.128  -9.838
  654    H    ARG  82           H        ARG  82 -17.092 -10.432  -2.964
  655    HA   ARG  82           HA       ARG  82 -18.233  -7.910  -3.559
  656    HB2  ARG  82           HB2      ARG  82 -19.298  -8.002  -1.387
  657    HB3  ARG  82           HB3      ARG  82 -19.398  -9.544  -2.244
  658    HG2  ARG  82           HG2      ARG  82 -17.409 -10.306  -0.793
  659    HG3  ARG  82           HG3      ARG  82 -17.670  -8.846   0.170
  660    HD2  ARG  82           HD2      ARG  82 -19.741 -11.002  -0.411
  661    HD3  ARG  82           HD3      ARG  82 -18.781 -10.908   1.076
  662    HE   ARG  82           HE       ARG  82 -20.008  -8.420   0.864
  663   HH11  ARG  82          HH11      ARG  82 -21.136 -11.782   1.175
  664   HH12  ARG  82          HH12      ARG  82 -22.626 -11.357   1.942
  665   HH21  ARG  82          HH21      ARG  82 -21.981  -7.859   1.902
  666   HH22  ARG  82          HH22      ARG  82 -23.111  -9.082   2.361
  667    H    LEU  83           H        LEU  83 -15.310  -8.659  -1.751
  668    HA   LEU  83           HA       LEU  83 -15.122  -5.913  -0.729
  669    HB2  LEU  83           HB2      LEU  83 -13.228  -8.229  -0.300
  670    HB3  LEU  83           HB3      LEU  83 -13.210  -6.690   0.546
  671    HG   LEU  83           HG       LEU  83 -15.310  -8.866   0.755
  672   HD11  LEU  83          HD11      LEU  83 -13.484  -7.783   2.921
  673   HD12  LEU  83          HD12      LEU  83 -14.522  -9.230   2.976
  674   HD13  LEU  83          HD13      LEU  83 -13.082  -9.203   1.952
  675   HD21  LEU  83          HD21      LEU  83 -16.499  -6.760   0.966
  676   HD22  LEU  83          HD22      LEU  83 -16.355  -7.524   2.551
  677   HD23  LEU  83          HD23      LEU  83 -15.292  -6.159   2.130
  678    H    VAL  84           H        VAL  84 -14.270  -7.460  -3.620
  679    HA   VAL  84           HA       VAL  84 -11.563  -6.466  -3.882
  680    HB   VAL  84           HB       VAL  84 -13.573  -7.511  -5.925
  681   HG11  VAL  84          HG11      VAL  84 -11.505  -7.739  -7.392
  682   HG12  VAL  84          HG12      VAL  84 -12.054  -6.076  -7.134
  683   HG13  VAL  84          HG13      VAL  84 -10.673  -6.701  -6.213
  684   HG21  VAL  84          HG21      VAL  84 -12.404  -9.542  -5.939
  685   HG22  VAL  84          HG22      VAL  84 -10.999  -8.877  -5.056
  686   HG23  VAL  84          HG23      VAL  84 -12.519  -9.155  -4.204
  687    H    ARG  85           H        ARG  85 -10.926  -4.445  -4.469
  688    HA   ARG  85           HA       ARG  85 -12.909  -2.515  -5.435
  689    HB2  ARG  85           HB2      ARG  85 -10.488  -2.415  -3.834
  690    HB3  ARG  85           HB3      ARG  85 -10.235  -1.412  -5.260
  691    HG2  ARG  85           HG2      ARG  85 -12.649  -1.261  -3.458
  692    HG3  ARG  85           HG3      ARG  85 -11.206  -0.215  -3.334
  693    HD2  ARG  85           HD2      ARG  85 -11.631   0.420  -5.782
  694    HD3  ARG  85           HD3      ARG  85 -13.227  -0.306  -5.637
  695    HE   ARG  85           HE       ARG  85 -12.188   2.175  -4.453
  696   HH11  ARG  85          HH22      ARG  85 -14.900  -0.152  -4.278
  697   HH12  ARG  85          HH21      ARG  85 -15.990   0.982  -3.572
  698   HH21  ARG  85          HH12      ARG  85 -13.646   3.649  -3.495
  699   HH22  ARG  85          HH11      ARG  85 -15.258   3.173  -3.098
  700    H    TRP  86           H        TRP  86 -13.378  -3.122  -7.442
  701    HA   TRP  86           HA       TRP  86 -11.413  -3.847  -9.408
  702    HB2  TRP  86           HB2      TRP  86 -14.339  -3.038  -9.555
  703    HB3  TRP  86           HB3      TRP  86 -13.416  -3.641 -10.934
  704    HD1  TRP  86           HD1      TRP  86 -15.496  -4.880  -8.118
  705    HE1  TRP  86           HE1      TRP  86 -15.350  -7.416  -7.868
  706    HE3  TRP  86           HE3      TRP  86 -11.553  -5.746 -11.248
  707    HZ2  TRP  86           HZ2      TRP  86 -13.578  -9.546  -8.751
  708    HZ3  TRP  86           HZ3      TRP  86 -10.647  -8.044 -11.529
  709    HH2  TRP  86           HH2      TRP  86 -11.645  -9.947 -10.277
  710    H    ASP  87           H        ASP  87 -12.600  -0.774  -8.217
  711    HA   ASP  87           HA       ASP  87 -12.375   0.705 -10.655
  712    HB2  ASP  87           HB2      ASP  87 -13.868   1.338  -8.822
  713    HB3  ASP  87           HB3      ASP  87 -12.488   1.602  -7.755
  714    H    THR  88           H        THR  88 -10.008  -0.154  -8.208
  715    HA   THR  88           HA       THR  88  -8.130   1.867  -9.237
  716    HB   THR  88           HB       THR  88  -8.745   1.843  -6.776
  717    HG1  THR  88           HG1      THR  88  -6.731   2.573  -6.321
  718   HG21  THR  88          HG21      THR  88  -7.615   0.315  -5.302
  719   HG22  THR  88          HG22      THR  88  -8.479  -0.678  -6.485
  720   HG23  THR  88          HG23      THR  88  -6.728  -0.430  -6.666
  721    H    LYS  89           H        LYS  89  -5.854   1.111  -9.432
  722    HA   LYS  89           HA       LYS  89  -5.688  -1.587 -10.584
  723    HB2  LYS  89           HB2      LYS  89  -4.857   0.953 -11.998
  724    HB3  LYS  89           HB3      LYS  89  -4.593  -0.714 -12.542
  725    HG2  LYS  89           HG2      LYS  89  -7.195  -0.979 -12.201
  726    HG3  LYS  89           HG3      LYS  89  -7.198   0.798 -12.190
  727    HD2  LYS  89           HD2      LYS  89  -6.132   0.764 -14.444
  728    HD3  LYS  89           HD3      LYS  89  -6.051  -1.016 -14.356
  729    HE2  LYS  89           HE2      LYS  89  -8.513  -1.150 -14.226
  730    HE3  LYS  89           HE3      LYS  89  -8.636   0.616 -14.277
  731    HZ1  LYS  89           HZ1      LYS  89  -9.026  -0.345 -16.457
  732    HZ2  LYS  89           HZ2      LYS  89  -7.665   0.554 -16.515
  733    HZ3  LYS  89           HZ3      LYS  89  -7.574  -1.081 -16.473
  734    HA   PRO  90           HA       PRO  90  -4.359  -3.129 -10.917
  735    HB2  PRO  90           HB2      PRO  90  -3.008  -5.030  -9.594
  736    HB3  PRO  90           HB3      PRO  90  -2.308  -4.078 -10.953
  737    HG2  PRO  90           HG2      PRO  90  -2.037  -3.520  -7.981
  738    HG3  PRO  90           HG3      PRO  90  -0.692  -3.696  -9.163
  739    HD2  PRO  90           HD2      PRO  90  -1.679  -1.269  -8.454
  740    HD3  PRO  90           HD3      PRO  90  -1.249  -1.601 -10.161
  741    H    VAL  91           H        VAL  91  -5.990  -4.506 -10.117
  742    HA   VAL  91           HA       VAL  91  -7.442  -3.705  -7.830
  743    HB   VAL  91           HB       VAL  91  -7.504  -6.128  -9.692
  744   HG11  VAL  91          HG11      VAL  91  -9.517  -5.318  -7.589
  745   HG12  VAL  91          HG12      VAL  91  -9.841  -6.488  -8.896
  746   HG13  VAL  91          HG13      VAL  91  -8.619  -6.841  -7.675
  747   HG21  VAL  91          HG21      VAL  91  -9.421  -4.932 -10.718
  748   HG22  VAL  91          HG22      VAL  91  -9.168  -3.585  -9.574
  749   HG23  VAL  91          HG23      VAL  91  -7.951  -3.964 -10.798
  750    H    CYS  92           H        CYS  92  -7.715  -4.566  -5.794
  751    HA   CYS  92           HA       CYS  92  -5.639  -6.375  -4.776
  752    HB2  CYS  92           HB2      CYS  92  -6.836  -5.978  -2.606
  753    HB3  CYS  92           HB3      CYS  92  -6.320  -4.491  -3.406
  754    HG   CYS  92           HG       CYS  92  -9.278  -5.867  -3.531
  755    H    ILE  93           H        ILE  93  -5.889  -8.602  -4.925
  756    HA   ILE  93           HA       ILE  93  -8.640  -9.610  -4.305
  757    HB   ILE  93           HB       ILE  93  -8.530 -11.401  -5.698
  758   HG12  ILE  93          HG12      ILE  93  -6.332 -12.284  -5.439
  759   HG13  ILE  93          HG13      ILE  93  -6.716 -12.110  -7.140
  760   HG21  ILE  93          HG21      ILE  93  -9.094  -9.286  -6.808
  761   HG22  ILE  93          HG22      ILE  93  -7.417  -9.110  -7.361
  762   HG23  ILE  93          HG23      ILE  93  -8.400 -10.471  -7.929
  763   HD11  ILE  93          HD11      ILE  93  -4.766 -10.504  -5.482
  764   HD12  ILE  93          HD12      ILE  93  -4.455 -11.480  -6.915
  765   HD13  ILE  93          HD13      ILE  93  -5.310  -9.941  -7.093
  766    H    GLY  94           H        GLY  94  -5.333  -9.521  -3.323
  767    HA2  GLY  94           HA2      GLY  94  -5.899 -11.013  -0.943
  768    HA3  GLY  94           HA3      GLY  94  -4.963 -11.970  -2.110
  769    H    GLN  95           H        GLN  95  -3.529 -11.713  -0.112
  770    HA   GLN  95           HA       GLN  95  -1.361  -9.865  -0.680
  771    HB2  GLN  95           HB2      GLN  95  -1.396  -8.811   1.600
  772    HB3  GLN  95           HB3      GLN  95  -2.784  -8.383   0.596
  773    HG2  GLN  95           HG2      GLN  95  -4.184 -10.037   1.805
  774    HG3  GLN  95           HG3      GLN  95  -2.822 -10.365   2.895
  775   HE21  GLN  95          HE22      GLN  95  -4.966  -7.797   1.610
  776   HE22  GLN  95          HE21      GLN  95  -4.974  -6.824   3.071
  777    H    LYS  96           H        LYS  96   0.521 -10.285   0.782
  778    HA   LYS  96           HA       LYS  96   0.478 -13.077   1.932
  779    HB2  LYS  96           HB2      LYS  96   2.773 -11.222   1.113
  780    HB3  LYS  96           HB3      LYS  96   2.981 -12.699   2.055
  781    HG2  LYS  96           HG2      LYS  96   2.091 -14.062   0.233
  782    HG3  LYS  96           HG3      LYS  96   1.795 -12.608  -0.737
  783    HD2  LYS  96           HD2      LYS  96   3.840 -13.744  -1.447
  784    HD3  LYS  96           HD3      LYS  96   4.190 -12.121  -0.841
  785    HE2  LYS  96           HE2      LYS  96   5.064 -13.044   1.288
  786    HE3  LYS  96           HE3      LYS  96   4.551 -14.669   0.824
  787    HZ1  LYS  96           HZ1      LYS  96   6.158 -14.592  -1.012
  788    HZ2  LYS  96           HZ2      LYS  96   6.629 -13.080  -0.593
  789    HZ3  LYS  96           HZ3      LYS  96   6.911 -14.340   0.413
  790    H    GLN  97           H        GLN  97   0.374 -13.111   4.231
  791    HA   GLN  97           HA       GLN  97   0.911 -10.514   5.610
  792    HB2  GLN  97           HB2      GLN  97  -0.769 -12.832   6.604
  793    HB3  GLN  97           HB3      GLN  97  -0.513 -11.250   7.354
  794    HG2  GLN  97           HG2      GLN  97  -1.542 -10.290   5.148
  795    HG3  GLN  97           HG3      GLN  97  -2.150 -11.932   4.909
  796   HE21  GLN  97          HE22      GLN  97  -3.310  -9.118   5.815
  797   HE22  GLN  97          HE21      GLN  97  -4.248  -9.477   7.236
  798    H    LYS  98           H        LYS  98   2.308 -10.465   7.323
  799    HA   LYS  98           HA       LYS  98   3.568 -13.021   8.249
  800    HB2  LYS  98           HB2      LYS  98   5.026 -11.838   6.650
  801    HB3  LYS  98           HB3      LYS  98   4.975 -10.370   7.651
  802    HG2  LYS  98           HG2      LYS  98   6.410 -11.253   9.198
  803    HG3  LYS  98           HG3      LYS  98   5.938 -12.939   8.918
  804    HD2  LYS  98           HD2      LYS  98   7.498 -11.310   6.896
  805    HD3  LYS  98           HD3      LYS  98   8.312 -12.159   8.198
  806    HE2  LYS  98           HE2      LYS  98   6.414 -13.665   6.340
  807    HE3  LYS  98           HE3      LYS  98   8.031 -13.246   5.810
  808    HZ1  LYS  98           HZ1      LYS  98   7.545 -14.854   8.273
  809    HZ2  LYS  98           HZ2      LYS  98   7.962 -15.465   6.810
  810    HZ3  LYS  98           HZ3      LYS  98   8.994 -14.486   7.606
  811    H    TRP  99           H        TRP  99   3.275 -13.177  10.472
  812    HA   TRP  99           HA       TRP  99   2.300 -10.680  11.796
  813    HB2  TRP  99           HB2      TRP  99   1.540 -13.552  12.297
  814    HB3  TRP  99           HB3      TRP  99   1.117 -12.194  13.338
  815    HD1  TRP  99           HD1      TRP  99   0.544 -13.323   9.691
  816    HE1  TRP  99           HE1      TRP  99  -1.741 -12.388   8.897
  817    HE3  TRP  99           HE3      TRP  99  -0.601 -10.419  13.733
  818    HZ2  TRP  99           HZ2      TRP  99  -3.609 -10.425   9.757
  819    HZ3  TRP  99           HZ3      TRP  99  -2.496  -8.841  13.625
  820    HH2  TRP  99           HH2      TRP  99  -4.043  -8.866  11.678
  821    H    PHE 100           H        PHE 100   2.949 -10.242  13.936
  822    HA   PHE 100           HA       PHE 100   5.421 -11.642  14.850
  823    HB2  PHE 100           HB2      PHE 100   4.807  -8.658  14.663
  824    HB3  PHE 100           HB3      PHE 100   6.169  -9.351  15.533
  825    HD1  PHE 100           HD1      PHE 100   4.700  -9.071  12.059
  826    HD2  PHE 100           HD2      PHE 100   8.247  -9.641  14.484
  827    HE1  PHE 100           HE1      PHE 100   6.118  -8.998  10.053
  828    HE2  PHE 100           HE2      PHE 100   9.639  -9.585  12.456
  829    HZ   PHE 100           HZ       PHE 100   8.593  -9.293  10.232
  830    H    LEU 101           H        LEU 101   5.191 -12.285  16.969
  831    HA   LEU 101           HA       LEU 101   2.987 -11.101  18.597
  832    HB2  LEU 101           HB2      LEU 101   2.828 -13.449  18.868
  833    HB3  LEU 101           HB3      LEU 101   4.588 -13.634  18.907
  834    HG   LEU 101           HG       LEU 101   4.671 -12.529  21.105
  835   HD11  LEU 101          HD11      LEU 101   2.887 -11.826  22.355
  836   HD12  LEU 101          HD12      LEU 101   2.466 -11.195  20.792
  837   HD13  LEU 101          HD13      LEU 101   1.670 -12.681  21.350
  838   HD21  LEU 101          HD21      LEU 101   3.790 -14.330  22.453
  839   HD22  LEU 101          HD22      LEU 101   2.773 -14.901  21.103
  840   HD23  LEU 101          HD23      LEU 101   4.549 -14.984  20.996
  841    H    LEU 102           H        LEU 102   3.611  -9.428  19.786
  842    HA   LEU 102           HA       LEU 102   6.418  -9.278  20.719
  843    HB2  LEU 102           HB2      LEU 102   4.359  -7.221  19.877
  844    HB3  LEU 102           HB3      LEU 102   5.591  -6.777  21.049
  845    HG   LEU 102           HG       LEU 102   7.314  -7.130  19.455
  846   HD11  LEU 102          HD11      LEU 102   5.157  -8.127  17.579
  847   HD12  LEU 102          HD12      LEU 102   6.747  -7.566  17.022
  848   HD13  LEU 102          HD13      LEU 102   6.643  -8.966  18.103
  849   HD21  LEU 102          HD21      LEU 102   5.125  -5.640  17.955
  850   HD22  LEU 102          HD22      LEU 102   5.803  -5.015  19.458
  851   HD23  LEU 102          HD23      LEU 102   6.870  -5.260  18.060
  852    H    GLN 103           H        GLN 103   6.618  -8.544  22.930
  853    HA   GLN 103           HA       GLN 103   4.047  -8.712  24.487
  854    HB2  GLN 103           HB2      GLN 103   5.123 -10.338  25.358
  855    HB3  GLN 103           HB3      GLN 103   6.751  -9.606  25.280
  856    HG2  GLN 103           HG2      GLN 103   6.274  -8.234  27.219
  857    HG3  GLN 103           HG3      GLN 103   4.529  -8.400  27.019
  858   HE21  GLN 103          HE22      GLN 103   3.456 -10.442  27.540
  859   HE22  GLN 103          HE21      GLN 103   4.207 -11.491  28.739
  860    H    LEU 104           H        LEU 104   3.386  -6.869  25.445
  861    HA   LEU 104           HA       LEU 104   4.654  -4.323  24.978
  862    HB2  LEU 104           HB2      LEU 104   2.119  -5.414  25.983
  863    HB3  LEU 104           HB3      LEU 104   2.702  -4.197  27.093
  864    HG   LEU 104           HG       LEU 104   2.535  -3.723  24.099
  865   HD11  LEU 104          HD11      LEU 104   0.417  -2.576  24.441
  866   HD12  LEU 104          HD12      LEU 104   0.273  -4.273  24.875
  867   HD13  LEU 104          HD13      LEU 104   0.404  -3.044  26.159
  868   HD21  LEU 104          HD21      LEU 104   3.988  -2.162  25.100
  869   HD22  LEU 104          HD22      LEU 104   2.447  -1.302  24.988
  870   HD23  LEU 104          HD23      LEU 104   2.989  -1.956  26.543
  871    H    VAL 105           H        VAL 105   5.854  -3.040  26.419
  872    HA   VAL 105           HA       VAL 105   7.224  -4.630  28.459
  873    HB   VAL 105           HB       VAL 105   7.805  -1.974  27.154
  874   HG11  VAL 105          HG11      VAL 105   9.552  -3.477  29.140
  875   HG12  VAL 105          HG12      VAL 105  10.070  -2.100  28.138
  876   HG13  VAL 105          HG13      VAL 105   8.821  -1.873  29.365
  877   HG21  VAL 105          HG21      VAL 105   8.086  -4.165  25.807
  878   HG22  VAL 105          HG22      VAL 105   9.478  -3.087  25.863
  879   HG23  VAL 105          HG23      VAL 105   9.412  -4.537  26.908
  880    H    SER 106           H        SER 106   5.478  -1.485  28.307
  881    HA   SER 106           HA       SER 106   5.522  -1.293  31.257
  882    HB2  SER 106           HB2      SER 106   4.261   0.443  29.111
  883    HB3  SER 106           HB3      SER 106   4.242   0.801  30.846
  884    HG   SER 106           HG       SER 106   6.435   0.721  29.055
  885    H    GLY 107           H        GLY 107   3.467  -2.622  28.814
  886    HA2  GLY 107           HA2      GLY 107   1.732  -4.213  29.421
  887    HA3  GLY 107           HA3      GLY 107   1.378  -3.244  30.855
  888    H    ASP 108           H        ASP 108  -0.824  -3.471  29.868
  889    HA   ASP 108           HA       ASP 108  -1.543  -2.471  27.416
  890    HB2  ASP 108           HB2      ASP 108  -3.697  -2.891  28.035
  891    HB3  ASP 108           HB3      ASP 108  -2.777  -3.982  29.070
  892    H    ALA 109           H        ALA 109  -0.882  -0.693  30.256
  893    HA   ALA 109           HA       ALA 109  -2.224   1.753  29.890
  894    HB1  ALA 109           HB1      ALA 109  -0.746   1.257  31.826
  895    HB2  ALA 109           HB2      ALA 109   0.672   1.272  30.748
  896    HB3  ALA 109           HB3      ALA 109  -0.251   2.759  31.018
  897    H    GLU 110           H        GLU 110   0.512   0.404  28.084
  898    HA   GLU 110           HA       GLU 110   0.890   2.900  26.627
  899    HB2  GLU 110           HB2      GLU 110   2.586   0.449  26.987
  900    HB3  GLU 110           HB3      GLU 110   2.888   1.547  25.634
  901    HG2  GLU 110           HG2      GLU 110   2.745   2.435  28.523
  902    HG3  GLU 110           HG3      GLU 110   4.240   2.065  27.661
  903    H    ILE 111           H        ILE 111  -1.544   2.101  26.042
  904    HA   ILE 111           HA       ILE 111  -1.224   1.417  23.182
  905    HB   ILE 111           HB       ILE 111  -3.582   0.406  24.839
  906   HG12  ILE 111          HG12      ILE 111  -1.462  -1.333  23.513
  907   HG13  ILE 111          HG13      ILE 111  -1.335  -0.881  25.208
  908   HG21  ILE 111          HG21      ILE 111  -4.199  -0.721  22.730
  909   HG22  ILE 111          HG22      ILE 111  -4.106   1.009  22.519
  910   HG23  ILE 111          HG23      ILE 111  -2.766  -0.006  21.944
  911   HD11  ILE 111          HD11      ILE 111  -3.329  -2.033  25.822
  912   HD12  ILE 111          HD12      ILE 111  -3.765  -2.349  24.150
  913   HD13  ILE 111          HD13      ILE 111  -2.342  -3.129  24.841
  914    H    ASN 112           H        ASN 112  -2.108   3.017  21.953
  915    HA   ASN 112           HA       ASN 112  -3.722   5.131  23.368
  916    HB2  ASN 112           HB2      ASN 112  -1.438   5.872  22.868
  917    HB3  ASN 112           HB3      ASN 112  -1.639   5.437  21.171
  918   HD21  ASN 112          HD22      ASN 112  -1.272   7.645  20.443
  919   HD22  ASN 112          HD21      ASN 112  -2.553   8.823  20.612
  920    H    MET 113           H        MET 113  -3.054   3.834  20.092
  921    HA   MET 113           HA       MET 113  -4.297   3.346  18.323
  922    HB2  MET 113           HB2      MET 113  -6.876   3.458  19.873
  923    HB3  MET 113           HB3      MET 113  -6.435   2.506  18.456
  924    HG2  MET 113           HG2      MET 113  -4.578   1.540  20.112
  925    HG3  MET 113           HG3      MET 113  -5.721   2.092  21.335
  926    HE1  MET 113           HE1      MET 113  -5.587  -1.806  19.275
  927    HE2  MET 113           HE2      MET 113  -4.767  -0.355  18.636
  928    HE3  MET 113           HE3      MET 113  -4.459  -0.891  20.312
  929    H    GLN 114           H        GLN 114  -4.002   6.323  19.277
  930    HA   GLN 114           HA       GLN 114  -5.464   7.452  17.062
  931    HB2  GLN 114           HB2      GLN 114  -6.481   9.237  18.374
  932    HB3  GLN 114           HB3      GLN 114  -7.242   7.649  18.526
  933    HG2  GLN 114           HG2      GLN 114  -6.214   7.290  20.722
  934    HG3  GLN 114           HG3      GLN 114  -5.435   8.871  20.644
  935   HE21  GLN 114          HE22      GLN 114  -6.879  10.835  20.535
  936   HE22  GLN 114          HE21      GLN 114  -8.454  10.749  21.286
  937    H    THR 115           H        THR 115  -3.372   7.433  16.519
  938    HA   THR 115           HA       THR 115  -1.375   9.252  17.591
  939    HB   THR 115           HB       THR 115  -0.445   8.620  15.206
  940    HG1  THR 115           HG1      THR 115  -1.337   6.739  14.374
  941   HG21  THR 115          HG21      THR 115   0.444   6.469  16.162
  942   HG22  THR 115          HG22      THR 115   0.427   7.711  17.414
  943   HG23  THR 115          HG23      THR 115  -0.859   6.479  17.385
  944    H    SER 116           H        SER 116  -3.141   8.925  14.572
  945    HA   SER 116           HA       SER 116  -3.220  11.706  13.822
  946    HB2  SER 116           HB2      SER 116  -5.086   9.435  13.022
  947    HB3  SER 116           HB3      SER 116  -4.839  10.960  12.151
  948    HG   SER 116           HG       SER 116  -3.601   9.234  11.250
  949    H    SER 117           H        SER 117  -5.362  12.949  13.590
  950    HA   SER 117           HA       SER 117  -6.611  13.401  16.072
  951    HB2  SER 117           HB2      SER 117  -8.289  14.584  14.429
  952    HB3  SER 117           HB3      SER 117  -6.618  15.165  14.558
  953    HG   SER 117           HG       SER 117  -7.316  14.951  12.367
  954    H    THR 118           H        THR 118  -7.515  11.368  13.278
  955    HA   THR 118           HA       THR 118  -9.923  10.381  14.533
  956    HB   THR 118           HB       THR 118  -9.309   8.720  12.463
  957    HG1  THR 118           HG1      THR 118  -8.836  10.078  10.724
  958   HG21  THR 118          HG21      THR 118 -11.464   9.459  13.138
  959   HG22  THR 118          HG22      THR 118 -11.120  11.129  12.598
  960   HG23  THR 118          HG23      THR 118 -11.238   9.793  11.410
  961    HA   PRO 119           HA       PRO 119  -7.696   7.004  16.500
  962    HB2  PRO 119           HB2      PRO 119 -10.485   5.913  16.784
  963    HB3  PRO 119           HB3      PRO 119  -9.214   6.071  18.037
  964    HG2  PRO 119           HG2      PRO 119 -11.350   7.778  17.950
  965    HG3  PRO 119           HG3      PRO 119  -9.709   8.383  18.346
  966    HD2  PRO 119           HD2      PRO 119 -11.168   8.506  15.691
  967    HD3  PRO 119           HD3      PRO 119 -10.195   9.766  16.517
  968    H    GLU 120           H        GLU 120  -7.021   5.080  15.558
  969    HA   GLU 120           HA       GLU 120  -8.311   4.212  13.040
  970    HB2  GLU 120           HB2      GLU 120  -5.844   3.252  14.534
  971    HB3  GLU 120           HB3      GLU 120  -6.528   2.366  13.169
  972    HG2  GLU 120           HG2      GLU 120  -5.539   5.244  13.088
  973    HG3  GLU 120           HG3      GLU 120  -4.716   3.833  12.420
  974    H    PHE 121           H        PHE 121  -8.471   3.358  16.455
  975    HA   PHE 121           HA       PHE 121 -10.323   1.152  15.709
  976    HB2  PHE 121           HB2      PHE 121  -8.364   1.185  18.007
  977    HB3  PHE 121           HB3      PHE 121  -9.671   0.027  17.807
  978    HD1  PHE 121           HD2      PHE 121  -9.674  -1.606  15.941
  979    HD2  PHE 121           HD1      PHE 121  -6.305   0.964  16.659
  980    HE1  PHE 121           HE2      PHE 121  -8.300  -3.030  14.463
  981    HE2  PHE 121           HE1      PHE 121  -4.914  -0.493  15.231
  982    HZ   PHE 121           HZ       PHE 121  -5.906  -2.481  14.112
  983    H    ASP 122           H        ASP 122 -12.211   1.046  16.759
  984    HA   ASP 122           HA       ASP 122 -13.064   3.462  18.280
  985    HB2  ASP 122           HB2      ASP 122 -14.425   2.971  16.389
  986    HB3  ASP 122           HB3      ASP 122 -14.526   1.258  16.795
  987    H    GLY 123           H        GLY 123 -12.139   0.137  18.780
  988    HA2  GLY 123           HA2      GLY 123 -12.743   0.323  21.636
  989    HA3  GLY 123           HA3      GLY 123 -13.629  -0.942  20.743
  990    H    TRP 124           H        TRP 124 -11.499  -1.252  22.820
  991    HA   TRP 124           HA       TRP 124 -10.107  -3.329  21.365
  992    HB2  TRP 124           HB2      TRP 124  -8.133  -2.367  21.150
  993    HB3  TRP 124           HB3      TRP 124  -8.711  -0.895  21.885
  994    HD1  TRP 124           HD1      TRP 124  -7.095  -4.241  22.927
  995    HE1  TRP 124           HE1      TRP 124  -5.833  -3.930  25.110
  996    HE3  TRP 124           HE3      TRP 124  -8.191   0.689  23.756
  997    HZ2  TRP 124           HZ2      TRP 124  -5.391  -1.763  27.053
  998    HZ3  TRP 124           HZ3      TRP 124  -7.301   1.861  25.753
  999    HH2  TRP 124           HH2      TRP 124  -5.911   0.635  27.411
 1000    H    ARG 125           H        ARG 125  -9.399  -5.016  22.733
 1001    HA   ARG 125           HA       ARG 125  -9.874  -4.847  25.607
 1002    HB2  ARG 125           HB2      ARG 125 -11.516  -6.626  25.734
 1003    HB3  ARG 125           HB3      ARG 125 -12.139  -5.352  24.698
 1004    HG2  ARG 125           HG2      ARG 125 -11.353  -6.739  22.697
 1005    HG3  ARG 125           HG3      ARG 125 -11.013  -8.048  23.805
 1006    HD2  ARG 125           HD2      ARG 125 -13.747  -6.719  23.560
 1007    HD3  ARG 125           HD3      ARG 125 -13.241  -8.116  22.601
 1008    HE   ARG 125           HE       ARG 125 -12.928  -8.472  25.490
 1009   HH11  ARG 125          HH11      ARG 125 -15.360  -8.657  22.901
 1010   HH12  ARG 125          HH12      ARG 125 -16.120 -10.087  23.527
 1011   HH21  ARG 125          HH21      ARG 125 -14.087 -10.242  26.431
 1012   HH22  ARG 125          HH22      ARG 125 -15.471 -10.893  25.637
 1013    H    TRP 126           H        TRP 126  -9.323  -7.121  26.564
 1014    HA   TRP 126           HA       TRP 126  -7.242  -8.465  24.917
 1015    HB2  TRP 126           HB2      TRP 126  -7.340  -8.058  27.916
 1016    HB3  TRP 126           HB3      TRP 126  -6.236  -9.150  27.095
 1017    HD1  TRP 126           HD1      TRP 126  -6.964  -5.339  27.288
 1018    HE1  TRP 126           HE1      TRP 126  -4.757  -4.110  27.171
 1019    HE3  TRP 126           HE3      TRP 126  -3.907  -9.268  26.055
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.013  -4.682  26.466
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.516  -8.850  25.567
 1022    HH2  TRP 126           HH2      TRP 126  -0.555  -6.565  25.800
 1023    H    VAL 127           H        VAL 127  -7.444 -10.696  24.738
 1024    HA   VAL 127           HA       VAL 127  -9.782 -12.061  25.986
 1025    HB   VAL 127           HB       VAL 127 -10.132 -12.903  23.505
 1026   HG11  VAL 127          HG11      VAL 127 -11.782 -11.023  23.133
 1027   HG12  VAL 127          HG12      VAL 127 -11.870 -11.783  24.736
 1028   HG13  VAL 127          HG13      VAL 127 -11.084 -10.207  24.541
 1029   HG21  VAL 127          HG21      VAL 127  -8.225 -11.697  22.489
 1030   HG22  VAL 127          HG22      VAL 127  -9.786 -11.287  21.752
 1031   HG23  VAL 127          HG23      VAL 127  -9.015 -10.147  22.869
 1032    H    SER 128           H        SER 128  -9.602 -14.404  25.929
 1033    HA   SER 128           HA       SER 128  -6.995 -15.562  25.882
 1034    HB2  SER 128           HB2      SER 128  -9.738 -16.814  25.446
 1035    HB3  SER 128           HB3      SER 128  -8.264 -17.674  25.963
 1036    HG   SER 128           HG       SER 128  -9.631 -17.123  27.763
 1037    H    TYR 129           H        TYR 129  -5.977 -16.829  24.209
 1038    HA   TYR 129           HA       TYR 129  -5.845 -15.677  21.778
 1039    HB2  TYR 129           HB2      TYR 129  -5.303 -18.571  21.517
 1040    HB3  TYR 129           HB3      TYR 129  -4.255 -17.203  21.277
 1041    HD1  TYR 129           HD2      TYR 129  -5.763 -19.443  23.857
 1042    HD2  TYR 129           HD1      TYR 129  -2.532 -16.721  22.917
 1043    HE1  TYR 129           HE2      TYR 129  -4.620 -20.104  25.942
 1044    HE2  TYR 129           HE1      TYR 129  -1.380 -17.415  24.995
 1045    HH   TYR 129           HH       TYR 129  -2.719 -19.797  27.308
 1046    H    TRP 130           H        TRP 130  -8.041 -18.434  22.472
 1047    HA   TRP 130           HA       TRP 130  -8.609 -18.756  19.636
 1048    HB2  TRP 130           HB2      TRP 130  -9.872 -20.183  21.993
 1049    HB3  TRP 130           HB3      TRP 130  -9.805 -20.721  20.313
 1050    HD1  TRP 130           HD1      TRP 130  -8.176 -21.397  23.456
 1051    HE1  TRP 130           HE1      TRP 130  -5.803 -22.322  23.221
 1052    HE3  TRP 130           HE3      TRP 130  -7.371 -20.357  18.485
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.764 -22.443  21.214
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.187 -20.896  17.449
 1055    HH2  TRP 130           HH2      TRP 130  -3.370 -21.903  18.807
 1056    H    TYR 131           H        TYR 131 -10.167 -17.047  22.271
 1057    HA   TYR 131           HA       TYR 131 -12.831 -17.044  21.315
 1058    HB2  TYR 131           HB2      TYR 131 -12.277 -16.433  23.536
 1059    HB3  TYR 131           HB3      TYR 131 -11.288 -15.077  23.009
 1060    HD1  TYR 131           HD1      TYR 131 -12.345 -13.025  22.053
 1061    HD2  TYR 131           HD2      TYR 131 -14.717 -16.250  23.671
 1062    HE1  TYR 131           HE1      TYR 131 -14.269 -11.497  22.274
 1063    HE2  TYR 131           HE2      TYR 131 -16.652 -14.724  23.885
 1064    HH   TYR 131           HH       TYR 131 -17.452 -12.536  23.586
 1065    HA   PRO 132           HA       PRO 132 -11.967 -12.954  18.936
 1066    HB2  PRO 132           HB2      PRO 132  -9.469 -12.524  17.831
 1067    HB3  PRO 132           HB3      PRO 132  -9.986 -11.933  19.445
 1068    HG2  PRO 132           HG2      PRO 132  -8.435 -14.451  18.827
 1069    HG3  PRO 132           HG3      PRO 132  -8.041 -13.164  20.020
 1070    HD2  PRO 132           HD2      PRO 132  -9.291 -15.371  20.781
 1071    HD3  PRO 132           HD3      PRO 132  -9.849 -13.807  21.425
 1072    H    VAL 133           H        VAL 133 -10.620 -16.077  18.126
 1073    HA   VAL 133           HA       VAL 133 -10.696 -15.840  15.245
 1074    HB   VAL 133           HB       VAL 133 -10.875 -18.370  16.914
 1075   HG11  VAL 133          HG11      VAL 133 -11.292 -18.629  14.479
 1076   HG12  VAL 133          HG12      VAL 133  -9.705 -17.900  14.141
 1077   HG13  VAL 133          HG13      VAL 133  -9.831 -19.446  15.014
 1078   HG21  VAL 133          HG21      VAL 133  -8.392 -18.519  16.742
 1079   HG22  VAL 133          HG22      VAL 133  -8.342 -16.886  16.044
 1080   HG23  VAL 133          HG23      VAL 133  -8.876 -17.137  17.714
 1081    H    ARG 134           H        ARG 134 -13.000 -16.688  17.861
 1082    HA   ARG 134           HA       ARG 134 -14.881 -18.074  16.235
 1083    HB2  ARG 134           HB2      ARG 134 -15.482 -16.448  18.737
 1084    HB3  ARG 134           HB3      ARG 134 -16.406 -17.815  18.097
 1085    HG2  ARG 134           HG2      ARG 134 -13.621 -17.998  19.287
 1086    HG3  ARG 134           HG3      ARG 134 -15.112 -18.305  20.164
 1087    HD2  ARG 134           HD2      ARG 134 -14.305 -19.796  17.659
 1088    HD3  ARG 134           HD3      ARG 134 -13.887 -20.327  19.309
 1089    HE   ARG 134           HE       ARG 134 -16.660 -19.899  19.282
 1090   HH11  ARG 134          HH11      ARG 134 -14.369 -22.149  17.746
 1091   HH12  ARG 134          HH12      ARG 134 -15.523 -23.422  17.571
 1092   HH21  ARG 134          HH21      ARG 134 -18.190 -21.592  19.048
 1093   HH22  ARG 134          HH22      ARG 134 -17.734 -23.102  18.347
 1094    H    GLN 135           H        GLN 135 -14.490 -14.577  16.894
 1095    HA   GLN 135           HA       GLN 135 -17.148 -14.001  15.840
 1096    HB2  GLN 135           HB2      GLN 135 -14.886 -12.330  16.954
 1097    HB3  GLN 135           HB3      GLN 135 -16.216 -11.558  16.113
 1098    HG2  GLN 135           HG2      GLN 135 -16.757 -11.542  18.452
 1099    HG3  GLN 135           HG3      GLN 135 -17.857 -12.628  17.620
 1100   HE21  GLN 135          HE22      GLN 135 -14.684 -12.734  19.426
 1101   HE22  GLN 135          HE21      GLN 135 -14.977 -14.296  20.127
 1102    H    VAL 136           H        VAL 136 -13.995 -14.270  14.289
 1103    HA   VAL 136           HA       VAL 136 -14.818 -12.504  12.101
 1104    HB   VAL 136           HB       VAL 136 -12.638 -13.078  11.159
 1105   HG11  VAL 136          HG11      VAL 136 -11.327 -11.758  12.735
 1106   HG12  VAL 136          HG12      VAL 136 -12.967 -11.101  12.628
 1107   HG13  VAL 136          HG13      VAL 136 -12.490 -12.080  14.031
 1108   HG21  VAL 136          HG21      VAL 136 -11.943 -14.450  13.768
 1109   HG22  VAL 136          HG22      VAL 136 -12.293 -15.323  12.256
 1110   HG23  VAL 136          HG23      VAL 136 -10.916 -14.219  12.340
 1111    H    VAL 137           H        VAL 137 -14.547 -13.417   9.809
 1112    HA   VAL 137           HA       VAL 137 -16.538 -15.558   9.585
 1113    HB   VAL 137           HB       VAL 137 -16.902 -14.781   7.398
 1114   HG11  VAL 137          HG11      VAL 137 -17.340 -12.447   7.568
 1115   HG12  VAL 137          HG12      VAL 137 -17.613 -13.164   9.166
 1116   HG13  VAL 137          HG13      VAL 137 -16.137 -12.216   8.851
 1117   HG21  VAL 137          HG21      VAL 137 -14.820 -14.782   6.381
 1118   HG22  VAL 137          HG22      VAL 137 -15.254 -13.066   6.335
 1119   HG23  VAL 137          HG23      VAL 137 -14.075 -13.684   7.544
 1120    H    SER 138           H        SER 138 -16.157 -17.011   7.470
 1121    HA   SER 138           HA       SER 138 -14.484 -19.013   8.239
 1122    HB2  SER 138           HB2      SER 138 -15.375 -18.403   5.399
 1123    HB3  SER 138           HB3      SER 138 -15.048 -20.006   6.103
 1124    HG   SER 138           HG       SER 138 -17.295 -19.538   6.097
 1125    H    PHE 139           H        PHE 139 -13.634 -16.647   5.574
 1126    HA   PHE 139           HA       PHE 139 -11.152 -18.027   5.111
 1127    HB2  PHE 139           HB2      PHE 139 -10.656 -16.408   3.479
 1128    HB3  PHE 139           HB3      PHE 139 -12.355 -16.808   3.350
 1129    HD1  PHE 139           HD1      PHE 139  -9.893 -14.167   4.102
 1130    HD2  PHE 139           HD2      PHE 139 -14.100 -15.102   3.839
 1131    HE1  PHE 139           HE1      PHE 139 -10.433 -11.755   4.088
 1132    HE2  PHE 139           HE2      PHE 139 -14.632 -12.685   3.879
 1133    HZ   PHE 139           HZ       PHE 139 -12.799 -10.999   4.009
 1134    H    LYS 140           H        LYS 140 -12.038 -15.323   7.196
 1135    HA   LYS 140           HA       LYS 140  -9.221 -14.634   7.752
 1136    HB2  LYS 140           HB2      LYS 140 -11.790 -13.673   9.080
 1137    HB3  LYS 140           HB3      LYS 140 -10.164 -13.034   9.378
 1138    HG2  LYS 140           HG2      LYS 140  -9.981 -12.577   6.882
 1139    HG3  LYS 140           HG3      LYS 140 -11.691 -12.971   6.736
 1140    HD2  LYS 140           HD2      LYS 140 -10.527 -10.700   8.393
 1141    HD3  LYS 140           HD3      LYS 140 -11.306 -10.560   6.808
 1142    HE2  LYS 140           HE2      LYS 140 -13.418 -11.489   7.752
 1143    HE3  LYS 140           HE3      LYS 140 -12.663 -11.563   9.352
 1144    HZ1  LYS 140           HZ1      LYS 140 -13.126  -9.065   7.773
 1145    HZ2  LYS 140           HZ2      LYS 140 -13.989  -9.516   9.078
 1146    HZ3  LYS 140           HZ3      LYS 140 -12.413  -9.108   9.249
 1147    H    ARG 141           H        ARG 141 -11.883 -16.299   9.426
 1148    HA   ARG 141           HA       ARG 141 -10.741 -17.090  11.832
 1149    HB2  ARG 141           HB2      ARG 141 -12.401 -18.691   9.838
 1150    HB3  ARG 141           HB3      ARG 141 -11.795 -19.457  11.307
 1151    HG2  ARG 141           HG2      ARG 141 -12.945 -17.909  12.710
 1152    HG3  ARG 141           HG3      ARG 141 -13.505 -16.969  11.320
 1153    HD2  ARG 141           HD2      ARG 141 -14.816 -18.909  10.531
 1154    HD3  ARG 141           HD3      ARG 141 -14.226 -19.863  11.915
 1155    HE   ARG 141           HE       ARG 141 -15.496 -17.344  12.652
 1156   HH11  ARG 141          HH11      ARG 141 -16.347 -20.640  11.620
 1157   HH12  ARG 141          HH12      ARG 141 -17.816 -20.695  12.527
 1158   HH21  ARG 141          HH21      ARG 141 -17.314 -17.515  14.052
 1159   HH22  ARG 141          HH22      ARG 141 -18.429 -18.829  13.867
 1160    H    ASP 142           H        ASP 142 -10.013 -18.697   8.668
 1161    HA   ASP 142           HA       ASP 142  -8.315 -20.629   9.847
 1162    HB2  ASP 142           HB2      ASP 142  -9.209 -20.858   7.572
 1163    HB3  ASP 142           HB3      ASP 142  -8.179 -19.516   7.028
 1164    H    VAL 143           H        VAL 143  -7.529 -17.404   8.499
 1165    HA   VAL 143           HA       VAL 143  -4.701 -17.711   8.981
 1166    HB   VAL 143           HB       VAL 143  -6.554 -15.362   8.416
 1167   HG11  VAL 143          HG11      VAL 143  -4.804 -14.350   9.808
 1168   HG12  VAL 143          HG12      VAL 143  -3.546 -15.135   8.829
 1169   HG13  VAL 143          HG13      VAL 143  -4.595 -13.895   8.120
 1170   HG21  VAL 143          HG21      VAL 143  -5.245 -15.377   6.271
 1171   HG22  VAL 143          HG22      VAL 143  -4.341 -16.782   6.875
 1172   HG23  VAL 143          HG23      VAL 143  -6.085 -16.906   6.575
 1173    H    TYR 144           H        TYR 144  -7.395 -16.287  10.875
 1174    HA   TYR 144           HA       TYR 144  -5.738 -15.208  12.921
 1175    HB2  TYR 144           HB2      TYR 144  -8.679 -15.921  12.730
 1176    HB3  TYR 144           HB3      TYR 144  -7.970 -15.420  14.254
 1177    HD1  TYR 144           HD1      TYR 144  -7.299 -14.045  10.760
 1178    HD2  TYR 144           HD2      TYR 144  -8.858 -13.309  14.726
 1179    HE1  TYR 144           HE1      TYR 144  -7.499 -11.669  10.234
 1180    HE2  TYR 144           HE2      TYR 144  -9.039 -10.907  14.198
 1181    HH   TYR 144           HH       TYR 144  -8.167  -9.564  10.977
 1182    H    ARG 145           H        ARG 145  -7.329 -18.467  12.643
 1183    HA   ARG 145           HA       ARG 145  -6.336 -19.279  15.204
 1184    HB2  ARG 145           HB2      ARG 145  -7.229 -21.360  14.815
 1185    HB3  ARG 145           HB3      ARG 145  -8.206 -20.339  13.768
 1186    HG2  ARG 145           HG2      ARG 145  -6.444 -21.036  11.938
 1187    HG3  ARG 145           HG3      ARG 145  -6.096 -22.383  13.028
 1188    HD2  ARG 145           HD2      ARG 145  -8.518 -22.991  12.888
 1189    HD3  ARG 145           HD3      ARG 145  -8.758 -21.562  11.860
 1190    HE   ARG 145           HE       ARG 145  -7.474 -22.541  10.090
 1191   HH11  ARG 145          HH11      ARG 145  -8.131 -24.948  12.652
 1192   HH12  ARG 145          HH12      ARG 145  -7.923 -26.284  11.579
 1193   HH21  ARG 145          HH21      ARG 145  -7.260 -24.164   8.765
 1194   HH22  ARG 145          HH22      ARG 145  -7.400 -25.843   9.253
 1195    H    ARG 146           H        ARG 146  -4.887 -19.650  11.845
 1196    HA   ARG 146           HA       ARG 146  -2.664 -21.148  12.771
 1197    HB2  ARG 146           HB2      ARG 146  -3.221 -19.425  10.309
 1198    HB3  ARG 146           HB3      ARG 146  -1.562 -19.908  10.708
 1199    HG2  ARG 146           HG2      ARG 146  -2.174 -21.550   9.265
 1200    HG3  ARG 146           HG3      ARG 146  -2.299 -22.280  10.859
 1201    HD2  ARG 146           HD2      ARG 146  -4.806 -21.904  10.712
 1202    HD3  ARG 146           HD3      ARG 146  -4.556 -21.384   9.040
 1203    HE   ARG 146           HE       ARG 146  -4.006 -24.086  10.217
 1204   HH11  ARG 146          HH11      ARG 146  -4.927 -22.317   7.271
 1205   HH12  ARG 146          HH12      ARG 146  -4.340 -23.533   6.196
 1206   HH21  ARG 146          HH21      ARG 146  -3.495 -25.807   8.793
 1207   HH22  ARG 146          HH22      ARG 146  -3.709 -25.629   7.092
 1208    H    VAL 147           H        VAL 147  -3.017 -17.576  12.405
 1209    HA   VAL 147           HA       VAL 147  -0.455 -16.845  13.199
 1210    HB   VAL 147           HB       VAL 147  -3.174 -15.497  13.420
 1211   HG11  VAL 147          HG11      VAL 147  -2.016 -13.328  13.742
 1212   HG12  VAL 147          HG12      VAL 147  -1.856 -14.384  15.144
 1213   HG13  VAL 147          HG13      VAL 147  -0.487 -14.196  14.026
 1214   HG21  VAL 147          HG21      VAL 147  -0.750 -14.959  11.649
 1215   HG22  VAL 147          HG22      VAL 147  -2.156 -15.909  11.144
 1216   HG23  VAL 147          HG23      VAL 147  -2.354 -14.196  11.521
 1217    H    MET 148           H        MET 148  -3.269 -17.706  15.211
 1218    HA   MET 148           HA       MET 148  -2.070 -16.854  17.701
 1219    HB2  MET 148           HB2      MET 148  -4.461 -18.640  17.123
 1220    HB3  MET 148           HB3      MET 148  -3.912 -18.220  18.755
 1221    HG2  MET 148           HG2      MET 148  -4.755 -16.163  16.684
 1222    HG3  MET 148           HG3      MET 148  -5.813 -16.869  17.889
 1223    HE1  MET 148           HE1      MET 148  -2.360 -14.594  17.653
 1224    HE2  MET 148           HE2      MET 148  -3.867 -14.093  16.849
 1225    HE3  MET 148           HE3      MET 148  -3.315 -13.231  18.291
 1226    H    LYS 149           H        LYS 149  -2.631 -20.095  16.181
 1227    HA   LYS 149           HA       LYS 149  -1.244 -21.611  18.137
 1228    HB2  LYS 149           HB2      LYS 149  -2.750 -22.598  16.698
 1229    HB3  LYS 149           HB3      LYS 149  -1.963 -22.018  15.235
 1230    HG2  LYS 149           HG2      LYS 149  -0.740 -24.102  17.091
 1231    HG3  LYS 149           HG3      LYS 149  -1.810 -24.475  15.739
 1232    HD2  LYS 149           HD2      LYS 149  -0.098 -23.041  14.318
 1233    HD3  LYS 149           HD3      LYS 149   1.020 -23.407  15.632
 1234    HE2  LYS 149           HE2      LYS 149  -0.534 -25.461  14.003
 1235    HE3  LYS 149           HE3      LYS 149   1.136 -24.987  13.701
 1236    HZ1  LYS 149           HZ1      LYS 149   1.719 -25.866  15.911
 1237    HZ2  LYS 149           HZ2      LYS 149   0.163 -26.341  16.172
 1238    HZ3  LYS 149           HZ3      LYS 149   1.041 -27.021  14.983
 1239    H    GLU 150           H        GLU 150   0.058 -19.869  15.316
 1240    HA   GLU 150           HA       GLU 150   2.564 -20.948  15.224
 1241    HB2  GLU 150           HB2      GLU 150   1.156 -18.746  14.134
 1242    HB3  GLU 150           HB3      GLU 150   2.555 -18.009  14.820
 1243    HG2  GLU 150           HG2      GLU 150   2.738 -20.457  13.023
 1244    HG3  GLU 150           HG3      GLU 150   2.627 -18.817  12.403
 1245    H    PHE 151           H        PHE 151   1.397 -18.292  17.258
 1246    HA   PHE 151           HA       PHE 151   4.011 -18.165  18.689
 1247    HB2  PHE 151           HB2      PHE 151   1.796 -16.163  18.918
 1248    HB3  PHE 151           HB3      PHE 151   3.527 -15.989  19.210
 1249    HD1  PHE 151           HD2      PHE 151   4.721 -17.081  16.581
 1250    HD2  PHE 151           HD1      PHE 151   1.301 -14.508  17.338
 1251    HE1  PHE 151           HE2      PHE 151   4.848 -16.221  14.352
 1252    HE2  PHE 151           HE1      PHE 151   1.562 -13.545  15.098
 1253    HZ   PHE 151           HZ       PHE 151   3.327 -14.430  13.561
 1254    H    ALA 152           H        ALA 152   0.927 -19.526  19.165
 1255    HA   ALA 152           HA       ALA 152   0.187 -18.966  21.756
 1256    HB1  ALA 152           HB1      ALA 152  -1.208 -20.312  20.226
 1257    HB2  ALA 152           HB2      ALA 152   0.010 -21.598  20.189
 1258    HB3  ALA 152           HB3      ALA 152  -0.885 -21.257  21.676
 1259    H    SER 153           H        SER 153   2.496 -21.421  20.642
 1260    HA   SER 153           HA       SER 153   2.965 -22.612  23.175
 1261    HB2  SER 153           HB2      SER 153   4.842 -22.510  20.783
 1262    HB3  SER 153           HB3      SER 153   4.791 -23.746  22.058
 1263    HG   SER 153           HG       SER 153   3.682 -24.441  20.160
 1264    H    VAL 154           H        VAL 154   4.365 -19.753  21.583
 1265    HA   VAL 154           HA       VAL 154   6.535 -19.457  23.496
 1266    HB   VAL 154           HB       VAL 154   5.254 -17.371  21.693
 1267   HG11  VAL 154          HG11      VAL 154   7.332 -16.107  22.040
 1268   HG12  VAL 154          HG12      VAL 154   6.510 -16.360  23.601
 1269   HG13  VAL 154          HG13      VAL 154   7.924 -17.344  23.168
 1270   HG21  VAL 154          HG21      VAL 154   7.326 -17.775  20.275
 1271   HG22  VAL 154          HG22      VAL 154   7.690 -19.171  21.297
 1272   HG23  VAL 154          HG23      VAL 154   6.211 -19.146  20.307
 1273    H    VAL 155           H        VAL 155   3.172 -18.142  23.179
 1274    HA   VAL 155           HA       VAL 155   3.395 -16.407  25.389
 1275    HB   VAL 155           HB       VAL 155   0.893 -17.974  24.716
 1276   HG11  VAL 155          HG11      VAL 155   1.577 -15.389  26.170
 1277   HG12  VAL 155          HG12      VAL 155  -0.062 -15.620  25.501
 1278   HG13  VAL 155          HG13      VAL 155   0.582 -16.747  26.714
 1279   HG21  VAL 155          HG21      VAL 155   1.821 -15.469  23.301
 1280   HG22  VAL 155          HG22      VAL 155   1.490 -17.067  22.593
 1281   HG23  VAL 155          HG23      VAL 155   0.159 -16.137  23.242
 1282    H    MET 156           H        MET 156   2.327 -19.884  25.310
 1283    HA   MET 156           HA       MET 156   1.605 -19.966  27.957
 1284    HB2  MET 156           HB2      MET 156   2.655 -22.071  26.036
 1285    HB3  MET 156           HB3      MET 156   2.055 -22.522  27.640
 1286    HG2  MET 156           HG2      MET 156  -0.143 -21.924  27.199
 1287    HG3  MET 156           HG3      MET 156   0.304 -20.643  26.099
 1288    HE1  MET 156           HE1      MET 156  -1.824 -22.099  23.531
 1289    HE2  MET 156           HE2      MET 156  -2.075 -21.564  25.201
 1290    HE3  MET 156           HE3      MET 156  -0.982 -20.646  24.142
 1291    H    SER 157           H        SER 157   4.810 -20.328  26.541
 1292    HA   SER 157           HA       SER 157   6.078 -21.053  29.035
 1293    HB2  SER 157           HB2      SER 157   6.597 -21.872  26.701
 1294    HB3  SER 157           HB3      SER 157   7.280 -20.268  26.350
 1295    HG   SER 157           HG       SER 157   8.864 -21.854  27.059
 1296    H    LEU 158           H        LEU 158   5.519 -18.116  27.136
 1297    HA   LEU 158           HA       LEU 158   7.319 -16.332  28.304
 1298    HB2  LEU 158           HB2      LEU 158   5.919 -15.936  26.260
 1299    HB3  LEU 158           HB3      LEU 158   4.472 -15.899  27.277
 1300    HG   LEU 158           HG       LEU 158   5.416 -13.900  28.480
 1301   HD11  LEU 158          HD11      LEU 158   7.770 -14.126  27.809
 1302   HD12  LEU 158          HD12      LEU 158   7.325 -13.975  26.095
 1303   HD13  LEU 158          HD13      LEU 158   7.110 -12.595  27.214
 1304   HD21  LEU 158          HD21      LEU 158   4.712 -12.472  26.425
 1305   HD22  LEU 158          HD22      LEU 158   4.557 -14.021  25.588
 1306   HD23  LEU 158          HD23      LEU 158   3.595 -13.713  27.058
 1307    H    GLN 159           H        GLN 159   4.060 -17.331  29.388
 1308    HA   GLN 159           HA       GLN 159   3.830 -15.576  31.601
 1309    HB2  GLN 159           HB2      GLN 159   2.828 -18.455  31.653
 1310    HB3  GLN 159           HB3      GLN 159   2.145 -17.055  32.483
 1311    HG2  GLN 159           HG2      GLN 159   1.448 -16.140  30.224
 1312    HG3  GLN 159           HG3      GLN 159   2.072 -17.614  29.509
 1313   HE21  GLN 159          HE22      GLN 159  -0.174 -16.779  32.218
 1314   HE22  GLN 159          HE21      GLN 159  -1.305 -18.081  31.855
 1315    H    GLU 160           H        GLU 160   5.740 -18.491  31.293
 1316    HA   GLU 160           HA       GLU 160   6.317 -18.651  34.147
 1317    HB2  GLU 160           HB2      GLU 160   7.237 -20.425  31.851
 1318    HB3  GLU 160           HB3      GLU 160   7.432 -20.759  33.577
 1319    HG2  GLU 160           HG2      GLU 160   4.907 -20.700  33.797
 1320    HG3  GLU 160           HG3      GLU 160   4.815 -20.629  32.034
 1321    H    ASN 161           H        ASN 161   7.500 -16.981  31.541
 1322    HA   ASN 161           HA       ASN 161  10.366 -17.082  32.409
 1323    HB2  ASN 161           HB2      ASN 161   9.095 -16.738  29.686
 1324    HB3  ASN 161           HB3      ASN 161  10.672 -16.029  30.029
 1325   HD21  ASN 161          HD22      ASN 161   8.914 -19.164  29.977
 1326   HD22  ASN 161          HD21      ASN 161  10.358 -20.142  29.804
 1327    H    THR 162           H        THR 162   7.556 -14.912  31.926
 1328    HA   THR 162           HA       THR 162   9.227 -12.755  33.045
 1329    HB   THR 162           HB       THR 162   7.787 -11.297  31.765
 1330    HG1  THR 162           HG1      THR 162   6.783 -13.648  30.517
 1331   HG21  THR 162          HG21      THR 162   9.097 -13.331  29.925
 1332   HG22  THR 162          HG22      THR 162   8.690 -11.653  29.525
 1333   HG23  THR 162          HG23      THR 162   9.941 -11.995  30.744
 1334    HA   PRO 163           HA       PRO 163   5.372 -13.470  35.770
 1335    HB2  PRO 163           HB2      PRO 163   6.274 -14.943  37.848
 1336    HB3  PRO 163           HB3      PRO 163   5.771 -15.708  36.315
 1337    HG2  PRO 163           HG2      PRO 163   8.594 -14.930  37.147
 1338    HG3  PRO 163           HG3      PRO 163   8.025 -16.543  36.588
 1339    HD2  PRO 163           HD2      PRO 163   9.127 -14.739  34.849
 1340    HD3  PRO 163           HD3      PRO 163   7.724 -15.762  34.370
 1341    H    LYS 164           H        LYS 164   5.549 -12.992  38.369
 1342    HA   LYS 164           HA       LYS 164   7.429 -10.852  38.934
 1343    HB2  LYS 164           HB2      LYS 164   5.366  -9.338  39.438
 1344    HB3  LYS 164           HB3      LYS 164   6.019  -9.445  37.815
 1345    HG2  LYS 164           HG2      LYS 164   3.595  -9.459  37.733
 1346    HG3  LYS 164           HG3      LYS 164   4.245 -10.977  37.112
 1347    HD2  LYS 164           HD2      LYS 164   3.809 -12.007  39.380
 1348    HD3  LYS 164           HD3      LYS 164   3.004 -10.494  39.851
 1349    HE2  LYS 164           HE2      LYS 164   1.438 -10.795  37.908
 1350    HE3  LYS 164           HE3      LYS 164   2.263 -12.312  37.499
 1351    HZ1  LYS 164           HZ1      LYS 164   0.774 -11.783  40.026
 1352    HZ2  LYS 164           HZ2      LYS 164   0.247 -12.715  38.797
 1353    HZ3  LYS 164           HZ3      LYS 164   1.537 -13.190  39.673
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1  -0.848   2.074  -0.600
    2    H2   MET   1           H2       MET   1  -1.889   1.280  -1.579
    3    H3   MET   1           H3       MET   1  -1.309   0.533  -0.241
    4    HA   MET   1           HA       MET   1   0.272   1.340  -2.601
    5    HB2  MET   1           HB2      MET   1   1.394   1.377  -0.215
    6    HB3  MET   1           HB3      MET   1   1.357  -0.367  -0.303
    7    HG2  MET   1           HG2      MET   1   2.679   1.495  -2.335
    8    HG3  MET   1           HG3      MET   1   3.510   0.719  -1.000
    9    HE1  MET   1           HE1      MET   1   4.246  -2.807  -2.097
   10    HE2  MET   1           HE2      MET   1   5.020  -1.364  -1.395
   11    HE3  MET   1           HE3      MET   1   3.502  -1.978  -0.702
   12    H    ILE   2           H        ILE   2   0.509  -0.240  -4.216
   13    HA   ILE   2           HA       ILE   2  -0.111  -3.076  -3.674
   14    HB   ILE   2           HB       ILE   2  -1.209  -1.539  -6.047
   15   HG12  ILE   2          HG12      ILE   2  -2.367  -2.303  -3.495
   16   HG13  ILE   2          HG13      ILE   2  -3.007  -1.246  -4.751
   17   HG21  ILE   2          HG21      ILE   2  -1.275  -4.521  -5.450
   18   HG22  ILE   2          HG22      ILE   2  -2.048  -3.713  -6.839
   19   HG23  ILE   2          HG23      ILE   2  -0.290  -3.747  -6.711
   20   HD11  ILE   2          HD11      ILE   2  -3.328  -4.232  -4.387
   21   HD12  ILE   2          HD12      ILE   2  -4.559  -2.966  -4.173
   22   HD13  ILE   2          HD13      ILE   2  -4.017  -3.335  -5.808
   23    H    ASP   3           H        ASP   3   1.697  -4.189  -4.455
   24    HA   ASP   3           HA       ASP   3   3.989  -2.715  -4.990
   25    HB2  ASP   3           HB2      ASP   3   3.994  -4.933  -3.946
   26    HB3  ASP   3           HB3      ASP   3   3.499  -5.650  -5.491
   27    H    ASP   4           H        ASP   4   2.516  -5.059  -7.259
   28    HA   ASP   4           HA       ASP   4   2.801  -3.287  -9.493
   29    HB2  ASP   4           HB2      ASP   4   5.149  -4.001  -9.335
   30    HB3  ASP   4           HB3      ASP   4   4.639  -5.687  -9.286
   31    H    ASP   5           H        ASP   5   2.626  -6.740  -8.662
   32    HA   ASP   5           HA       ASP   5   1.042  -7.291 -11.015
   33    HB2  ASP   5           HB2      ASP   5   3.051  -8.611 -10.374
   34    HB3  ASP   5           HB3      ASP   5   2.155  -9.244  -8.995
   35    H    GLY   6           H        GLY   6  -0.100  -5.935  -8.560
   36    HA2  GLY   6           HA2      GLY   6  -2.322  -5.768  -7.877
   37    HA3  GLY   6           HA3      GLY   6  -2.674  -7.364  -8.549
   38    H    TYR   7           H        TYR   7   0.109  -7.390  -6.537
   39    HA   TYR   7           HA       TYR   7  -1.460  -8.298  -4.177
   40    HB2  TYR   7           HB2      TYR   7   1.409  -8.955  -4.955
   41    HB3  TYR   7           HB3      TYR   7   0.608  -9.470  -3.476
   42    HD1  TYR   7           HD2      TYR   7  -1.245 -11.132  -3.529
   43    HD2  TYR   7           HD1      TYR   7   0.972 -10.079  -7.072
   44    HE1  TYR   7           HE2      TYR   7  -2.202 -13.095  -4.710
   45    HE2  TYR   7           HE1      TYR   7   0.069 -12.059  -8.238
   46    HH   TYR   7           HH       TYR   7  -1.382 -13.895  -8.120
   47    H    ARG   8           H        ARG   8  -0.672  -7.507  -2.071
   48    HA   ARG   8           HA       ARG   8   1.321  -5.333  -2.243
   49    HB2  ARG   8           HB2      ARG   8   0.104  -3.787  -0.901
   50    HB3  ARG   8           HB3      ARG   8  -0.909  -4.245  -2.279
   51    HG2  ARG   8           HG2      ARG   8  -1.514  -5.947   0.004
   52    HG3  ARG   8           HG3      ARG   8  -1.630  -4.263   0.463
   53    HD2  ARG   8           HD2      ARG   8  -2.818  -5.129  -2.170
   54    HD3  ARG   8           HD3      ARG   8  -3.667  -5.551  -0.655
   55    HE   ARG   8           HE       ARG   8  -2.781  -2.731  -1.199
   56   HH11  ARG   8          HH11      ARG   8  -5.507  -4.959  -0.568
   57   HH12  ARG   8          HH12      ARG   8  -6.672  -3.691  -0.445
   58   HH21  ARG   8          HH21      ARG   8  -4.384  -1.072  -1.083
   59   HH22  ARG   8          HH22      ARG   8  -6.023  -1.460  -0.739
   60    HA   PRO   9           HA       PRO   9   2.672  -7.619   1.344
   61    HB2  PRO   9           HB2      PRO   9   4.852  -6.194   2.092
   62    HB3  PRO   9           HB3      PRO   9   4.765  -7.060   0.546
   63    HG2  PRO   9           HG2      PRO   9   4.337  -4.096   1.023
   64    HG3  PRO   9           HG3      PRO   9   5.281  -4.895  -0.261
   65    HD2  PRO   9           HD2      PRO   9   2.651  -3.993  -0.482
   66    HD3  PRO   9           HD3      PRO   9   3.393  -5.253  -1.511
   67    H    ASN  10           H        ASN  10   2.228  -7.685   3.573
   68    HA   ASN  10           HA       ASN  10   1.309  -5.223   4.975
   69    HB2  ASN  10           HB2      ASN  10  -0.678  -6.097   3.903
   70    HB3  ASN  10           HB3      ASN  10  -0.238  -7.746   4.310
   71   HD21  ASN  10          HD22      ASN  10  -2.001  -4.937   5.401
   72   HD22  ASN  10          HD21      ASN  10  -2.489  -5.630   6.927
   73    H    VAL  11           H        VAL  11   1.161  -5.533   7.313
   74    HA   VAL  11           HA       VAL  11   2.264  -8.033   8.285
   75    HB   VAL  11           HB       VAL  11   3.800  -7.022   9.873
   76   HG11  VAL  11          HG11      VAL  11   4.603  -7.584   7.582
   77   HG12  VAL  11          HG12      VAL  11   4.550  -5.832   7.300
   78   HG13  VAL  11          HG13      VAL  11   5.570  -6.475   8.579
   79   HG21  VAL  11          HG21      VAL  11   2.773  -4.862  10.332
   80   HG22  VAL  11          HG22      VAL  11   4.420  -4.637   9.726
   81   HG23  VAL  11          HG23      VAL  11   3.039  -4.334   8.649
   82    H    GLY  12           H        GLY  12   1.654  -8.524  10.458
   83    HA2  GLY  12           HA2      GLY  12  -0.389  -6.725  11.668
   84    HA3  GLY  12           HA3      GLY  12  -0.643  -8.462  11.595
   85    H    ILE  13           H        ILE  13  -0.533  -6.969  14.032
   86    HA   ILE  13           HA       ILE  13   1.911  -8.085  15.267
   87    HB   ILE  13           HB       ILE  13   0.417  -5.581  16.184
   88   HG12  ILE  13          HG12      ILE  13   2.897  -4.651  15.527
   89   HG13  ILE  13          HG13      ILE  13   2.693  -5.868  14.263
   90   HG21  ILE  13          HG21      ILE  13   2.534  -5.402  17.604
   91   HG22  ILE  13          HG22      ILE  13   1.464  -6.734  17.988
   92   HG23  ILE  13          HG23      ILE  13   2.951  -7.027  17.039
   93   HD11  ILE  13          HD11      ILE  13   0.601  -4.737  13.528
   94   HD12  ILE  13          HD12      ILE  13   0.780  -3.559  14.855
   95   HD13  ILE  13          HD13      ILE  13   1.971  -3.620  13.540
   96    H    VAL  14           H        VAL  14   1.556  -9.171  17.169
   97    HA   VAL  14           HA       VAL  14  -1.229  -9.384  18.206
   98    HB   VAL  14           HB       VAL  14   0.884 -11.594  18.043
   99   HG11  VAL  14          HG11      VAL  14  -2.010 -11.650  19.011
  100   HG12  VAL  14          HG12      VAL  14  -0.898 -13.048  18.910
  101   HG13  VAL  14          HG13      VAL  14  -0.570 -11.737  20.041
  102   HG21  VAL  14          HG21      VAL  14  -0.728 -12.708  16.479
  103   HG22  VAL  14          HG22      VAL  14  -1.667 -11.194  16.417
  104   HG23  VAL  14          HG23      VAL  14   0.001 -11.248  15.802
  105    H    ILE  15           H        ILE  15  -1.226  -8.966  20.466
  106    HA   ILE  15           HA       ILE  15   1.445  -8.814  21.736
  107    HB   ILE  15           HB       ILE  15  -0.948  -7.196  22.613
  108   HG12  ILE  15          HG12      ILE  15  -0.217  -6.233  20.494
  109   HG13  ILE  15          HG13      ILE  15   0.129  -5.167  21.850
  110   HG21  ILE  15          HG21      ILE  15   0.570  -6.078  24.080
  111   HG22  ILE  15          HG22      ILE  15   0.625  -7.813  24.405
  112   HG23  ILE  15          HG23      ILE  15   1.948  -7.051  23.510
  113   HD11  ILE  15          HD11      ILE  15   2.159  -7.007  20.559
  114   HD12  ILE  15          HD12      ILE  15   1.985  -5.278  20.182
  115   HD13  ILE  15          HD13      ILE  15   2.503  -5.781  21.806
  116    H    CYS  16           H        CYS  16   1.695 -10.164  23.511
  117    HA   CYS  16           HA       CYS  16  -0.801 -11.444  24.523
  118    HB2  CYS  16           HB2      CYS  16   1.821 -12.954  24.283
  119    HB3  CYS  16           HB3      CYS  16   0.230 -13.579  24.738
  120    HG   CYS  16           HG       CYS  16   0.712 -14.470  22.333
  121    H    ASN  17           H        ASN  17  -0.869 -11.895  26.720
  122    HA   ASN  17           HA       ASN  17   1.140 -10.449  28.386
  123    HB2  ASN  17           HB2      ASN  17  -0.557  -9.970  29.968
  124    HB3  ASN  17           HB3      ASN  17  -1.183  -9.516  28.402
  125   HD21  ASN  17          HD22      ASN  17  -3.193  -9.593  29.968
  126   HD22  ASN  17          HD21      ASN  17  -4.056 -11.117  30.020
  127    H    ARG  18           H        ARG  18   1.108 -11.590  30.764
  128    HA   ARG  18           HA       ARG  18   2.037 -14.300  30.145
  129    HB2  ARG  18           HB2      ARG  18   2.144 -12.732  32.762
  130    HB3  ARG  18           HB3      ARG  18   2.818 -14.339  32.518
  131    HG2  ARG  18           HG2      ARG  18   4.714 -13.315  31.903
  132    HG3  ARG  18           HG3      ARG  18   3.896 -13.093  30.362
  133    HD2  ARG  18           HD2      ARG  18   4.400 -10.886  30.693
  134    HD3  ARG  18           HD3      ARG  18   2.959 -10.896  31.674
  135    HE   ARG  18           HE       ARG  18   4.256 -11.056  33.657
  136   HH11  ARG  18          HH11      ARG  18   6.331 -10.507  30.754
  137   HH12  ARG  18          HH12      ARG  18   7.725 -10.154  31.744
  138   HH21  ARG  18          HH21      ARG  18   6.143 -10.423  34.847
  139   HH22  ARG  18          HH22      ARG  18   7.630 -10.125  33.991
  140    H    GLN  19           H        GLN  19  -0.982 -13.355  30.457
  141    HA   GLN  19           HA       GLN  19  -1.877 -15.521  32.235
  142    HB2  GLN  19           HB2      GLN  19  -3.670 -13.491  30.907
  143    HB3  GLN  19           HB3      GLN  19  -4.010 -14.478  32.317
  144    HG2  GLN  19           HG2      GLN  19  -2.129 -12.100  32.127
  145    HG3  GLN  19           HG3      GLN  19  -3.702 -12.127  32.896
  146   HE21  GLN  19          HE22      GLN  19  -1.383 -11.264  34.308
  147   HE22  GLN  19          HE21      GLN  19  -1.033 -12.425  35.567
  148    H    GLY  20           H        GLY  20  -1.053 -15.095  28.982
  149    HA2  GLY  20           HA2      GLY  20  -1.451 -16.509  27.193
  150    HA3  GLY  20           HA3      GLY  20  -2.628 -17.415  28.148
  151    H    GLN  21           H        GLN  21  -2.916 -13.860  27.961
  152    HA   GLN  21           HA       GLN  21  -5.257 -14.208  26.147
  153    HB2  GLN  21           HB2      GLN  21  -4.587 -11.800  27.855
  154    HB3  GLN  21           HB3      GLN  21  -6.041 -12.069  26.906
  155    HG2  GLN  21           HG2      GLN  21  -6.733 -13.895  28.397
  156    HG3  GLN  21           HG3      GLN  21  -5.231 -13.734  29.319
  157   HE21  GLN  21          HE22      GLN  21  -8.462 -12.351  28.881
  158   HE22  GLN  21          HE21      GLN  21  -8.283 -11.141  30.125
  159    H    VAL  22           H        VAL  22  -5.354 -12.849  24.333
  160    HA   VAL  22           HA       VAL  22  -2.866 -11.460  23.578
  161    HB   VAL  22           HB       VAL  22  -3.209 -12.031  21.308
  162   HG11  VAL  22          HG11      VAL  22  -3.813 -14.619  22.800
  163   HG12  VAL  22          HG12      VAL  22  -2.821 -14.382  21.334
  164   HG13  VAL  22          HG13      VAL  22  -2.256 -13.792  22.917
  165   HG21  VAL  22          HG21      VAL  22  -5.873 -13.342  22.060
  166   HG22  VAL  22          HG22      VAL  22  -5.649 -11.882  21.065
  167   HG23  VAL  22          HG23      VAL  22  -5.068 -13.436  20.478
  168    H    MET  23           H        MET  23  -3.163  -9.408  22.485
  169    HA   MET  23           HA       MET  23  -5.577  -7.935  23.238
  170    HB2  MET  23           HB2      MET  23  -3.162  -7.285  21.505
  171    HB3  MET  23           HB3      MET  23  -4.578  -6.235  21.571
  172    HG2  MET  23           HG2      MET  23  -4.348  -6.077  24.045
  173    HG3  MET  23           HG3      MET  23  -2.880  -7.049  23.942
  174    HE1  MET  23           HE1      MET  23  -3.429  -2.746  22.334
  175    HE2  MET  23           HE2      MET  23  -3.840  -4.084  21.246
  176    HE3  MET  23           HE3      MET  23  -4.715  -3.870  22.780
  177    H    TRP  24           H        TRP  24  -7.270  -7.284  21.931
  178    HA   TRP  24           HA       TRP  24  -7.272  -7.896  19.050
  179    HB2  TRP  24           HB2      TRP  24  -8.112  -9.878  20.379
  180    HB3  TRP  24           HB3      TRP  24  -9.370  -8.850  21.036
  181    HD1  TRP  24           HD1      TRP  24  -8.264  -9.440  17.342
  182    HE1  TRP  24           HE1      TRP  24 -10.248 -10.422  16.058
  183    HE3  TRP  24           HE3      TRP  24 -11.641  -9.618  21.149
  184    HZ2  TRP  24           HZ2      TRP  24 -12.897 -11.381  16.672
  185    HZ3  TRP  24           HZ3      TRP  24 -13.897 -10.593  20.792
  186    HH2  TRP  24           HH2      TRP  24 -14.525 -11.482  18.581
  187    H    ALA  25           H        ALA  25  -8.667  -6.233  17.988
  188    HA   ALA  25           HA       ALA  25  -9.825  -4.228  19.861
  189    HB1  ALA  25           HB1      ALA  25  -7.448  -3.638  19.432
  190    HB2  ALA  25           HB2      ALA  25  -7.787  -3.587  17.705
  191    HB3  ALA  25           HB3      ALA  25  -8.564  -2.430  18.829
  192    H    ARG  26           H        ARG  26 -11.402  -2.863  19.067
  193    HA   ARG  26           HA       ARG  26 -12.981  -3.997  16.831
  194    HB2  ARG  26           HB2      ARG  26 -13.940  -3.890  19.118
  195    HB3  ARG  26           HB3      ARG  26 -13.794  -2.136  19.114
  196    HG2  ARG  26           HG2      ARG  26 -15.403  -1.921  17.325
  197    HG3  ARG  26           HG3      ARG  26 -15.341  -3.658  16.985
  198    HD2  ARG  26           HD2      ARG  26 -17.397  -3.288  18.112
  199    HD3  ARG  26           HD3      ARG  26 -16.318  -4.118  19.228
  200    HE   ARG  26           HE       ARG  26 -16.443  -1.159  19.442
  201   HH11  ARG  26          HH11      ARG  26 -17.840  -4.212  20.701
  202   HH12  ARG  26          HH12      ARG  26 -18.374  -3.476  22.164
  203   HH21  ARG  26          HH21      ARG  26 -17.248  -0.239  21.201
  204   HH22  ARG  26          HH22      ARG  26 -18.036  -1.130  22.494
  205    H    ARG  27           H        ARG  27 -12.642  -2.825  14.805
  206    HA   ARG  27           HA       ARG  27 -11.140  -0.341  15.129
  207    HB2  ARG  27           HB2      ARG  27 -10.537  -2.035  13.466
  208    HB3  ARG  27           HB3      ARG  27 -11.999  -1.666  12.562
  209    HG2  ARG  27           HG2      ARG  27 -11.211   0.717  12.328
  210    HG3  ARG  27           HG3      ARG  27  -9.757   0.291  13.245
  211    HD2  ARG  27           HD2      ARG  27 -10.545  -0.828  10.531
  212    HD3  ARG  27           HD3      ARG  27  -9.312   0.395  10.831
  213    HE   ARG  27           HE       ARG  27  -9.070  -2.483  11.164
  214   HH11  ARG  27          HH21      ARG  27  -7.617   0.647  12.181
  215   HH12  ARG  27          HH22      ARG  27  -6.108  -0.119  12.618
  216   HH21  ARG  27          HH11      ARG  27  -7.118  -3.386  11.808
  217   HH22  ARG  27          HH12      ARG  27  -5.832  -2.358  12.468
  218    H    PHE  28           H        PHE  28 -11.712   1.728  14.594
  219    HA   PHE  28           HA       PHE  28 -14.323   2.416  15.451
  220    HB2  PHE  28           HB2      PHE  28 -12.297   3.782  15.809
  221    HB3  PHE  28           HB3      PHE  28 -12.144   4.038  14.076
  222    HD1  PHE  28           HD2      PHE  28 -14.731   4.498  16.813
  223    HD2  PHE  28           HD1      PHE  28 -12.828   6.129  13.297
  224    HE1  PHE  28           HE2      PHE  28 -16.046   6.579  17.061
  225    HE2  PHE  28           HE1      PHE  28 -14.111   8.232  13.583
  226    HZ   PHE  28           HZ       PHE  28 -15.736   8.454  15.452
  227    H    GLY  29           H        GLY  29 -16.147   2.986  14.365
  228    HA2  GLY  29           HA2      GLY  29 -17.583   3.418  12.628
  229    HA3  GLY  29           HA3      GLY  29 -16.237   3.391  11.484
  230    H    GLN  30           H        GLN  30 -15.408   0.574  12.531
  231    HA   GLN  30           HA       GLN  30 -17.157  -0.894  10.699
  232    HB2  GLN  30           HB2      GLN  30 -15.127  -2.198  12.538
  233    HB3  GLN  30           HB3      GLN  30 -15.725  -2.748  10.983
  234    HG2  GLN  30           HG2      GLN  30 -13.781  -0.508  11.567
  235    HG3  GLN  30           HG3      GLN  30 -13.436  -2.106  10.921
  236   HE21  GLN  30          HE22      GLN  30 -14.423  -2.648   8.692
  237   HE22  GLN  30          HE21      GLN  30 -14.632  -1.339   7.554
  238    H    HIS  31           H        HIS  31 -16.425  -0.836  14.173
  239    HA   HIS  31           HA       HIS  31 -17.242  -1.938  15.967
  240    HB2  HIS  31           HB2      HIS  31 -19.921  -2.134  14.578
  241    HB3  HIS  31           HB3      HIS  31 -19.581  -2.173  16.304
  242    HD1  HIS  31           HD1      HIS  31 -20.302   0.280  13.540
  243    HD2  HIS  31           HD2      HIS  31 -18.525   0.250  17.363
  244    HE1  HIS  31           HE1      HIS  31 -20.128   2.712  14.272
  245    H    SER  32           H        SER  32 -15.868  -3.333  13.790
  246    HA   SER  32           HA       SER  32 -16.665  -6.117  14.491
  247    HB2  SER  32           HB2      SER  32 -15.405  -5.180  11.881
  248    HB3  SER  32           HB3      SER  32 -15.889  -6.833  12.300
  249    HG   SER  32           HG       SER  32 -17.481  -5.821  11.009
  250    H    TRP  33           H        TRP  33 -14.753  -7.572  14.695
  251    HA   TRP  33           HA       TRP  33 -12.585  -6.008  15.970
  252    HB2  TRP  33           HB2      TRP  33 -13.543  -8.845  16.332
  253    HB3  TRP  33           HB3      TRP  33 -12.199  -8.067  17.188
  254    HD1  TRP  33           HD1      TRP  33 -16.047  -7.734  16.895
  255    HE1  TRP  33           HE1      TRP  33 -16.933  -6.622  18.999
  256    HE3  TRP  33           HE3      TRP  33 -11.586  -6.830  19.204
  257    HZ2  TRP  33           HZ2      TRP  33 -15.814  -5.555  21.506
  258    HZ3  TRP  33           HZ3      TRP  33 -11.515  -5.728  21.409
  259    HH2  TRP  33           HH2      TRP  33 -13.619  -5.061  22.563
  260    H    GLN  34           H        GLN  34 -10.419  -6.424  15.707
  261    HA   GLN  34           HA       GLN  34  -9.495  -8.312  13.633
  262    HB2  GLN  34           HB2      GLN  34  -9.059  -5.280  13.597
  263    HB3  GLN  34           HB3      GLN  34  -8.139  -6.426  12.621
  264    HG2  GLN  34           HG2      GLN  34 -10.236  -7.121  11.470
  265    HG3  GLN  34           HG3      GLN  34 -11.110  -5.865  12.360
  266   HE21  GLN  34          HE22      GLN  34 -11.314  -5.592   9.677
  267   HE22  GLN  34          HE21      GLN  34 -10.255  -4.339   9.081
  268    H    PHE  35           H        PHE  35  -7.107  -8.401  13.617
  269    HA   PHE  35           HA       PHE  35  -5.841  -7.810  16.247
  270    HB2  PHE  35           HB2      PHE  35  -4.916  -9.283  13.754
  271    HB3  PHE  35           HB3      PHE  35  -3.856  -8.966  15.127
  272    HD1  PHE  35           HD2      PHE  35  -5.645  -9.622  17.456
  273    HD2  PHE  35           HD1      PHE  35  -4.987 -11.664  13.687
  274    HE1  PHE  35           HE2      PHE  35  -6.311 -11.755  18.492
  275    HE2  PHE  35           HE1      PHE  35  -5.570 -13.796  14.780
  276    HZ   PHE  35           HZ       PHE  35  -6.294 -13.853  17.157
  277    HA   PRO  36           HA       PRO  36  -4.435  -3.955  14.577
  278    HB2  PRO  36           HB2      PRO  36  -1.928  -3.621  15.808
  279    HB3  PRO  36           HB3      PRO  36  -3.524  -3.273  16.560
  280    HG2  PRO  36           HG2      PRO  36  -1.810  -5.741  16.812
  281    HG3  PRO  36           HG3      PRO  36  -2.699  -4.874  18.094
  282    HD2  PRO  36           HD2      PRO  36  -3.666  -7.146  16.956
  283    HD3  PRO  36           HD3      PRO  36  -4.767  -5.806  17.409
  284    H    GLN  37           H        GLN  37  -3.432  -3.380  12.599
  285    HA   GLN  37           HA       GLN  37  -1.100  -4.795  11.609
  286    HB2  GLN  37           HB2      GLN  37  -2.221  -6.001   9.779
  287    HB3  GLN  37           HB3      GLN  37  -2.831  -6.545  11.327
  288    HG2  GLN  37           HG2      GLN  37  -4.815  -4.928  10.944
  289    HG3  GLN  37           HG3      GLN  37  -4.213  -4.762   9.288
  290   HE21  GLN  37          HE22      GLN  37  -5.469  -7.048  11.719
  291   HE22  GLN  37          HE21      GLN  37  -5.945  -8.304  10.575
  292    H    GLY  38           H        GLY  38  -0.626  -4.228   9.254
  293    HA2  GLY  38           HA2      GLY  38  -1.981  -1.976   8.072
  294    HA3  GLY  38           HA3      GLY  38  -0.472  -1.502   8.858
  295    H    GLY  39           H        GLY  39  -0.712  -1.183   6.083
  296    HA2  GLY  39           HA2      GLY  39   0.397  -3.421   4.636
  297    HA3  GLY  39           HA3      GLY  39   0.142  -1.775   4.066
  298    H    ILE  40           H        ILE  40   2.474  -3.414   3.820
  299    HA   ILE  40           HA       ILE  40   4.616  -2.047   5.370
  300    HB   ILE  40           HB       ILE  40   4.629  -4.094   3.124
  301   HG12  ILE  40          HG12      ILE  40   5.767  -4.386   5.903
  302   HG13  ILE  40          HG13      ILE  40   4.079  -4.750   5.553
  303   HG21  ILE  40          HG21      ILE  40   7.089  -4.212   3.353
  304   HG22  ILE  40          HG22      ILE  40   6.597  -2.597   2.839
  305   HG23  ILE  40          HG23      ILE  40   7.052  -2.893   4.533
  306   HD11  ILE  40          HD11      ILE  40   6.303  -6.127   4.008
  307   HD12  ILE  40          HD12      ILE  40   5.756  -6.705   5.575
  308   HD13  ILE  40          HD13      ILE  40   4.601  -6.598   4.241
  309    H    ASN  41           H        ASN  41   4.970   0.019   4.810
  310    HA   ASN  41           HA       ASN  41   3.827   1.158   2.381
  311    HB2  ASN  41           HB2      ASN  41   5.643   2.395   4.489
  312    HB3  ASN  41           HB3      ASN  41   4.817   3.281   3.229
  313   HD21  ASN  41          HD22      ASN  41   4.341   1.378   6.171
  314   HD22  ASN  41          HD21      ASN  41   2.687   1.877   6.501
  315    HA   PRO  42           HA       PRO  42   6.970   0.184  -0.306
  316    HB2  PRO  42           HB2      PRO  42   7.598   2.368  -1.880
  317    HB3  PRO  42           HB3      PRO  42   6.076   1.431  -1.990
  318    HG2  PRO  42           HG2      PRO  42   6.565   4.030  -0.531
  319    HG3  PRO  42           HG3      PRO  42   5.175   3.586  -1.567
  320    HD2  PRO  42           HD2      PRO  42   5.099   3.481   1.157
  321    HD3  PRO  42           HD3      PRO  42   4.189   2.318   0.164
  322    H    GLY  43           H        GLY  43   9.029  -0.341   0.211
  323    HA2  GLY  43           HA2      GLY  43  11.313   0.004   0.530
  324    HA3  GLY  43           HA3      GLY  43  11.026   1.688   0.973
  325    H    GLU  44           H        GLU  44   8.759   0.067   2.849
  326    HA   GLU  44           HA       GLU  44  10.464  -0.010   5.206
  327    HB2  GLU  44           HB2      GLU  44   7.553  -0.424   4.621
  328    HB3  GLU  44           HB3      GLU  44   8.193  -1.275   6.003
  329    HG2  GLU  44           HG2      GLU  44   8.749   0.601   7.182
  330    HG3  GLU  44           HG3      GLU  44   8.767   1.655   5.750
  331    H    SER  45           H        SER  45  10.837  -1.930   6.472
  332    HA   SER  45           HA       SER  45  10.865  -4.501   4.974
  333    HB2  SER  45           HB2      SER  45  12.303  -5.249   6.860
  334    HB3  SER  45           HB3      SER  45  13.022  -3.906   5.957
  335    HG   SER  45           HG       SER  45  13.012  -3.767   8.356
  336    H    ALA  46           H        ALA  46  10.037  -6.365   6.471
  337    HA   ALA  46           HA       ALA  46   7.405  -5.756   7.286
  338    HB1  ALA  46           HB1      ALA  46   7.397  -8.051   8.189
  339    HB2  ALA  46           HB2      ALA  46   8.216  -8.006   6.618
  340    HB3  ALA  46           HB3      ALA  46   9.184  -8.092   8.119
  341    H    GLU  47           H        GLU  47  10.393  -6.026   9.213
  342    HA   GLU  47           HA       GLU  47   9.111  -5.777  11.748
  343    HB2  GLU  47           HB2      GLU  47  11.319  -6.792  11.225
  344    HB3  GLU  47           HB3      GLU  47  11.983  -5.174  10.923
  345    HG2  GLU  47           HG2      GLU  47  11.397  -4.547  13.279
  346    HG3  GLU  47           HG3      GLU  47  10.789  -6.183  13.540
  347    H    GLN  48           H        GLN  48  10.542  -3.352   9.482
  348    HA   GLN  48           HA       GLN  48  10.132  -1.128  11.304
  349    HB2  GLN  48           HB2      GLN  48  10.474  -1.272   8.280
  350    HB3  GLN  48           HB3      GLN  48  10.261   0.247   9.162
  351    HG2  GLN  48           HG2      GLN  48  12.249  -0.216  10.537
  352    HG3  GLN  48           HG3      GLN  48  12.484  -1.756   9.709
  353   HE21  GLN  48          HE22      GLN  48  13.003  -1.699   7.368
  354   HE22  GLN  48          HE21      GLN  48  13.758  -0.271   6.664
  355    H    ALA  49           H        ALA  49   8.105  -2.707   8.784
  356    HA   ALA  49           HA       ALA  49   5.992  -0.766   8.890
  357    HB1  ALA  49           HB1      ALA  49   6.287  -2.408   7.077
  358    HB2  ALA  49           HB2      ALA  49   5.886  -3.741   8.210
  359    HB3  ALA  49           HB3      ALA  49   4.668  -2.517   7.817
  360    H    MET  50           H        MET  50   6.750  -3.760  10.736
  361    HA   MET  50           HA       MET  50   4.332  -3.891  12.171
  362    HB2  MET  50           HB2      MET  50   5.750  -5.775  12.122
  363    HB3  MET  50           HB3      MET  50   7.154  -4.891  12.692
  364    HG2  MET  50           HG2      MET  50   4.700  -5.369  14.373
  365    HG3  MET  50           HG3      MET  50   6.052  -6.482  14.302
  366    HE1  MET  50           HE1      MET  50   8.338  -6.152  15.064
  367    HE2  MET  50           HE2      MET  50   8.709  -4.533  14.417
  368    HE3  MET  50           HE3      MET  50   8.894  -4.857  16.148
  369    H    TYR  51           H        TYR  51   7.455  -2.297  13.179
  370    HA   TYR  51           HA       TYR  51   6.265  -1.220  15.532
  371    HB2  TYR  51           HB2      TYR  51   8.647  -0.290  13.879
  372    HB3  TYR  51           HB3      TYR  51   8.204   0.392  15.440
  373    HD1  TYR  51           HD2      TYR  51   7.744  -1.562  17.334
  374    HD2  TYR  51           HD1      TYR  51  10.463  -1.774  13.982
  375    HE1  TYR  51           HE2      TYR  51   9.293  -2.926  18.681
  376    HE2  TYR  51           HE1      TYR  51  11.998  -3.166  15.315
  377    HH   TYR  51           HH       TYR  51  11.394  -4.006  18.768
  378    H    ARG  52           H        ARG  52   6.636   0.217  12.247
  379    HA   ARG  52           HA       ARG  52   5.774   2.825  13.029
  380    HB2  ARG  52           HB2      ARG  52   7.136   2.403  11.080
  381    HB3  ARG  52           HB3      ARG  52   5.877   1.444  10.315
  382    HG2  ARG  52           HG2      ARG  52   5.187   4.282  11.097
  383    HG3  ARG  52           HG3      ARG  52   6.339   4.035   9.791
  384    HD2  ARG  52           HD2      ARG  52   4.251   2.259   9.151
  385    HD3  ARG  52           HD3      ARG  52   3.414   3.671   9.791
  386    HE   ARG  52           HE       ARG  52   5.396   3.544   7.563
  387   HH11  ARG  52          HH11      ARG  52   2.453   5.143   8.884
  388   HH12  ARG  52          HH12      ARG  52   2.389   6.310   7.611
  389   HH21  ARG  52          HH21      ARG  52   5.333   5.162   5.976
  390   HH22  ARG  52          HH22      ARG  52   4.028   6.297   5.896
  391    H    GLU  53           H        GLU  53   3.976   0.047  11.585
  392    HA   GLU  53           HA       GLU  53   1.540   1.534  11.449
  393    HB2  GLU  53           HB2      GLU  53   2.071  -1.444  11.325
  394    HB3  GLU  53           HB3      GLU  53   0.486  -0.723  11.094
  395    HG2  GLU  53           HG2      GLU  53   2.940   0.064   9.473
  396    HG3  GLU  53           HG3      GLU  53   1.781  -1.153   8.946
  397    H    LEU  54           H        LEU  54   3.016  -0.696  13.903
  398    HA   LEU  54           HA       LEU  54   0.852  -0.983  15.631
  399    HB2  LEU  54           HB2      LEU  54   3.078  -2.087  15.917
  400    HB3  LEU  54           HB3      LEU  54   3.774  -0.524  16.363
  401    HG   LEU  54           HG       LEU  54   2.129  -0.521  18.330
  402   HD11  LEU  54          HD11      LEU  54   0.560  -2.259  17.480
  403   HD12  LEU  54          HD12      LEU  54   1.869  -3.419  17.406
  404   HD13  LEU  54          HD13      LEU  54   1.318  -2.832  18.985
  405   HD21  LEU  54          HD21      LEU  54   3.570  -1.987  19.673
  406   HD22  LEU  54          HD22      LEU  54   4.246  -2.707  18.186
  407   HD23  LEU  54          HD23      LEU  54   4.524  -0.997  18.575
  408    H    PHE  55           H        PHE  55   3.194   1.785  15.475
  409    HA   PHE  55           HA       PHE  55   2.122   3.190  17.675
  410    HB2  PHE  55           HB2      PHE  55   4.255   3.745  16.556
  411    HB3  PHE  55           HB3      PHE  55   3.374   4.303  15.135
  412    HD1  PHE  55           HD2      PHE  55   3.925   4.934  18.785
  413    HD2  PHE  55           HD1      PHE  55   2.435   6.527  15.058
  414    HE1  PHE  55           HE2      PHE  55   3.677   7.169  19.837
  415    HE2  PHE  55           HE1      PHE  55   2.199   8.762  16.116
  416    HZ   PHE  55           HZ       PHE  55   2.824   9.085  18.504
  417    H    GLU  56           H        GLU  56   0.985   3.115  14.254
  418    HA   GLU  56           HA       GLU  56  -0.957   5.176  14.738
  419    HB2  GLU  56           HB2      GLU  56  -0.485   3.279  12.413
  420    HB3  GLU  56           HB3      GLU  56  -1.758   4.507  12.444
  421    HG2  GLU  56           HG2      GLU  56  -0.076   6.286  12.773
  422    HG3  GLU  56           HG3      GLU  56   1.220   5.091  12.758
  423    H    GLU  57           H        GLU  57  -0.875   1.770  15.372
  424    HA   GLU  57           HA       GLU  57  -3.800   1.461  15.239
  425    HB2  GLU  57           HB2      GLU  57  -1.525  -0.429  15.938
  426    HB3  GLU  57           HB3      GLU  57  -3.216  -0.887  16.022
  427    HG2  GLU  57           HG2      GLU  57  -1.892   0.068  13.451
  428    HG3  GLU  57           HG3      GLU  57  -1.961  -1.611  13.963
  429    H    VAL  58           H        VAL  58  -1.219   1.313  17.747
  430    HA   VAL  58           HA       VAL  58  -3.330   1.510  19.874
  431    HB   VAL  58           HB       VAL  58  -1.492   0.185  21.202
  432   HG11  VAL  58          HG11      VAL  58  -2.372  -1.924  20.620
  433   HG12  VAL  58          HG12      VAL  58  -3.691  -0.764  20.655
  434   HG13  VAL  58          HG13      VAL  58  -3.061  -1.308  19.082
  435   HG21  VAL  58          HG21      VAL  58  -0.740  -0.753  18.437
  436   HG22  VAL  58          HG22      VAL  58   0.221   0.397  19.380
  437   HG23  VAL  58          HG23      VAL  58  -0.060  -1.240  20.016
  438    H    GLY  59           H        GLY  59  -0.967   3.449  18.485
  439    HA2  GLY  59           HA2      GLY  59   0.151   5.299  19.254
  440    HA3  GLY  59           HA3      GLY  59  -0.649   5.094  20.815
  441    H    LEU  60           H        LEU  60   0.788   2.181  20.264
  442    HA   LEU  60           HA       LEU  60   2.780   2.589  22.263
  443    HB2  LEU  60           HB2      LEU  60   1.170   0.675  21.917
  444    HB3  LEU  60           HB3      LEU  60   2.134   0.211  20.507
  445    HG   LEU  60           HG       LEU  60   4.029  -0.395  21.905
  446   HD11  LEU  60          HD11      LEU  60   2.256   0.435  24.240
  447   HD12  LEU  60          HD12      LEU  60   3.805  -0.435  24.350
  448   HD13  LEU  60          HD13      LEU  60   3.771   1.229  23.750
  449   HD21  LEU  60          HD21      LEU  60   2.129  -2.000  21.446
  450   HD22  LEU  60          HD22      LEU  60   2.780  -2.293  23.069
  451   HD23  LEU  60          HD23      LEU  60   1.260  -1.398  22.862
  452    H    SER  61           H        SER  61   5.021   2.356  22.049
  453    HA   SER  61           HA       SER  61   6.156   2.496  19.294
  454    HB2  SER  61           HB2      SER  61   7.749   4.180  20.277
  455    HB3  SER  61           HB3      SER  61   6.069   4.719  20.193
  456    HG   SER  61           HG       SER  61   6.960   5.210  22.238
  457    H    ARG  62           H        ARG  62   8.533   2.012  19.314
  458    HA   ARG  62           HA       ARG  62   9.046  -0.615  19.946
  459    HB2  ARG  62           HB2      ARG  62  11.187   1.572  19.884
  460    HB3  ARG  62           HB3      ARG  62  11.402  -0.164  19.638
  461    HG2  ARG  62           HG2      ARG  62   9.652   0.213  17.689
  462    HG3  ARG  62           HG3      ARG  62  10.193   1.892  17.794
  463    HD2  ARG  62           HD2      ARG  62  12.572   1.086  17.632
  464    HD3  ARG  62           HD3      ARG  62  11.954  -0.559  17.357
  465    HE   ARG  62           HE       ARG  62  10.714   1.094  15.462
  466   HH11  ARG  62          HH11      ARG  62  13.983  -0.096  16.184
  467   HH12  ARG  62          HH12      ARG  62  14.585   0.136  14.584
  468   HH21  ARG  62          HH21      ARG  62  11.544   1.502  13.336
  469   HH22  ARG  62          HH22      ARG  62  13.157   1.047  12.934
  470    H    LYS  63           H        LYS  63   9.570   2.198  22.051
  471    HA   LYS  63           HA       LYS  63  11.415   0.936  23.784
  472    HB2  LYS  63           HB2      LYS  63   9.492   3.169  24.574
  473    HB3  LYS  63           HB3      LYS  63  11.116   2.854  25.213
  474    HG2  LYS  63           HG2      LYS  63  10.414   3.967  22.480
  475    HG3  LYS  63           HG3      LYS  63  11.139   4.847  23.820
  476    HD2  LYS  63           HD2      LYS  63  12.412   2.403  22.561
  477    HD3  LYS  63           HD3      LYS  63  12.701   4.047  21.956
  478    HE2  LYS  63           HE2      LYS  63  13.536   4.712  24.225
  479    HE3  LYS  63           HE3      LYS  63  13.325   3.047  24.781
  480    HZ1  LYS  63           HZ1      LYS  63  15.169   3.910  22.619
  481    HZ2  LYS  63           HZ2      LYS  63  15.606   3.484  24.128
  482    HZ3  LYS  63           HZ3      LYS  63  14.982   2.359  23.124
  483    H    ASP  64           H        ASP  64   7.947   0.661  23.600
  484    HA   ASP  64           HA       ASP  64   8.006  -0.656  26.261
  485    HB2  ASP  64           HB2      ASP  64   6.752   1.578  26.013
  486    HB3  ASP  64           HB3      ASP  64   5.498   0.612  25.259
  487    H    VAL  65           H        VAL  65   8.474  -1.741  23.507
  488    HA   VAL  65           HA       VAL  65   6.895  -4.173  24.040
  489    HB   VAL  65           HB       VAL  65   6.692  -4.545  21.558
  490   HG11  VAL  65          HG11      VAL  65   4.624  -3.265  21.367
  491   HG12  VAL  65          HG12      VAL  65   4.794  -3.925  23.004
  492   HG13  VAL  65          HG13      VAL  65   5.139  -2.212  22.703
  493   HG21  VAL  65          HG21      VAL  65   7.211  -1.548  21.343
  494   HG22  VAL  65          HG22      VAL  65   8.320  -2.802  20.794
  495   HG23  VAL  65          HG23      VAL  65   6.729  -2.620  20.025
  496    H    ARG  66           H        ARG  66   7.807  -6.121  23.043
  497    HA   ARG  66           HA       ARG  66  10.521  -5.897  21.948
  498    HB2  ARG  66           HB2      ARG  66  11.440  -7.666  23.299
  499    HB3  ARG  66           HB3      ARG  66  10.999  -6.269  24.262
  500    HG2  ARG  66           HG2      ARG  66   8.989  -8.536  24.166
  501    HG3  ARG  66           HG3      ARG  66  10.519  -8.854  24.961
  502    HD2  ARG  66           HD2      ARG  66   8.717  -6.513  25.665
  503    HD3  ARG  66           HD3      ARG  66   8.755  -8.072  26.507
  504    HE   ARG  66           HE       ARG  66  11.263  -6.479  26.215
  505   HH11  ARG  66          HH21      ARG  66   8.810  -7.712  28.527
  506   HH12  ARG  66          HH22      ARG  66   9.892  -7.520  29.886
  507   HH21  ARG  66          HH11      ARG  66  12.635  -6.381  28.043
  508   HH22  ARG  66          HH12      ARG  66  12.067  -6.944  29.583
  509    H    ILE  67           H        ILE  67  10.739  -7.348  20.188
  510    HA   ILE  67           HA       ILE  67   8.424  -8.884  19.418
  511    HB   ILE  67           HB       ILE  67  11.225  -9.021  18.252
  512   HG12  ILE  67          HG12      ILE  67   9.035  -7.117  17.345
  513   HG13  ILE  67          HG13      ILE  67  10.455  -6.639  18.270
  514   HG21  ILE  67          HG21      ILE  67   9.630 -10.827  17.599
  515   HG22  ILE  67          HG22      ILE  67   8.492  -9.604  17.003
  516   HG23  ILE  67          HG23      ILE  67  10.083  -9.827  16.234
  517   HD11  ILE  67          HD11      ILE  67  10.452  -7.742  15.447
  518   HD12  ILE  67          HD12      ILE  67  10.927  -6.134  16.003
  519   HD13  ILE  67          HD13      ILE  67  11.918  -7.531  16.446
  520    H    LEU  68           H        LEU  68   7.928 -10.656  20.459
  521    HA   LEU  68           HA       LEU  68  10.003 -12.388  21.708
  522    HB2  LEU  68           HB2      LEU  68   6.964 -12.515  21.672
  523    HB3  LEU  68           HB3      LEU  68   8.044 -13.623  22.523
  524    HG   LEU  68           HG       LEU  68   7.661 -10.649  23.134
  525   HD11  LEU  68          HD11      LEU  68   5.823 -11.858  23.897
  526   HD12  LEU  68          HD12      LEU  68   6.801 -13.275  24.387
  527   HD13  LEU  68          HD13      LEU  68   6.906 -11.770  25.314
  528   HD21  LEU  68          HD21      LEU  68  10.002 -11.196  23.582
  529   HD22  LEU  68          HD22      LEU  68   9.117 -11.081  25.106
  530   HD23  LEU  68          HD23      LEU  68   9.520 -12.685  24.447
  531    H    ALA  69           H        ALA  69   7.749 -12.273  18.930
  532    HA   ALA  69           HA       ALA  69   8.927 -14.701  17.789
  533    HB1  ALA  69           HB1      ALA  69   7.057 -16.078  17.841
  534    HB2  ALA  69           HB2      ALA  69   7.009 -15.353  19.464
  535    HB3  ALA  69           HB3      ALA  69   5.943 -14.744  18.186
  536    H    SER  70           H        SER  70   8.006 -15.116  15.702
  537    HA   SER  70           HA       SER  70   6.399 -13.145  14.408
  538    HB2  SER  70           HB2      SER  70   8.141 -12.506  12.692
  539    HB3  SER  70           HB3      SER  70   8.329 -11.830  14.318
  540    HG   SER  70           HG       SER  70  10.343 -12.627  13.503
  541    H    THR  71           H        THR  71   5.917 -13.775  12.047
  542    HA   THR  71           HA       THR  71   5.703 -16.670  12.047
  543    HB   THR  71           HB       THR  71   4.600 -16.240   9.768
  544    HG1  THR  71           HG1      THR  71   5.066 -14.264   9.173
  545   HG21  THR  71          HG21      THR  71   2.552 -15.263  10.884
  546   HG22  THR  71          HG22      THR  71   3.223 -16.781  11.486
  547   HG23  THR  71          HG23      THR  71   3.514 -15.284  12.393
  548    H    ARG  72           H        ARG  72   6.778 -18.115  10.913
  549    HA   ARG  72           HA       ARG  72   9.330 -17.290   9.632
  550    HB2  ARG  72           HB2      ARG  72   7.984 -20.027   9.941
  551    HB3  ARG  72           HB3      ARG  72   9.570 -19.742   9.236
  552    HG2  ARG  72           HG2      ARG  72  10.482 -19.871  11.244
  553    HG3  ARG  72           HG3      ARG  72   9.698 -18.343  11.654
  554    HD2  ARG  72           HD2      ARG  72   8.014 -20.775  12.022
  555    HD3  ARG  72           HD3      ARG  72   9.436 -20.648  13.069
  556    HE   ARG  72           HE       ARG  72   8.240 -18.135  13.165
  557   HH11  ARG  72          HH21      ARG  72   7.405 -21.456  14.151
  558   HH12  ARG  72          HH22      ARG  72   6.418 -20.950  15.480
  559   HH21  ARG  72          HH11      ARG  72   6.901 -17.481  14.851
  560   HH22  ARG  72          HH12      ARG  72   6.033 -18.652  15.831
  561    H    ASN  73           H        ASN  73   6.254 -18.733   8.706
  562    HA   ASN  73           HA       ASN  73   6.724 -18.437   5.842
  563    HB2  ASN  73           HB2      ASN  73   4.391 -19.319   5.642
  564    HB3  ASN  73           HB3      ASN  73   5.443 -20.380   6.560
  565   HD21  ASN  73          HD22      ASN  73   4.845 -20.890   8.716
  566   HD22  ASN  73          HD21      ASN  73   3.637 -20.023   9.630
  567    H    TRP  74           H        TRP  74   5.069 -17.238   4.533
  568    HA   TRP  74           HA       TRP  74   4.044 -14.758   5.875
  569    HB2  TRP  74           HB2      TRP  74   4.649 -15.445   2.958
  570    HB3  TRP  74           HB3      TRP  74   3.641 -14.094   3.436
  571    HD1  TRP  74           HD1      TRP  74   7.295 -15.245   3.550
  572    HE1  TRP  74           HE1      TRP  74   8.808 -13.206   3.828
  573    HE3  TRP  74           HE3      TRP  74   3.709 -11.661   4.214
  574    HZ2  TRP  74           HZ2      TRP  74   8.516 -10.417   4.483
  575    HZ3  TRP  74           HZ3      TRP  74   4.347  -9.306   4.678
  576    HH2  TRP  74           HH2      TRP  74   6.746  -8.712   4.975
  577    H    LEU  75           H        LEU  75   1.818 -14.839   6.251
  578    HA   LEU  75           HA       LEU  75   0.237 -16.976   4.956
  579    HB2  LEU  75           HB2      LEU  75  -0.716 -14.724   6.759
  580    HB3  LEU  75           HB3      LEU  75  -1.658 -16.079   6.140
  581    HG   LEU  75           HG       LEU  75   0.590 -17.343   7.272
  582   HD11  LEU  75          HD11      LEU  75  -0.249 -15.136   9.117
  583   HD12  LEU  75          HD12      LEU  75   0.830 -16.497   9.512
  584   HD13  LEU  75          HD13      LEU  75   1.341 -15.304   8.308
  585   HD21  LEU  75          HD21      LEU  75  -2.083 -16.869   8.648
  586   HD22  LEU  75          HD22      LEU  75  -1.753 -18.119   7.420
  587   HD23  LEU  75          HD23      LEU  75  -0.899 -18.144   8.968
  588    H    ARG  76           H        ARG  76   0.420 -16.576   2.817
  589    HA   ARG  76           HA       ARG  76  -0.432 -13.960   1.720
  590    HB2  ARG  76           HB2      ARG  76   1.428 -15.406   0.698
  591    HB3  ARG  76           HB3      ARG  76   0.162 -16.532   0.208
  592    HG2  ARG  76           HG2      ARG  76  -0.896 -14.722  -1.161
  593    HG3  ARG  76           HG3      ARG  76   0.386 -13.605  -0.633
  594    HD2  ARG  76           HD2      ARG  76   2.070 -15.234  -1.571
  595    HD3  ARG  76           HD3      ARG  76   0.717 -16.161  -2.256
  596    HE   ARG  76           HE       ARG  76   0.417 -13.484  -3.111
  597   HH11  ARG  76          HH21      ARG  76   2.779 -16.111  -3.543
  598   HH12  ARG  76          HH22      ARG  76   3.391 -15.507  -5.043
  599   HH21  ARG  76          HH11      ARG  76   1.233 -12.690  -5.138
  600   HH22  ARG  76          HH12      ARG  76   2.494 -13.527  -5.956
  601    H    TYR  77           H        TYR  77  -2.403 -13.689   0.679
  602    HA   TYR  77           HA       TYR  77  -4.323 -15.952   0.913
  603    HB2  TYR  77           HB2      TYR  77  -4.480 -13.902   2.682
  604    HB3  TYR  77           HB3      TYR  77  -5.422 -13.221   1.340
  605    HD1  TYR  77           HD2      TYR  77  -5.034 -16.198   3.548
  606    HD2  TYR  77           HD1      TYR  77  -7.640 -14.037   0.873
  607    HE1  TYR  77           HE2      TYR  77  -6.813 -17.824   4.010
  608    HE2  TYR  77           HE1      TYR  77  -9.439 -15.663   1.286
  609    HH   TYR  77           HH       TYR  77  -8.966 -18.569   3.396
  610    H    LYS  78           H        LYS  78  -5.997 -15.899  -0.640
  611    HA   LYS  78           HA       LYS  78  -5.707 -14.053  -2.955
  612    HB2  LYS  78           HB2      LYS  78  -5.565 -17.077  -2.998
  613    HB3  LYS  78           HB3      LYS  78  -6.609 -16.308  -4.180
  614    HG2  LYS  78           HG2      LYS  78  -4.585 -16.609  -5.253
  615    HG3  LYS  78           HG3      LYS  78  -4.743 -14.874  -4.946
  616    HD2  LYS  78           HD2      LYS  78  -3.046 -14.873  -3.321
  617    HD3  LYS  78           HD3      LYS  78  -3.174 -16.603  -2.985
  618    HE2  LYS  78           HE2      LYS  78  -2.148 -15.449  -5.617
  619    HE3  LYS  78           HE3      LYS  78  -1.099 -15.871  -4.258
  620    HZ1  LYS  78           HZ1      LYS  78  -1.181 -17.670  -5.849
  621    HZ2  LYS  78           HZ2      LYS  78  -1.879 -18.185  -4.465
  622    HZ3  LYS  78           HZ3      LYS  78  -2.800 -17.795  -5.766
  623    H    LEU  79           H        LEU  79  -7.671 -13.205  -3.480
  624    HA   LEU  79           HA       LEU  79  -9.915 -13.874  -1.769
  625    HB2  LEU  79           HB2      LEU  79  -9.532 -11.923  -4.065
  626    HB3  LEU  79           HB3      LEU  79 -10.861 -11.869  -2.924
  627    HG   LEU  79           HG       LEU  79  -7.930 -11.533  -2.112
  628   HD11  LEU  79          HD11      LEU  79  -8.537  -9.920  -3.724
  629   HD12  LEU  79          HD12      LEU  79 -10.038  -9.490  -2.863
  630   HD13  LEU  79          HD13      LEU  79  -8.438  -9.129  -2.133
  631   HD21  LEU  79          HD21      LEU  79  -9.320 -12.298  -0.296
  632   HD22  LEU  79          HD22      LEU  79  -8.908 -10.589  -0.060
  633   HD23  LEU  79          HD23      LEU  79 -10.536 -11.037  -0.637
  634    HA   PRO  80           HA       PRO  80 -12.358 -15.870  -5.063
  635    HB2  PRO  80           HB2      PRO  80 -14.878 -15.498  -3.968
  636    HB3  PRO  80           HB3      PRO  80 -13.732 -16.732  -3.338
  637    HG2  PRO  80           HG2      PRO  80 -14.220 -13.941  -2.331
  638    HG3  PRO  80           HG3      PRO  80 -14.201 -15.460  -1.382
  639    HD2  PRO  80           HD2      PRO  80 -12.015 -13.860  -1.522
  640    HD3  PRO  80           HD3      PRO  80 -11.833 -15.637  -1.569
  641    H    LYS  81           H        LYS  81 -13.684 -14.808  -6.867
  642    HA   LYS  81           HA       LYS  81 -12.751 -12.134  -7.024
  643    HB2  LYS  81           HB2      LYS  81 -14.602 -13.430  -8.994
  644    HB3  LYS  81           HB3      LYS  81 -13.601 -11.947  -9.175
  645    HG2  LYS  81           HG2      LYS  81 -11.563 -13.142  -9.139
  646    HG3  LYS  81           HG3      LYS  81 -12.356 -14.651  -8.678
  647    HD2  LYS  81           HD2      LYS  81 -11.746 -14.641 -11.058
  648    HD3  LYS  81           HD3      LYS  81 -13.483 -14.833 -10.795
  649    HE2  LYS  81           HE2      LYS  81 -13.846 -12.431 -11.373
  650    HE3  LYS  81           HE3      LYS  81 -12.108 -12.231 -11.632
  651    HZ1  LYS  81           HZ1      LYS  81 -13.273 -12.613 -13.716
  652    HZ2  LYS  81           HZ2      LYS  81 -12.262 -13.862 -13.439
  653    HZ3  LYS  81           HZ3      LYS  81 -13.873 -14.039 -13.200
  654    H    ARG  82           H        ARG  82 -15.762 -13.220  -5.738
  655    HA   ARG  82           HA       ARG  82 -17.180 -10.799  -6.082
  656    HB2  ARG  82           HB2      ARG  82 -18.533 -11.441  -4.180
  657    HB3  ARG  82           HB3      ARG  82 -18.265 -12.797  -5.278
  658    HG2  ARG  82           HG2      ARG  82 -16.402 -13.531  -3.628
  659    HG3  ARG  82           HG3      ARG  82 -17.088 -12.344  -2.509
  660    HD2  ARG  82           HD2      ARG  82 -18.604 -14.626  -3.820
  661    HD3  ARG  82           HD3      ARG  82 -17.938 -14.676  -2.176
  662    HE   ARG  82           HE       ARG  82 -19.537 -12.395  -2.243
  663   HH11  ARG  82          HH11      ARG  82 -20.064 -15.896  -2.623
  664   HH12  ARG  82          HH12      ARG  82 -21.704 -15.852  -2.070
  665   HH21  ARG  82          HH21      ARG  82 -21.724 -12.335  -1.535
  666   HH22  ARG  82          HH22      ARG  82 -22.656 -13.787  -1.431
  667    H    LEU  83           H        LEU  83 -14.518 -11.543  -3.920
  668    HA   LEU  83           HA       LEU  83 -14.885  -9.036  -2.439
  669    HB2  LEU  83           HB2      LEU  83 -12.819 -11.216  -2.096
  670    HB3  LEU  83           HB3      LEU  83 -13.074  -9.852  -1.013
  671    HG   LEU  83           HG       LEU  83 -15.004 -12.142  -1.538
  672   HD11  LEU  83          HD11      LEU  83 -13.505 -11.427   1.002
  673   HD12  LEU  83          HD12      LEU  83 -14.565 -12.832   0.720
  674   HD13  LEU  83          HD13      LEU  83 -13.031 -12.699  -0.141
  675   HD21  LEU  83          HD21      LEU  83 -15.413  -9.734   0.252
  676   HD22  LEU  83          HD22      LEU  83 -16.381 -10.219  -1.166
  677   HD23  LEU  83          HD23      LEU  83 -16.401 -11.213   0.287
  678    H    VAL  84           H        VAL  84 -13.069 -10.235  -5.130
  679    HA   VAL  84           HA       VAL  84 -10.807  -8.473  -4.992
  680    HB   VAL  84           HB       VAL  84 -12.280  -9.697  -7.377
  681   HG11  VAL  84          HG11      VAL  84 -10.093  -9.342  -8.596
  682   HG12  VAL  84          HG12      VAL  84 -11.005  -7.867  -8.255
  683   HG13  VAL  84          HG13      VAL  84  -9.604  -8.285  -7.257
  684   HG21  VAL  84          HG21      VAL  84 -11.173 -11.353  -5.755
  685   HG22  VAL  84          HG22      VAL  84 -10.720 -11.427  -7.465
  686   HG23  VAL  84          HG23      VAL  84  -9.629 -10.659  -6.271
  687    H    ARG  85           H        ARG  85 -10.649  -6.309  -5.438
  688    HA   ARG  85           HA       ARG  85 -13.072  -4.917  -6.319
  689    HB2  ARG  85           HB2      ARG  85 -10.945  -4.376  -4.447
  690    HB3  ARG  85           HB3      ARG  85 -10.945  -3.092  -5.661
  691    HG2  ARG  85           HG2      ARG  85 -13.386  -4.076  -4.197
  692    HG3  ARG  85           HG3      ARG  85 -12.418  -2.654  -3.717
  693    HD2  ARG  85           HD2      ARG  85 -12.858  -1.735  -6.072
  694    HD3  ARG  85           HD3      ARG  85 -14.086  -2.979  -6.266
  695    HE   ARG  85           HE       ARG  85 -14.131  -0.570  -4.582
  696   HH11  ARG  85          HH21      ARG  85 -15.820  -3.663  -5.180
  697   HH12  ARG  85          HH22      ARG  85 -17.303  -3.120  -4.478
  698   HH21  ARG  85          HH11      ARG  85 -16.087   0.104  -3.641
  699   HH22  ARG  85          HH12      ARG  85 -17.451  -0.949  -3.580
  700    H    TRP  86           H        TRP  86 -13.083  -5.635  -8.357
  701    HA   TRP  86           HA       TRP  86 -11.049  -5.118 -10.287
  702    HB2  TRP  86           HB2      TRP  86 -14.048  -5.547 -10.459
  703    HB3  TRP  86           HB3      TRP  86 -13.018  -5.433 -11.888
  704    HD1  TRP  86           HD1      TRP  86 -14.351  -7.975  -9.576
  705    HE1  TRP  86           HE1      TRP  86 -13.141 -10.190  -9.772
  706    HE3  TRP  86           HE3      TRP  86 -10.416  -6.469 -12.469
  707    HZ2  TRP  86           HZ2      TRP  86 -10.567 -11.143 -10.751
  708    HZ3  TRP  86           HZ3      TRP  86  -8.583  -8.058 -13.020
  709    HH2  TRP  86           HH2      TRP  86  -8.635 -10.388 -12.145
  710    H    ASP  87           H        ASP  87 -13.378  -3.013  -8.735
  711    HA   ASP  87           HA       ASP  87 -13.717  -1.164 -10.915
  712    HB2  ASP  87           HB2      ASP  87 -15.395  -1.519  -9.151
  713    HB3  ASP  87           HB3      ASP  87 -14.272  -0.887  -7.941
  714    H    THR  88           H        THR  88 -11.148  -1.535  -8.587
  715    HA   THR  88           HA       THR  88 -10.295   1.264  -9.000
  716    HB   THR  88           HB       THR  88 -10.899   0.465  -6.642
  717    HG1  THR  88           HG1      THR  88  -9.851   2.357  -6.775
  718   HG21  THR  88          HG21      THR  88  -8.101  -0.714  -6.705
  719   HG22  THR  88          HG22      THR  88  -9.276  -0.714  -5.361
  720   HG23  THR  88          HG23      THR  88  -9.570  -1.701  -6.805
  721    H    LYS  89           H        LYS  89  -7.880   1.539  -9.064
  722    HA   LYS  89           HA       LYS  89  -6.605  -0.598 -10.644
  723    HB2  LYS  89           HB2      LYS  89  -6.676   2.331 -11.386
  724    HB3  LYS  89           HB3      LYS  89  -5.797   1.021 -12.196
  725    HG2  LYS  89           HG2      LYS  89  -8.152  -0.147 -12.342
  726    HG3  LYS  89           HG3      LYS  89  -8.792   1.467 -11.977
  727    HD2  LYS  89           HD2      LYS  89  -7.534   2.343 -13.962
  728    HD3  LYS  89           HD3      LYS  89  -6.913   0.694 -14.246
  729    HE2  LYS  89           HE2      LYS  89  -9.239  -0.125 -14.562
  730    HE3  LYS  89           HE3      LYS  89  -9.864   1.503 -14.260
  731    HZ1  LYS  89           HZ1      LYS  89  -9.730   1.033 -16.622
  732    HZ2  LYS  89           HZ2      LYS  89  -8.717   2.260 -16.259
  733    HZ3  LYS  89           HZ3      LYS  89  -8.126   0.757 -16.544
  734    HA   PRO  90           HA       PRO  90  -4.837  -1.594 -10.861
  735    HB2  PRO  90           HB2      PRO  90  -3.035  -3.111  -9.581
  736    HB3  PRO  90           HB3      PRO  90  -2.574  -1.770 -10.685
  737    HG2  PRO  90           HG2      PRO  90  -2.885  -1.647  -7.654
  738    HG3  PRO  90           HG3      PRO  90  -1.419  -1.191  -8.604
  739    HD2  PRO  90           HD2      PRO  90  -3.242   0.651  -7.826
  740    HD3  PRO  90           HD3      PRO  90  -2.536   0.736  -9.469
  741    H    VAL  91           H        VAL  91  -5.708  -3.735 -10.380
  742    HA   VAL  91           HA       VAL  91  -7.513  -3.797  -8.131
  743    HB   VAL  91           HB       VAL  91  -6.730  -5.807 -10.316
  744   HG11  VAL  91          HG11      VAL  91  -7.693  -7.100  -8.529
  745   HG12  VAL  91          HG12      VAL  91  -9.053  -5.983  -8.369
  746   HG13  VAL  91          HG13      VAL  91  -8.872  -6.980  -9.834
  747   HG21  VAL  91          HG21      VAL  91  -9.129  -3.953 -10.150
  748   HG22  VAL  91          HG22      VAL  91  -7.767  -3.794 -11.265
  749   HG23  VAL  91          HG23      VAL  91  -8.843  -5.178 -11.411
  750    H    CYS  92           H        CYS  92  -7.460  -4.963  -6.308
  751    HA   CYS  92           HA       CYS  92  -4.972  -6.351  -5.564
  752    HB2  CYS  92           HB2      CYS  92  -6.170  -6.386  -3.306
  753    HB3  CYS  92           HB3      CYS  92  -5.701  -4.800  -3.938
  754    HG   CYS  92           HG       CYS  92  -7.982  -4.566  -2.698
  755    H    ILE  93           H        ILE  93  -4.897  -8.555  -5.968
  756    HA   ILE  93           HA       ILE  93  -7.493 -10.027  -5.746
  757    HB   ILE  93           HB       ILE  93  -6.865 -11.669  -7.167
  758   HG12  ILE  93          HG12      ILE  93  -4.572 -12.165  -6.652
  759   HG13  ILE  93          HG13      ILE  93  -4.768 -11.917  -8.377
  760   HG21  ILE  93          HG21      ILE  93  -7.666  -9.635  -8.252
  761   HG22  ILE  93          HG22      ILE  93  -6.005  -9.067  -8.501
  762   HG23  ILE  93          HG23      ILE  93  -6.579 -10.541  -9.309
  763   HD11  ILE  93          HD11      ILE  93  -3.384 -10.121  -6.378
  764   HD12  ILE  93          HD12      ILE  93  -2.734 -10.875  -7.837
  765   HD13  ILE  93          HD13      ILE  93  -3.851  -9.529  -7.996
  766    H    GLY  94           H        GLY  94  -4.481  -9.546  -4.163
  767    HA2  GLY  94           HA2      GLY  94  -5.191 -11.301  -2.031
  768    HA3  GLY  94           HA3      GLY  94  -3.906 -11.994  -3.052
  769    H    GLN  95           H        GLN  95  -3.090 -11.456  -0.599
  770    HA   GLN  95           HA       GLN  95  -1.049  -9.482  -0.987
  771    HB2  GLN  95           HB2      GLN  95  -1.619  -8.165   1.126
  772    HB3  GLN  95           HB3      GLN  95  -2.552  -7.885  -0.336
  773    HG2  GLN  95           HG2      GLN  95  -4.129  -7.700   1.284
  774    HG3  GLN  95           HG3      GLN  95  -4.425  -9.297   0.642
  775   HE21  GLN  95          HE21      GLN  95  -4.278 -11.069   2.093
  776   HE22  GLN  95          HE22      GLN  95  -3.933 -10.860   3.802
  777    H    LYS  96           H        LYS  96   0.518  -9.498   0.883
  778    HA   LYS  96           HA       LYS  96   0.546 -12.250   2.073
  779    HB2  LYS  96           HB2      LYS  96   2.965 -12.294   1.868
  780    HB3  LYS  96           HB3      LYS  96   2.194 -12.126   0.296
  781    HG2  LYS  96           HG2      LYS  96   2.693  -9.696   0.302
  782    HG3  LYS  96           HG3      LYS  96   3.527  -9.857   1.850
  783    HD2  LYS  96           HD2      LYS  96   4.332 -11.311  -0.712
  784    HD3  LYS  96           HD3      LYS  96   4.999  -9.761  -0.192
  785    HE2  LYS  96           HE2      LYS  96   5.851 -10.810   1.911
  786    HE3  LYS  96           HE3      LYS  96   5.217 -12.374   1.380
  787    HZ1  LYS  96           HZ1      LYS  96   7.561 -12.175   0.857
  788    HZ2  LYS  96           HZ2      LYS  96   6.724 -12.256  -0.544
  789    HZ3  LYS  96           HZ3      LYS  96   7.331 -10.823  -0.025
  790    H    GLN  97           H        GLN  97   0.756 -12.411   4.256
  791    HA   GLN  97           HA       GLN  97   1.139  -9.841   5.722
  792    HB2  GLN  97           HB2      GLN  97  -0.676 -12.155   6.464
  793    HB3  GLN  97           HB3      GLN  97  -0.526 -10.574   7.268
  794    HG2  GLN  97           HG2      GLN  97  -1.250  -9.541   5.050
  795    HG3  GLN  97           HG3      GLN  97  -1.650 -11.163   4.502
  796   HE21  GLN  97          HE22      GLN  97  -2.337  -8.794   7.123
  797   HE22  GLN  97          HE21      GLN  97  -3.999  -9.291   7.383
  798    H    LYS  98           H        LYS  98   2.887  -9.823   7.011
  799    HA   LYS  98           HA       LYS  98   3.889 -12.402   8.174
  800    HB2  LYS  98           HB2      LYS  98   5.487 -11.171   6.786
  801    HB3  LYS  98           HB3      LYS  98   5.273  -9.702   7.783
  802    HG2  LYS  98           HG2      LYS  98   6.454 -10.595   9.543
  803    HG3  LYS  98           HG3      LYS  98   6.186 -12.286   9.056
  804    HD2  LYS  98           HD2      LYS  98   7.878 -10.405   7.400
  805    HD3  LYS  98           HD3      LYS  98   8.570 -11.218   8.797
  806    HE2  LYS  98           HE2      LYS  98   7.108 -12.845   6.679
  807    HE3  LYS  98           HE3      LYS  98   8.714 -12.224   6.325
  808    HZ1  LYS  98           HZ1      LYS  98   9.600 -13.404   8.237
  809    HZ2  LYS  98           HZ2      LYS  98   8.130 -13.998   8.658
  810    HZ3  LYS  98           HZ3      LYS  98   8.831 -14.455   7.253
  811    H    TRP  99           H        TRP  99   4.031 -12.517  10.489
  812    HA   TRP  99           HA       TRP  99   2.595 -10.295  11.860
  813    HB2  TRP  99           HB2      TRP  99   2.149 -13.262  12.217
  814    HB3  TRP  99           HB3      TRP  99   1.370 -11.972  13.136
  815    HD1  TRP  99           HD1      TRP  99   1.611 -13.339   9.548
  816    HE1  TRP  99           HE1      TRP  99  -0.572 -12.890   8.314
  817    HE3  TRP  99           HE3      TRP  99  -0.814 -10.640  13.159
  818    HZ2  TRP  99           HZ2      TRP  99  -3.088 -11.596   8.831
  819    HZ3  TRP  99           HZ3      TRP  99  -3.088  -9.785  12.744
  820    HH2  TRP  99           HH2      TRP  99  -4.266 -10.280  10.604
  821    H    PHE 100           H        PHE 100   3.024 -10.098  14.134
  822    HA   PHE 100           HA       PHE 100   5.623 -11.253  15.036
  823    HB2  PHE 100           HB2      PHE 100   4.787  -8.318  14.967
  824    HB3  PHE 100           HB3      PHE 100   6.224  -8.955  15.753
  825    HD1  PHE 100           HD2      PHE 100   4.572  -8.452  12.432
  826    HD2  PHE 100           HD1      PHE 100   8.235  -9.330  14.551
  827    HE1  PHE 100           HE2      PHE 100   5.881  -8.139  10.342
  828    HE2  PHE 100           HE1      PHE 100   9.523  -9.007  12.465
  829    HZ   PHE 100           HZ       PHE 100   8.360  -8.430  10.367
  830    H    LEU 101           H        LEU 101   5.454 -11.945  17.138
  831    HA   LEU 101           HA       LEU 101   3.131 -11.119  18.814
  832    HB2  LEU 101           HB2      LEU 101   3.861 -13.564  18.632
  833    HB3  LEU 101           HB3      LEU 101   5.347 -13.083  19.469
  834    HG   LEU 101           HG       LEU 101   2.553 -13.389  20.471
  835   HD11  LEU 101          HD11      LEU 101   4.428 -15.183  20.651
  836   HD12  LEU 101          HD12      LEU 101   5.181 -14.111  21.836
  837   HD13  LEU 101          HD13      LEU 101   3.569 -14.785  22.128
  838   HD21  LEU 101          HD21      LEU 101   3.217 -12.339  22.660
  839   HD22  LEU 101          HD22      LEU 101   4.624 -11.640  21.862
  840   HD23  LEU 101          HD23      LEU 101   2.973 -11.174  21.353
  841    H    LEU 102           H        LEU 102   3.573  -9.194  19.879
  842    HA   LEU 102           HA       LEU 102   6.335  -8.753  20.870
  843    HB2  LEU 102           HB2      LEU 102   4.131  -6.972  19.856
  844    HB3  LEU 102           HB3      LEU 102   5.135  -6.356  21.161
  845    HG   LEU 102           HG       LEU 102   7.094  -6.598  19.794
  846   HD11  LEU 102          HD11      LEU 102   5.220  -7.727  17.692
  847   HD12  LEU 102          HD12      LEU 102   6.840  -7.090  17.315
  848   HD13  LEU 102          HD13      LEU 102   6.675  -8.489  18.386
  849   HD21  LEU 102          HD21      LEU 102   5.408  -4.604  19.630
  850   HD22  LEU 102          HD22      LEU 102   6.654  -4.741  18.376
  851   HD23  LEU 102          HD23      LEU 102   4.979  -5.263  18.050
  852    H    GLN 103           H        GLN 103   6.560  -8.601  23.187
  853    HA   GLN 103           HA       GLN 103   3.965  -8.803  24.685
  854    HB2  GLN 103           HB2      GLN 103   5.364 -10.313  25.507
  855    HB3  GLN 103           HB3      GLN 103   6.789  -9.251  25.572
  856    HG2  GLN 103           HG2      GLN 103   6.059  -8.304  27.610
  857    HG3  GLN 103           HG3      GLN 103   4.355  -8.448  27.193
  858   HE21  GLN 103          HE22      GLN 103   3.334 -10.661  27.213
  859   HE22  GLN 103          HE21      GLN 103   3.906 -11.777  28.438
  860    H    LEU 104           H        LEU 104   3.100  -7.056  25.683
  861    HA   LEU 104           HA       LEU 104   4.025  -4.363  25.337
  862    HB2  LEU 104           HB2      LEU 104   1.635  -5.664  26.010
  863    HB3  LEU 104           HB3      LEU 104   2.159  -5.148  27.575
  864    HG   LEU 104           HG       LEU 104   0.911  -3.393  27.166
  865   HD11  LEU 104          HD11      LEU 104   3.130  -2.425  25.332
  866   HD12  LEU 104          HD12      LEU 104   1.901  -1.437  26.148
  867   HD13  LEU 104          HD13      LEU 104   3.091  -2.302  27.112
  868   HD21  LEU 104          HD21      LEU 104  -0.225  -4.278  25.289
  869   HD22  LEU 104          HD22      LEU 104   0.115  -2.579  25.005
  870   HD23  LEU 104          HD23      LEU 104   1.110  -3.809  24.183
  871    H    VAL 105           H        VAL 105   5.417  -3.171  26.801
  872    HA   VAL 105           HA       VAL 105   6.858  -4.884  28.691
  873    HB   VAL 105           HB       VAL 105   7.323  -2.121  27.594
  874   HG11  VAL 105          HG11      VAL 105   8.389  -2.146  29.789
  875   HG12  VAL 105          HG12      VAL 105   9.169  -3.703  29.418
  876   HG13  VAL 105          HG13      VAL 105   9.611  -2.228  28.521
  877   HG21  VAL 105          HG21      VAL 105   8.993  -4.618  27.142
  878   HG22  VAL 105          HG22      VAL 105   7.632  -4.214  26.094
  879   HG23  VAL 105          HG23      VAL 105   9.002  -3.096  26.213
  880    H    SER 106           H        SER 106   5.275  -1.648  28.919
  881    HA   SER 106           HA       SER 106   5.341  -1.696  31.838
  882    HB2  SER 106           HB2      SER 106   3.902   0.089  29.824
  883    HB3  SER 106           HB3      SER 106   3.912   0.347  31.576
  884    HG   SER 106           HG       SER 106   6.043   0.503  29.730
  885    H    GLY 107           H        GLY 107   3.201  -2.878  29.357
  886    HA2  GLY 107           HA2      GLY 107   1.455  -4.507  29.921
  887    HA3  GLY 107           HA3      GLY 107   1.112  -3.573  31.387
  888    H    ASP 108           H        ASP 108  -1.015  -3.907  30.018
  889    HA   ASP 108           HA       ASP 108  -1.509  -2.705  27.617
  890    HB2  ASP 108           HB2      ASP 108  -3.743  -3.233  28.022
  891    HB3  ASP 108           HB3      ASP 108  -2.838  -4.406  28.966
  892    H    ALA 109           H        ALA 109  -1.321  -1.173  30.686
  893    HA   ALA 109           HA       ALA 109  -2.755   1.205  30.439
  894    HB1  ALA 109           HB1      ALA 109   0.088   0.813  31.473
  895    HB2  ALA 109           HB2      ALA 109  -0.972   2.188  31.853
  896    HB3  ALA 109           HB3      ALA 109  -1.406   0.559  32.418
  897    H    GLU 110           H        GLU 110   0.176   0.254  28.684
  898    HA   GLU 110           HA       GLU 110   0.524   2.941  27.683
  899    HB2  GLU 110           HB2      GLU 110   2.234   0.466  27.683
  900    HB3  GLU 110           HB3      GLU 110   2.598   1.724  26.497
  901    HG2  GLU 110           HG2      GLU 110   2.370   2.193  29.485
  902    HG3  GLU 110           HG3      GLU 110   3.879   1.923  28.607
  903    H    ILE 111           H        ILE 111  -1.739   1.289  26.878
  904    HA   ILE 111           HA       ILE 111  -1.485   1.471  23.908
  905    HB   ILE 111           HB       ILE 111  -3.821   0.391  25.525
  906   HG12  ILE 111          HG12      ILE 111  -2.068  -1.333  23.722
  907   HG13  ILE 111          HG13      ILE 111  -1.591  -1.048  25.421
  908   HG21  ILE 111          HG21      ILE 111  -4.575   1.258  23.386
  909   HG22  ILE 111          HG22      ILE 111  -3.213   0.480  22.546
  910   HG23  ILE 111          HG23      ILE 111  -4.529  -0.493  23.239
  911   HD11  ILE 111          HD11      ILE 111  -4.223  -2.309  24.544
  912   HD12  ILE 111          HD12      ILE 111  -2.868  -3.110  25.364
  913   HD13  ILE 111          HD13      ILE 111  -3.818  -1.886  26.196
  914    H    ASN 112           H        ASN 112  -2.474   3.111  22.836
  915    HA   ASN 112           HA       ASN 112  -4.452   4.873  24.194
  916    HB2  ASN 112           HB2      ASN 112  -2.405   6.197  24.131
  917    HB3  ASN 112           HB3      ASN 112  -2.090   5.708  22.460
  918   HD21  ASN 112          HD22      ASN 112  -2.005   8.055  21.895
  919   HD22  ASN 112          HD21      ASN 112  -3.528   8.873  21.612
  920    H    MET 113           H        MET 113  -6.324   4.925  22.951
  921    HA   MET 113           HA       MET 113  -6.223   3.588  20.300
  922    HB2  MET 113           HB2      MET 113  -8.576   4.276  22.076
  923    HB3  MET 113           HB3      MET 113  -8.657   3.345  20.574
  924    HG2  MET 113           HG2      MET 113  -6.790   2.379  22.725
  925    HG3  MET 113           HG3      MET 113  -8.523   2.231  22.992
  926    HE1  MET 113           HE1      MET 113  -5.386   0.988  21.118
  927    HE2  MET 113           HE2      MET 113  -6.030  -0.169  19.926
  928    HE3  MET 113           HE3      MET 113  -6.220   1.570  19.664
  929    H    GLN 114           H        GLN 114  -6.132   6.719  21.504
  930    HA   GLN 114           HA       GLN 114  -7.641   7.945  19.292
  931    HB2  GLN 114           HB2      GLN 114  -6.900   9.073  22.015
  932    HB3  GLN 114           HB3      GLN 114  -7.654   9.967  20.682
  933    HG2  GLN 114           HG2      GLN 114  -9.645   8.560  20.795
  934    HG3  GLN 114           HG3      GLN 114  -8.902   7.518  22.021
  935   HE21  GLN 114          HE22      GLN 114  -9.945  10.953  21.423
  936   HE22  GLN 114          HE21      GLN 114 -10.317  11.290  23.098
  937    H    THR 115           H        THR 115  -5.729   7.052  18.293
  938    HA   THR 115           HA       THR 115  -3.067   8.013  18.686
  939    HB   THR 115           HB       THR 115  -3.052   6.925  16.271
  940    HG1  THR 115           HG1      THR 115  -4.775   5.586  15.881
  941   HG21  THR 115          HG21      THR 115  -3.837   5.413  18.850
  942   HG22  THR 115          HG22      THR 115  -3.108   4.627  17.428
  943   HG23  THR 115          HG23      THR 115  -2.177   5.819  18.350
  944    H    SER 116           H        SER 116  -5.381   8.392  16.096
  945    HA   SER 116           HA       SER 116  -4.342  11.011  15.230
  946    HB2  SER 116           HB2      SER 116  -6.357   9.023  14.132
  947    HB3  SER 116           HB3      SER 116  -6.032  10.596  13.367
  948    HG   SER 116           HG       SER 116  -4.747   8.881  12.478
  949    H    SER 117           H        SER 117  -6.199  12.639  14.616
  950    HA   SER 117           HA       SER 117  -7.399  13.572  16.956
  951    HB2  SER 117           HB2      SER 117  -8.307  14.179  14.117
  952    HB3  SER 117           HB3      SER 117  -8.397  15.243  15.534
  953    HG   SER 117           HG       SER 117  -6.610  15.769  14.176
  954    H    THR 118           H        THR 118  -8.596  11.189  14.703
  955    HA   THR 118           HA       THR 118 -11.034  10.898  16.299
  956    HB   THR 118           HB       THR 118 -11.326  11.709  13.843
  957    HG1  THR 118           HG1      THR 118 -13.275  10.829  13.895
  958   HG21  THR 118          HG21      THR 118  -9.889  10.033  12.724
  959   HG22  THR 118          HG22      THR 118 -10.974   8.738  13.285
  960   HG23  THR 118          HG23      THR 118 -11.567   9.974  12.158
  961    HA   PRO 119           HA       PRO 119  -8.611   7.446  17.421
  962    HB2  PRO 119           HB2      PRO 119 -10.472   5.604  18.304
  963    HB3  PRO 119           HB3      PRO 119  -9.993   7.062  19.215
  964    HG2  PRO 119           HG2      PRO 119 -12.363   6.672  17.379
  965    HG3  PRO 119           HG3      PRO 119 -12.348   7.415  19.013
  966    HD2  PRO 119           HD2      PRO 119 -12.314   8.942  16.750
  967    HD3  PRO 119           HD3      PRO 119 -11.317   9.418  18.164
  968    H    GLU 120           H        GLU 120  -7.928   5.342  16.849
  969    HA   GLU 120           HA       GLU 120  -8.715   4.504  14.146
  970    HB2  GLU 120           HB2      GLU 120  -6.350   4.623  14.853
  971    HB3  GLU 120           HB3      GLU 120  -6.661   3.419  16.114
  972    HG2  GLU 120           HG2      GLU 120  -5.622   2.416  14.171
  973    HG3  GLU 120           HG3      GLU 120  -7.236   1.760  14.429
  974    H    PHE 121           H        PHE 121  -9.118   3.461  17.539
  975    HA   PHE 121           HA       PHE 121 -10.864   1.236  16.603
  976    HB2  PHE 121           HB2      PHE 121  -8.886   1.247  18.872
  977    HB3  PHE 121           HB3      PHE 121 -10.118   0.017  18.647
  978    HD1  PHE 121           HD1      PHE 121 -10.030  -1.521  16.684
  979    HD2  PHE 121           HD2      PHE 121  -6.848   1.226  17.531
  980    HE1  PHE 121           HE1      PHE 121  -8.550  -2.808  15.178
  981    HE2  PHE 121           HE2      PHE 121  -5.332  -0.125  16.139
  982    HZ   PHE 121           HZ       PHE 121  -6.166  -2.139  14.948
  983    H    ASP 122           H        ASP 122 -12.753   1.005  17.600
  984    HA   ASP 122           HA       ASP 122 -13.804   3.223  19.239
  985    HB2  ASP 122           HB2      ASP 122 -15.230   2.319  17.510
  986    HB3  ASP 122           HB3      ASP 122 -14.957   0.665  18.062
  987    H    GLY 123           H        GLY 123 -12.495  -0.051  19.640
  988    HA2  GLY 123           HA2      GLY 123 -12.518   0.180  22.539
  989    HA3  GLY 123           HA3      GLY 123 -13.656  -1.028  21.878
  990    H    TRP 124           H        TRP 124 -11.535  -1.855  23.512
  991    HA   TRP 124           HA       TRP 124 -10.529  -3.815  21.686
  992    HB2  TRP 124           HB2      TRP 124  -8.331  -3.461  21.633
  993    HB3  TRP 124           HB3      TRP 124  -8.733  -1.796  21.971
  994    HD1  TRP 124           HD1      TRP 124  -7.157  -4.903  23.425
  995    HE1  TRP 124           HE1      TRP 124  -6.057  -4.433  25.663
  996    HE3  TRP 124           HE3      TRP 124  -8.767  -0.090  24.078
  997    HZ2  TRP 124           HZ2      TRP 124  -5.937  -2.224  27.573
  998    HZ3  TRP 124           HZ3      TRP 124  -8.117   1.188  26.111
  999    HH2  TRP 124           HH2      TRP 124  -6.708   0.119  27.866
 1000    H    ARG 125           H        ARG 125  -9.571  -5.678  22.898
 1001    HA   ARG 125           HA       ARG 125 -10.043  -5.695  25.777
 1002    HB2  ARG 125           HB2      ARG 125 -11.581  -7.548  25.830
 1003    HB3  ARG 125           HB3      ARG 125 -12.279  -6.276  24.840
 1004    HG2  ARG 125           HG2      ARG 125 -11.407  -7.557  22.787
 1005    HG3  ARG 125           HG3      ARG 125 -11.013  -8.877  23.864
 1006    HD2  ARG 125           HD2      ARG 125 -13.783  -7.648  23.498
 1007    HD3  ARG 125           HD3      ARG 125 -13.219  -9.132  22.724
 1008    HE   ARG 125           HE       ARG 125 -12.858  -9.454  25.512
 1009   HH11  ARG 125          HH21      ARG 125 -15.579  -9.077  23.242
 1010   HH12  ARG 125          HH22      ARG 125 -16.685  -9.978  24.210
 1011   HH21  ARG 125          HH11      ARG 125 -14.340 -10.676  26.784
 1012   HH22  ARG 125          HH12      ARG 125 -15.958 -10.920  26.251
 1013    H    TRP 126           H        TRP 126  -9.297  -7.827  26.687
 1014    HA   TRP 126           HA       TRP 126  -7.119  -9.026  25.046
 1015    HB2  TRP 126           HB2      TRP 126  -7.403  -8.668  28.047
 1016    HB3  TRP 126           HB3      TRP 126  -6.234  -9.741  27.297
 1017    HD1  TRP 126           HD1      TRP 126  -6.971  -5.951  27.631
 1018    HE1  TRP 126           HE1      TRP 126  -4.773  -4.717  27.549
 1019    HE3  TRP 126           HE3      TRP 126  -3.948  -9.795  26.112
 1020    HZ2  TRP 126           HZ2      TRP 126  -2.021  -5.268  26.837
 1021    HZ3  TRP 126           HZ3      TRP 126  -1.542  -9.393  25.714
 1022    HH2  TRP 126           HH2      TRP 126  -0.552  -7.144  26.168
 1023    H    VAL 127           H        VAL 127  -7.364 -11.216  24.602
 1024    HA   VAL 127           HA       VAL 127  -9.631 -12.726  25.828
 1025    HB   VAL 127           HB       VAL 127  -9.925 -13.423  23.250
 1026   HG11  VAL 127          HG11      VAL 127 -11.165 -11.008  24.608
 1027   HG12  VAL 127          HG12      VAL 127 -11.798 -11.743  23.116
 1028   HG13  VAL 127          HG13      VAL 127 -11.750 -12.682  24.617
 1029   HG21  VAL 127          HG21      VAL 127  -9.799 -11.627  21.674
 1030   HG22  VAL 127          HG22      VAL 127  -9.172 -10.502  22.895
 1031   HG23  VAL 127          HG23      VAL 127  -8.191 -11.891  22.363
 1032    H    SER 128           H        SER 128  -9.434 -15.047  25.647
 1033    HA   SER 128           HA       SER 128  -6.805 -16.138  25.473
 1034    HB2  SER 128           HB2      SER 128  -9.498 -17.493  25.055
 1035    HB3  SER 128           HB3      SER 128  -7.977 -18.274  25.549
 1036    HG   SER 128           HG       SER 128  -9.354 -17.833  27.361
 1037    H    TYR 129           H        TYR 129  -5.799 -17.270  23.732
 1038    HA   TYR 129           HA       TYR 129  -5.792 -16.013  21.337
 1039    HB2  TYR 129           HB2      TYR 129  -5.047 -18.825  20.938
 1040    HB3  TYR 129           HB3      TYR 129  -4.078 -17.378  20.826
 1041    HD1  TYR 129           HD2      TYR 129  -5.513 -19.861  23.220
 1042    HD2  TYR 129           HD1      TYR 129  -2.396 -16.936  22.526
 1043    HE1  TYR 129           HE2      TYR 129  -4.426 -20.526  25.337
 1044    HE2  TYR 129           HE1      TYR 129  -1.323 -17.616  24.637
 1045    HH   TYR 129           HH       TYR 129  -2.633 -20.131  26.822
 1046    H    TRP 130           H        TRP 130  -7.885 -18.818  22.060
 1047    HA   TRP 130           HA       TRP 130  -8.592 -19.099  19.232
 1048    HB2  TRP 130           HB2      TRP 130  -9.677 -20.653  21.582
 1049    HB3  TRP 130           HB3      TRP 130  -9.637 -21.129  19.887
 1050    HD1  TRP 130           HD1      TRP 130  -7.976 -21.963  22.924
 1051    HE1  TRP 130           HE1      TRP 130  -5.563 -22.766  22.648
 1052    HE3  TRP 130           HE3      TRP 130  -7.161 -20.484  18.072
 1053    HZ2  TRP 130           HZ2      TRP 130  -3.484 -22.598  20.681
 1054    HZ3  TRP 130           HZ3      TRP 130  -4.933 -20.826  17.029
 1055    HH2  TRP 130           HH2      TRP 130  -3.080 -21.831  18.343
 1056    H    TYR 131           H        TYR 131  -9.866 -17.244  21.853
 1057    HA   TYR 131           HA       TYR 131 -12.640 -17.382  21.145
 1058    HB2  TYR 131           HB2      TYR 131 -11.787 -16.658  23.333
 1059    HB3  TYR 131           HB3      TYR 131 -11.148 -15.191  22.609
 1060    HD1  TYR 131           HD2      TYR 131 -12.764 -13.455  21.653
 1061    HD2  TYR 131           HD1      TYR 131 -14.124 -16.924  23.845
 1062    HE1  TYR 131           HE2      TYR 131 -14.970 -12.398  21.948
 1063    HE2  TYR 131           HE1      TYR 131 -16.338 -15.858  24.149
 1064    HH   TYR 131           HH       TYR 131 -17.137 -12.607  22.828
 1065    HA   PRO 132           HA       PRO 132 -11.912 -13.315  18.673
 1066    HB2  PRO 132           HB2      PRO 132  -9.494 -12.928  17.371
 1067    HB3  PRO 132           HB3      PRO 132  -9.874 -12.313  19.010
 1068    HG2  PRO 132           HG2      PRO 132  -8.400 -14.849  18.326
 1069    HG3  PRO 132           HG3      PRO 132  -7.915 -13.540  19.459
 1070    HD2  PRO 132           HD2      PRO 132  -9.123 -15.717  20.370
 1071    HD3  PRO 132           HD3      PRO 132  -9.623 -14.135  21.015
 1072    H    VAL 133           H        VAL 133 -10.439 -16.373  17.756
 1073    HA   VAL 133           HA       VAL 133 -10.770 -16.255  14.935
 1074    HB   VAL 133           HB       VAL 133 -10.663 -18.654  16.810
 1075   HG11  VAL 133          HG11      VAL 133 -11.392 -19.273  14.508
 1076   HG12  VAL 133          HG12      VAL 133  -9.920 -18.515  13.864
 1077   HG13  VAL 133          HG13      VAL 133  -9.828 -19.934  14.944
 1078   HG21  VAL 133          HG21      VAL 133  -8.227 -18.706  16.294
 1079   HG22  VAL 133          HG22      VAL 133  -8.387 -17.184  15.393
 1080   HG23  VAL 133          HG23      VAL 133  -8.655 -17.233  17.150
 1081    H    ARG 134           H        ARG 134 -13.065 -16.842  17.601
 1082    HA   ARG 134           HA       ARG 134 -15.055 -18.257  16.077
 1083    HB2  ARG 134           HB2      ARG 134 -15.498 -16.363  18.433
 1084    HB3  ARG 134           HB3      ARG 134 -16.585 -17.623  17.857
 1085    HG2  ARG 134           HG2      ARG 134 -13.879 -18.180  19.108
 1086    HG3  ARG 134           HG3      ARG 134 -15.399 -18.128  19.992
 1087    HD2  ARG 134           HD2      ARG 134 -14.904 -19.947  17.619
 1088    HD3  ARG 134           HD3      ARG 134 -14.561 -20.420  19.305
 1089    HE   ARG 134           HE       ARG 134 -17.206 -19.511  19.271
 1090   HH11  ARG 134          HH11      ARG 134 -15.401 -22.202  17.797
 1091   HH12  ARG 134          HH12      ARG 134 -16.771 -23.249  17.700
 1092   HH21  ARG 134          HH21      ARG 134 -19.024 -20.905  19.143
 1093   HH22  ARG 134          HH22      ARG 134 -18.869 -22.494  18.490
 1094    H    GLN 135           H        GLN 135 -14.197 -14.784  16.305
 1095    HA   GLN 135           HA       GLN 135 -16.880 -14.130  15.223
 1096    HB2  GLN 135           HB2      GLN 135 -14.871 -12.339  16.516
 1097    HB3  GLN 135           HB3      GLN 135 -16.390 -11.780  15.835
 1098    HG2  GLN 135           HG2      GLN 135 -16.085 -13.910  17.981
 1099    HG3  GLN 135           HG3      GLN 135 -16.585 -12.240  18.290
 1100   HE21  GLN 135          HE22      GLN 135 -17.965 -14.919  18.825
 1101   HE22  GLN 135          HE21      GLN 135 -19.523 -14.750  18.053
 1102    H    VAL 136           H        VAL 136 -13.553 -14.231  14.107
 1103    HA   VAL 136           HA       VAL 136 -14.060 -12.453  11.852
 1104    HB   VAL 136           HB       VAL 136 -11.979 -13.829  10.979
 1105   HG11  VAL 136          HG11      VAL 136 -11.761 -11.612  13.049
 1106   HG12  VAL 136          HG12      VAL 136 -10.533 -12.070  11.850
 1107   HG13  VAL 136          HG13      VAL 136 -12.057 -11.373  11.312
 1108   HG21  VAL 136          HG21      VAL 136 -11.882 -15.312  13.032
 1109   HG22  VAL 136          HG22      VAL 136 -10.394 -14.417  12.656
 1110   HG23  VAL 136          HG23      VAL 136 -11.436 -13.854  13.959
 1111    H    VAL 137           H        VAL 137 -14.327 -13.048   9.682
 1112    HA   VAL 137           HA       VAL 137 -16.211 -15.185   9.271
 1113    HB   VAL 137           HB       VAL 137 -16.472 -14.306   7.093
 1114   HG11  VAL 137          HG11      VAL 137 -16.847 -11.969   7.354
 1115   HG12  VAL 137          HG12      VAL 137 -17.202 -12.742   8.908
 1116   HG13  VAL 137          HG13      VAL 137 -15.688 -11.833   8.684
 1117   HG21  VAL 137          HG21      VAL 137 -14.322 -14.323   6.179
 1118   HG22  VAL 137          HG22      VAL 137 -14.796 -12.620   6.115
 1119   HG23  VAL 137          HG23      VAL 137 -13.650 -13.178   7.373
 1120    H    SER 138           H        SER 138 -15.812 -16.551   7.096
 1121    HA   SER 138           HA       SER 138 -14.093 -18.611   7.767
 1122    HB2  SER 138           HB2      SER 138 -15.103 -17.852   5.004
 1123    HB3  SER 138           HB3      SER 138 -14.682 -19.486   5.573
 1124    HG   SER 138           HG       SER 138 -16.958 -19.090   5.663
 1125    H    PHE 139           H        PHE 139 -13.483 -16.019   5.336
 1126    HA   PHE 139           HA       PHE 139 -11.018 -17.091   4.467
 1127    HB2  PHE 139           HB2      PHE 139 -11.901 -14.181   4.334
 1128    HB3  PHE 139           HB3      PHE 139 -10.745 -14.981   3.290
 1129    HD1  PHE 139           HD2      PHE 139 -11.656 -17.106   1.956
 1130    HD2  PHE 139           HD1      PHE 139 -14.163 -14.004   3.618
 1131    HE1  PHE 139           HE2      PHE 139 -13.510 -17.802   0.471
 1132    HE2  PHE 139           HE1      PHE 139 -16.022 -14.727   2.144
 1133    HZ   PHE 139           HZ       PHE 139 -15.704 -16.632   0.573
 1134    H    LYS 140           H        LYS 140 -11.743 -14.631   6.954
 1135    HA   LYS 140           HA       LYS 140  -8.892 -14.080   7.447
 1136    HB2  LYS 140           HB2      LYS 140 -11.447 -13.207   8.853
 1137    HB3  LYS 140           HB3      LYS 140  -9.825 -12.713   9.376
 1138    HG2  LYS 140           HG2      LYS 140  -9.377 -11.692   7.197
 1139    HG3  LYS 140           HG3      LYS 140 -10.961 -12.175   6.590
 1140    HD2  LYS 140           HD2      LYS 140 -10.528 -10.343   8.997
 1141    HD3  LYS 140           HD3      LYS 140 -10.824  -9.794   7.321
 1142    HE2  LYS 140           HE2      LYS 140 -12.982 -11.087   7.366
 1143    HE3  LYS 140           HE3      LYS 140 -12.697 -11.377   9.103
 1144    HZ1  LYS 140           HZ1      LYS 140 -14.139  -9.399   8.706
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.741  -8.916   9.408
 1146    HZ3  LYS 140           HZ3      LYS 140 -12.991  -8.693   7.801
 1147    H    ARG 141           H        ARG 141 -11.491 -15.926   9.110
 1148    HA   ARG 141           HA       ARG 141  -9.974 -16.335  11.443
 1149    HB2  ARG 141           HB2      ARG 141 -11.576 -17.873  12.185
 1150    HB3  ARG 141           HB3      ARG 141 -12.421 -16.677  11.215
 1151    HG2  ARG 141           HG2      ARG 141 -12.319 -18.377   9.290
 1152    HG3  ARG 141           HG3      ARG 141 -11.778 -19.561  10.493
 1153    HD2  ARG 141           HD2      ARG 141 -13.832 -19.064  11.846
 1154    HD3  ARG 141           HD3      ARG 141 -14.341 -17.915  10.592
 1155    HE   ARG 141           HE       ARG 141 -13.816 -20.639   9.640
 1156   HH11  ARG 141          HH11      ARG 141 -16.310 -18.510  11.023
 1157   HH12  ARG 141          HH12      ARG 141 -17.636 -19.395  10.360
 1158   HH21  ARG 141          HH21      ARG 141 -15.591 -21.818   8.748
 1159   HH22  ARG 141          HH22      ARG 141 -17.213 -21.323   9.047
 1160    H    ASP 142           H        ASP 142  -9.712 -18.142   8.423
 1161    HA   ASP 142           HA       ASP 142  -8.094 -20.272   9.468
 1162    HB2  ASP 142           HB2      ASP 142  -9.112 -20.304   7.214
 1163    HB3  ASP 142           HB3      ASP 142  -8.045 -18.986   6.712
 1164    H    VAL 143           H        VAL 143  -7.241 -17.008   8.146
 1165    HA   VAL 143           HA       VAL 143  -4.418 -17.372   8.591
 1166    HB   VAL 143           HB       VAL 143  -6.213 -14.964   8.119
 1167   HG11  VAL 143          HG11      VAL 143  -4.128 -13.583   7.887
 1168   HG12  VAL 143          HG12      VAL 143  -4.512 -14.021   9.559
 1169   HG13  VAL 143          HG13      VAL 143  -3.223 -14.892   8.695
 1170   HG21  VAL 143          HG21      VAL 143  -5.757 -16.428   6.211
 1171   HG22  VAL 143          HG22      VAL 143  -4.908 -14.893   5.990
 1172   HG23  VAL 143          HG23      VAL 143  -4.011 -16.339   6.518
 1173    H    TYR 144           H        TYR 144  -7.050 -15.908  10.564
 1174    HA   TYR 144           HA       TYR 144  -5.326 -14.951  12.602
 1175    HB2  TYR 144           HB2      TYR 144  -8.270 -15.661  12.544
 1176    HB3  TYR 144           HB3      TYR 144  -7.487 -15.164  14.022
 1177    HD1  TYR 144           HD2      TYR 144  -7.007 -13.690  10.524
 1178    HD2  TYR 144           HD1      TYR 144  -8.464 -13.125  14.554
 1179    HE1  TYR 144           HE2      TYR 144  -7.302 -11.303  10.078
 1180    HE2  TYR 144           HE1      TYR 144  -8.760 -10.720  14.098
 1181    HH   TYR 144           HH       TYR 144  -8.066  -9.244  10.901
 1182    H    ARG 145           H        ARG 145  -7.057 -18.162  12.380
 1183    HA   ARG 145           HA       ARG 145  -5.973 -19.000  14.897
 1184    HB2  ARG 145           HB2      ARG 145  -6.907 -21.106  14.510
 1185    HB3  ARG 145           HB3      ARG 145  -7.974 -19.971  13.687
 1186    HG2  ARG 145           HG2      ARG 145  -6.717 -20.519  11.553
 1187    HG3  ARG 145           HG3      ARG 145  -5.948 -21.858  12.419
 1188    HD2  ARG 145           HD2      ARG 145  -8.916 -21.418  11.982
 1189    HD3  ARG 145           HD3      ARG 145  -7.863 -22.500  11.040
 1190    HE   ARG 145           HE       ARG 145  -7.558 -23.263  13.722
 1191   HH11  ARG 145          HH11      ARG 145 -10.175 -23.296  11.308
 1192   HH12  ARG 145          HH12      ARG 145 -11.001 -24.630  12.026
 1193   HH21  ARG 145          HH21      ARG 145  -8.676 -25.024  14.683
 1194   HH22  ARG 145          HH22      ARG 145 -10.125 -25.633  13.976
 1195    H    ARG 146           H        ARG 146  -4.692 -19.438  11.508
 1196    HA   ARG 146           HA       ARG 146  -2.449 -20.986  12.326
 1197    HB2  ARG 146           HB2      ARG 146  -3.012 -19.153   9.944
 1198    HB3  ARG 146           HB3      ARG 146  -1.373 -19.704  10.300
 1199    HG2  ARG 146           HG2      ARG 146  -2.069 -21.270   8.795
 1200    HG3  ARG 146           HG3      ARG 146  -2.173 -22.061  10.366
 1201    HD2  ARG 146           HD2      ARG 146  -4.673 -21.596  10.304
 1202    HD3  ARG 146           HD3      ARG 146  -4.445 -21.021   8.648
 1203    HE   ARG 146           HE       ARG 146  -4.048 -23.789   9.696
 1204   HH11  ARG 146          HH11      ARG 146  -4.734 -21.802   6.830
 1205   HH12  ARG 146          HH12      ARG 146  -4.200 -22.997   5.704
 1206   HH21  ARG 146          HH21      ARG 146  -3.647 -25.476   8.186
 1207   HH22  ARG 146          HH22      ARG 146  -3.769 -25.181   6.492
 1208    H    VAL 147           H        VAL 147  -2.734 -17.389  12.055
 1209    HA   VAL 147           HA       VAL 147  -0.148 -16.746  12.836
 1210    HB   VAL 147           HB       VAL 147  -2.835 -15.359  13.183
 1211   HG11  VAL 147          HG11      VAL 147  -1.379 -14.368  14.909
 1212   HG12  VAL 147          HG12      VAL 147  -0.101 -14.119  13.690
 1213   HG13  VAL 147          HG13      VAL 147  -1.651 -13.240  13.580
 1214   HG21  VAL 147          HG21      VAL 147  -1.836 -15.732  10.861
 1215   HG22  VAL 147          HG22      VAL 147  -2.129 -14.045  11.295
 1216   HG23  VAL 147          HG23      VAL 147  -0.481 -14.721  11.371
 1217    H    MET 148           H        MET 148  -2.981 -17.572  14.827
 1218    HA   MET 148           HA       MET 148  -1.857 -16.843  17.355
 1219    HB2  MET 148           HB2      MET 148  -4.200 -18.641  16.644
 1220    HB3  MET 148           HB3      MET 148  -3.709 -18.308  18.309
 1221    HG2  MET 148           HG2      MET 148  -4.574 -16.164  16.338
 1222    HG3  MET 148           HG3      MET 148  -5.628 -16.964  17.488
 1223    HE1  MET 148           HE1      MET 148  -3.566 -14.178  16.590
 1224    HE2  MET 148           HE2      MET 148  -3.180 -13.306  18.075
 1225    HE3  MET 148           HE3      MET 148  -2.135 -14.649  17.542
 1226    H    LYS 149           H        LYS 149  -2.316 -20.028  15.721
 1227    HA   LYS 149           HA       LYS 149  -0.827 -21.554  17.638
 1228    HB2  LYS 149           HB2      LYS 149  -2.402 -22.558  16.285
 1229    HB3  LYS 149           HB3      LYS 149  -1.639 -22.022  14.777
 1230    HG2  LYS 149           HG2      LYS 149  -0.228 -23.866  16.733
 1231    HG3  LYS 149           HG3      LYS 149  -1.381 -24.498  15.556
 1232    HD2  LYS 149           HD2      LYS 149   0.021 -24.253  13.786
 1233    HD3  LYS 149           HD3      LYS 149   0.515 -22.645  14.300
 1234    HE2  LYS 149           HE2      LYS 149   2.479 -23.891  14.386
 1235    HE3  LYS 149           HE3      LYS 149   1.951 -23.657  16.062
 1236    HZ1  LYS 149           HZ1      LYS 149   2.687 -25.949  15.653
 1237    HZ2  LYS 149           HZ2      LYS 149   1.098 -25.963  16.030
 1238    HZ3  LYS 149           HZ3      LYS 149   1.578 -26.158  14.475
 1239    H    GLU 150           H        GLU 150   0.349 -19.647  14.814
 1240    HA   GLU 150           HA       GLU 150   2.900 -20.614  14.830
 1241    HB2  GLU 150           HB2      GLU 150   1.662 -18.905  13.249
 1242    HB3  GLU 150           HB3      GLU 150   2.215 -17.688  14.380
 1243    HG2  GLU 150           HG2      GLU 150   4.223 -17.663  13.422
 1244    HG3  GLU 150           HG3      GLU 150   4.493 -19.297  13.962
 1245    H    PHE 151           H        PHE 151   1.407 -18.337  17.073
 1246    HA   PHE 151           HA       PHE 151   4.020 -17.881  18.451
 1247    HB2  PHE 151           HB2      PHE 151   1.420 -16.345  18.692
 1248    HB3  PHE 151           HB3      PHE 151   2.981 -15.900  19.347
 1249    HD1  PHE 151           HD1      PHE 151   4.830 -16.352  16.887
 1250    HD2  PHE 151           HD2      PHE 151   0.909 -14.510  17.292
 1251    HE1  PHE 151           HE1      PHE 151   5.101 -15.222  14.802
 1252    HE2  PHE 151           HE2      PHE 151   1.361 -13.189  15.270
 1253    HZ   PHE 151           HZ       PHE 151   3.451 -13.596  13.980
 1254    H    ALA 152           H        ALA 152   1.057 -19.594  18.847
 1255    HA   ALA 152           HA       ALA 152   0.354 -19.243  21.467
 1256    HB1  ALA 152           HB1      ALA 152  -0.955 -20.583  19.830
 1257    HB2  ALA 152           HB2      ALA 152   0.309 -21.827  19.815
 1258    HB3  ALA 152           HB3      ALA 152  -0.642 -21.536  21.288
 1259    H    SER 153           H        SER 153   2.875 -21.367  20.194
 1260    HA   SER 153           HA       SER 153   3.403 -22.772  22.627
 1261    HB2  SER 153           HB2      SER 153   5.273 -22.310  20.273
 1262    HB3  SER 153           HB3      SER 153   5.300 -23.680  21.399
 1263    HG   SER 153           HG       SER 153   3.381 -24.437  20.500
 1264    H    VAL 154           H        VAL 154   4.554 -19.711  21.283
 1265    HA   VAL 154           HA       VAL 154   6.766 -19.409  23.149
 1266    HB   VAL 154           HB       VAL 154   5.267 -17.257  21.606
 1267   HG11  VAL 154          HG11      VAL 154   6.663 -16.377  23.487
 1268   HG12  VAL 154          HG12      VAL 154   8.067 -17.237  22.814
 1269   HG13  VAL 154          HG13      VAL 154   7.307 -15.922  21.894
 1270   HG21  VAL 154          HG21      VAL 154   6.080 -18.770  19.934
 1271   HG22  VAL 154          HG22      VAL 154   7.274 -17.479  20.005
 1272   HG23  VAL 154          HG23      VAL 154   7.617 -19.020  20.804
 1273    H    VAL 155           H        VAL 155   3.309 -18.397  22.996
 1274    HA   VAL 155           HA       VAL 155   3.477 -16.721  25.238
 1275    HB   VAL 155           HB       VAL 155   1.047 -18.376  24.539
 1276   HG11  VAL 155          HG11      VAL 155   0.014 -16.109  25.516
 1277   HG12  VAL 155          HG12      VAL 155   0.718 -17.291  26.642
 1278   HG13  VAL 155          HG13      VAL 155   1.645 -15.854  26.174
 1279   HG21  VAL 155          HG21      VAL 155   1.841 -15.643  23.451
 1280   HG22  VAL 155          HG22      VAL 155   1.728 -17.145  22.502
 1281   HG23  VAL 155          HG23      VAL 155   0.263 -16.455  23.182
 1282    H    MET 156           H        MET 156   2.889 -20.306  25.098
 1283    HA   MET 156           HA       MET 156   2.109 -20.573  27.699
 1284    HB2  MET 156           HB2      MET 156   4.008 -22.446  26.158
 1285    HB3  MET 156           HB3      MET 156   3.025 -22.935  27.547
 1286    HG2  MET 156           HG2      MET 156   2.026 -22.105  24.815
 1287    HG3  MET 156           HG3      MET 156   1.976 -23.715  25.503
 1288    HE1  MET 156           HE1      MET 156  -0.288 -21.118  24.372
 1289    HE2  MET 156           HE2      MET 156  -0.467 -22.875  24.139
 1290    HE3  MET 156           HE3      MET 156  -1.716 -21.960  25.013
 1291    H    SER 157           H        SER 157   5.391 -20.759  26.381
 1292    HA   SER 157           HA       SER 157   6.717 -21.072  28.882
 1293    HB2  SER 157           HB2      SER 157   7.422 -20.541  25.997
 1294    HB3  SER 157           HB3      SER 157   8.712 -20.641  27.255
 1295    HG   SER 157           HG       SER 157   8.306 -22.679  26.245
 1296    H    LEU 158           H        LEU 158   5.789 -18.245  26.961
 1297    HA   LEU 158           HA       LEU 158   7.338 -16.287  28.288
 1298    HB2  LEU 158           HB2      LEU 158   6.077 -15.960  26.147
 1299    HB3  LEU 158           HB3      LEU 158   4.558 -16.192  27.009
 1300    HG   LEU 158           HG       LEU 158   4.929 -14.173  28.355
 1301   HD11  LEU 158          HD11      LEU 158   7.374 -13.930  26.565
 1302   HD12  LEU 158          HD12      LEU 158   6.684 -12.582  27.527
 1303   HD13  LEU 158          HD13      LEU 158   7.300 -14.021  28.335
 1304   HD21  LEU 158          HD21      LEU 158   3.439 -14.026  26.627
 1305   HD22  LEU 158          HD22      LEU 158   4.551 -12.682  26.217
 1306   HD23  LEU 158          HD23      LEU 158   4.675 -14.218  25.350
 1307    H    GLN 159           H        GLN 159   4.130 -17.693  29.013
 1308    HA   GLN 159           HA       GLN 159   3.625 -16.142  31.370
 1309    HB2  GLN 159           HB2      GLN 159   2.762 -19.039  31.010
 1310    HB3  GLN 159           HB3      GLN 159   2.073 -17.824  32.065
 1311    HG2  GLN 159           HG2      GLN 159   1.383 -16.546  29.901
 1312    HG3  GLN 159           HG3      GLN 159   1.844 -18.021  29.055
 1313   HE21  GLN 159          HE22      GLN 159  -0.125 -17.274  32.007
 1314   HE22  GLN 159          HE21      GLN 159  -1.366 -18.471  31.628
 1315    H    GLU 160           H        GLU 160   5.356 -19.250  30.930
 1316    HA   GLU 160           HA       GLU 160   5.597 -19.814  33.670
 1317    HB2  GLU 160           HB2      GLU 160   7.171 -20.788  31.245
 1318    HB3  GLU 160           HB3      GLU 160   7.413 -21.436  32.872
 1319    HG2  GLU 160           HG2      GLU 160   5.006 -22.005  33.027
 1320    HG3  GLU 160           HG3      GLU 160   4.777 -21.434  31.381
 1321    H    ASN 161           H        ASN 161   7.589 -17.759  31.642
 1322    HA   ASN 161           HA       ASN 161   9.968 -18.083  33.353
 1323    HB2  ASN 161           HB2      ASN 161   9.321 -16.743  30.721
 1324    HB3  ASN 161           HB3      ASN 161  10.730 -16.226  31.631
 1325   HD21  ASN 161          HD22      ASN 161   9.241 -19.160  30.159
 1326   HD22  ASN 161          HD21      ASN 161  10.754 -20.038  30.007
 1327    H    THR 162           H        THR 162   7.177 -16.021  33.264
 1328    HA   THR 162           HA       THR 162   6.798 -13.835  33.542
 1329    HB   THR 162           HB       THR 162   6.796 -13.453  35.860
 1330    HG1  THR 162           HG1      THR 162   8.927 -14.165  36.459
 1331   HG21  THR 162          HG21      THR 162   5.296 -15.165  34.923
 1332   HG22  THR 162          HG22      THR 162   6.460 -16.423  35.388
 1333   HG23  THR 162          HG23      THR 162   5.655 -15.447  36.636
 1334    HA   PRO 163           HA       PRO 163  11.184 -12.956  32.765
 1335    HB2  PRO 163           HB2      PRO 163  11.240 -11.891  30.232
 1336    HB3  PRO 163           HB3      PRO 163  11.222 -13.645  30.606
 1337    HG2  PRO 163           HG2      PRO 163   8.864 -11.863  29.913
 1338    HG3  PRO 163           HG3      PRO 163   9.272 -13.491  29.271
 1339    HD2  PRO 163           HD2      PRO 163   7.476 -13.071  31.323
 1340    HD3  PRO 163           HD3      PRO 163   8.473 -14.552  31.199
 1341    H    LYS 164           H        LYS 164  12.369 -10.742  32.171
 1342    HA   LYS 164           HA       LYS 164  10.859  -8.736  33.700
 1343    HB2  LYS 164           HB2      LYS 164  13.829  -8.824  33.102
 1344    HB3  LYS 164           HB3      LYS 164  12.954  -7.769  34.231
 1345    HG2  LYS 164           HG2      LYS 164  12.064 -10.046  35.248
 1346    HG3  LYS 164           HG3      LYS 164  13.419 -10.775  34.372
 1347    HD2  LYS 164           HD2      LYS 164  14.954  -9.170  35.560
 1348    HD3  LYS 164           HD3      LYS 164  13.533  -8.531  36.428
 1349    HE2  LYS 164           HE2      LYS 164  13.112 -10.785  37.395
 1350    HE3  LYS 164           HE3      LYS 164  14.508 -11.432  36.526
 1351    HZ1  LYS 164           HZ1      LYS 164  15.932  -9.947  37.825
 1352    HZ2  LYS 164           HZ2      LYS 164  14.641  -9.342  38.634
 1353    HZ3  LYS 164           HZ3      LYS 164  15.064 -10.908  38.818
  Start of MODEL   21
    1    H1   MET   1           H1       MET   1  -0.626   0.612   0.094
    2    H2   MET   1           H2       MET   1   0.343  -0.221   1.110
    3    H3   MET   1           H3       MET   1   0.693   1.341   0.724
    4    HA   MET   1           HA       MET   1   1.059   0.761  -1.579
    5    HB2  MET   1           HB2      MET   1   3.242  -0.061  -1.385
    6    HB3  MET   1           HB3      MET   1   2.968   0.707   0.161
    7    HG2  MET   1           HG2      MET   1   4.116  -1.251   0.659
    8    HG3  MET   1           HG3      MET   1   2.461  -1.609   1.111
    9    HE1  MET   1           HE1      MET   1   5.558  -2.537  -1.035
   10    HE2  MET   1           HE2      MET   1   4.904  -3.606  -2.293
   11    HE3  MET   1           HE3      MET   1   4.569  -1.863  -2.355
   12    H    ILE   2           H        ILE   2   1.307  -0.905  -3.235
   13    HA   ILE   2           HA       ILE   2   0.581  -3.667  -2.594
   14    HB   ILE   2           HB       ILE   2  -0.801  -2.142  -4.837
   15   HG12  ILE   2          HG12      ILE   2  -1.651  -3.052  -2.089
   16   HG13  ILE   2          HG13      ILE   2  -2.042  -1.549  -2.929
   17   HG21  ILE   2          HG21      ILE   2  -0.180  -4.510  -5.418
   18   HG22  ILE   2          HG22      ILE   2  -1.112  -5.051  -3.995
   19   HG23  ILE   2          HG23      ILE   2  -1.913  -4.243  -5.361
   20   HD11  ILE   2          HD11      ILE   2  -3.615  -2.969  -4.356
   21   HD12  ILE   2          HD12      ILE   2  -3.218  -4.310  -3.212
   22   HD13  ILE   2          HD13      ILE   2  -4.011  -2.835  -2.625
   23    H    ASP   3           H        ASP   3   1.867  -5.027  -3.950
   24    HA   ASP   3           HA       ASP   3   4.334  -3.867  -4.586
   25    HB2  ASP   3           HB2      ASP   3   4.093  -6.177  -3.827
   26    HB3  ASP   3           HB3      ASP   3   3.305  -6.585  -5.365
   27    H    ASP   4           H        ASP   4   2.328  -5.674  -6.928
   28    HA   ASP   4           HA       ASP   4   2.551  -3.636  -8.930
   29    HB2  ASP   4           HB2      ASP   4   4.805  -4.579  -9.161
   30    HB3  ASP   4           HB3      ASP   4   4.126  -6.201  -9.267
   31    H    ASP   5           H        ASP   5   2.128  -7.151  -8.583
   32    HA   ASP   5           HA       ASP   5   0.201  -7.210 -10.733
   33    HB2  ASP   5           HB2      ASP   5   2.098  -8.797 -10.546
   34    HB3  ASP   5           HB3      ASP   5   1.335  -9.507  -9.123
   35    H    GLY   6           H        GLY   6  -0.452  -6.097  -8.002
   36    HA2  GLY   6           HA2      GLY   6  -2.474  -5.823  -6.916
   37    HA3  GLY   6           HA3      GLY   6  -3.139  -7.275  -7.669
   38    H    TYR   7           H        TYR   7  -0.147  -8.154  -6.476
   39    HA   TYR   7           HA       TYR   7  -1.206  -9.145  -3.909
   40    HB2  TYR   7           HB2      TYR   7   1.356  -9.761  -5.418
   41    HB3  TYR   7           HB3      TYR   7   1.002 -10.346  -3.799
   42    HD1  TYR   7           HD1      TYR   7  -0.813 -11.961  -3.354
   43    HD2  TYR   7           HD2      TYR   7   0.230 -10.763  -7.372
   44    HE1  TYR   7           HE1      TYR   7  -2.022 -13.921  -4.255
   45    HE2  TYR   7           HE2      TYR   7  -0.986 -12.706  -8.278
   46    HH   TYR   7           HH       TYR   7  -2.248 -14.607  -7.788
   47    H    ARG   8           H        ARG   8   0.139  -8.830  -1.967
   48    HA   ARG   8           HA       ARG   8   1.610  -6.242  -1.822
   49    HB2  ARG   8           HB2      ARG   8  -0.666  -5.521  -1.774
   50    HB3  ARG   8           HB3      ARG   8  -1.181  -6.931  -0.859
   51    HG2  ARG   8           HG2      ARG   8  -0.068  -6.038   1.186
   52    HG3  ARG   8           HG3      ARG   8   0.380  -4.577   0.272
   53    HD2  ARG   8           HD2      ARG   8  -1.982  -4.139  -0.212
   54    HD3  ARG   8           HD3      ARG   8  -2.475  -5.662   0.556
   55    HE   ARG   8           HE       ARG   8  -1.192  -4.528   2.615
   56   HH11  ARG   8          HH21      ARG   8  -3.778  -3.221   0.527
   57   HH12  ARG   8          HH22      ARG   8  -4.413  -2.190   1.754
   58   HH21  ARG   8          HH11      ARG   8  -2.023  -3.161   4.199
   59   HH22  ARG   8          HH12      ARG   8  -3.395  -2.153   3.893
   60    HA   PRO   9           HA       PRO   9   3.113  -9.001   1.489
   61    HB2  PRO   9           HB2      PRO   9   5.238  -6.944   1.832
   62    HB3  PRO   9           HB3      PRO   9   5.410  -8.711   1.589
   63    HG2  PRO   9           HG2      PRO   9   6.030  -6.940  -0.360
   64    HG3  PRO   9           HG3      PRO   9   5.129  -8.444  -0.770
   65    HD2  PRO   9           HD2      PRO   9   4.000  -5.675  -0.190
   66    HD3  PRO   9           HD3      PRO   9   3.702  -6.717  -1.622
   67    H    ASN  10           H        ASN  10   2.397  -8.911   3.638
   68    HA   ASN  10           HA       ASN  10   1.900  -6.234   4.856
   69    HB2  ASN  10           HB2      ASN  10  -0.058  -7.855   3.686
   70    HB3  ASN  10           HB3      ASN  10  -0.127  -8.352   5.360
   71   HD21  ASN  10          HD22      ASN  10  -1.320  -6.960   6.783
   72   HD22  ASN  10          HD21      ASN  10  -2.000  -5.443   6.218
   73    H    VAL  11           H        VAL  11   1.781  -6.323   7.264
   74    HA   VAL  11           HA       VAL  11   2.763  -8.844   8.427
   75    HB   VAL  11           HB       VAL  11   4.369  -7.622   9.856
   76   HG11  VAL  11          HG11      VAL  11   6.130  -7.303   8.113
   77   HG12  VAL  11          HG12      VAL  11   5.358  -8.870   8.308
   78   HG13  VAL  11          HG13      VAL  11   4.889  -7.841   6.951
   79   HG21  VAL  11          HG21      VAL  11   5.248  -5.454   9.119
   80   HG22  VAL  11          HG22      VAL  11   4.004  -5.317   7.873
   81   HG23  VAL  11          HG23      VAL  11   3.554  -5.280   9.597
   82    H    GLY  12           H        GLY  12   1.841  -9.280  10.388
   83    HA2  GLY  12           HA2      GLY  12  -0.060  -7.260  11.500
   84    HA3  GLY  12           HA3      GLY  12  -0.435  -8.969  11.336
   85    H    ILE  13           H        ILE  13  -0.394  -7.383  13.795
   86    HA   ILE  13           HA       ILE  13   1.832  -8.627  15.279
   87    HB   ILE  13           HB       ILE  13   0.534  -5.916  15.857
   88   HG12  ILE  13          HG12      ILE  13   3.096  -5.268  15.214
   89   HG13  ILE  13          HG13      ILE  13   2.879  -6.617  14.096
   90   HG21  ILE  13          HG21      ILE  13   1.440  -7.014  17.795
   91   HG22  ILE  13          HG22      ILE  13   2.923  -7.475  16.915
   92   HG23  ILE  13          HG23      ILE  13   2.607  -5.787  17.341
   93   HD11  ILE  13          HD11      ILE  13   1.160  -4.097  14.265
   94   HD12  ILE  13          HD12      ILE  13   2.406  -4.449  13.045
   95   HD13  ILE  13          HD13      ILE  13   0.923  -5.420  13.097
   96    H    VAL  14           H        VAL  14   1.295  -9.598  17.142
   97    HA   VAL  14           HA       VAL  14  -1.506  -9.459  18.177
   98    HB   VAL  14           HB       VAL  14   0.460 -11.792  18.357
   99   HG11  VAL  14          HG11      VAL  14  -1.502 -13.081  19.091
  100   HG12  VAL  14          HG12      VAL  14  -1.204 -11.724  20.172
  101   HG13  VAL  14          HG13      VAL  14  -2.516 -11.613  18.970
  102   HG21  VAL  14          HG21      VAL  14  -0.957 -12.974  16.726
  103   HG22  VAL  14          HG22      VAL  14  -1.839 -11.460  16.393
  104   HG23  VAL  14          HG23      VAL  14  -0.102 -11.619  16.006
  105    H    ILE  15           H        ILE  15  -1.538  -9.079  20.506
  106    HA   ILE  15           HA       ILE  15   1.129  -8.991  21.766
  107    HB   ILE  15           HB       ILE  15  -1.106  -7.188  22.699
  108   HG12  ILE  15          HG12      ILE  15  -0.457  -6.405  20.434
  109   HG13  ILE  15          HG13      ILE  15  -0.043  -5.280  21.721
  110   HG21  ILE  15          HG21      ILE  15   0.781  -6.113  23.901
  111   HG22  ILE  15          HG22      ILE  15   0.550  -7.781  24.394
  112   HG23  ILE  15          HG23      ILE  15   1.882  -7.363  23.294
  113   HD11  ILE  15          HD11      ILE  15   2.309  -5.891  21.620
  114   HD12  ILE  15          HD12      ILE  15   1.962  -7.188  20.453
  115   HD13  ILE  15          HD13      ILE  15   1.740  -5.491  19.988
  116    H    CYS  16           H        CYS  16   1.266 -10.147  23.770
  117    HA   CYS  16           HA       CYS  16  -1.320 -11.156  24.861
  118    HB2  CYS  16           HB2      CYS  16  -0.202 -13.276  25.492
  119    HB3  CYS  16           HB3      CYS  16  -0.233 -13.034  23.733
  120    HG   CYS  16           HG       CYS  16   2.113 -14.064  24.440
  121    H    ASN  17           H        ASN  17  -1.291 -11.749  27.126
  122    HA   ASN  17           HA       ASN  17   0.691 -10.233  28.752
  123    HB2  ASN  17           HB2      ASN  17  -1.035  -9.503  30.253
  124    HB3  ASN  17           HB3      ASN  17  -1.453  -9.011  28.633
  125   HD21  ASN  17          HD22      ASN  17  -3.618  -8.751  29.864
  126   HD22  ASN  17          HD21      ASN  17  -4.647 -10.160  29.947
  127    H    ARG  18           H        ARG  18   0.500 -11.181  31.219
  128    HA   ARG  18           HA       ARG  18   1.058 -14.017  30.838
  129    HB2  ARG  18           HB2      ARG  18   1.208 -12.418  33.431
  130    HB3  ARG  18           HB3      ARG  18   1.693 -14.099  33.215
  131    HG2  ARG  18           HG2      ARG  18   3.731 -13.300  32.798
  132    HG3  ARG  18           HG3      ARG  18   3.082 -13.038  31.167
  133    HD2  ARG  18           HD2      ARG  18   2.447 -10.720  31.866
  134    HD3  ARG  18           HD3      ARG  18   3.217 -10.979  33.432
  135    HE   ARG  18           HE       ARG  18   4.494 -10.686  30.768
  136   HH11  ARG  18          HH11      ARG  18   5.135 -11.068  34.269
  137   HH12  ARG  18          HH12      ARG  18   6.859 -10.922  34.037
  138   HH21  ARG  18          HH21      ARG  18   6.626 -10.412  30.544
  139   HH22  ARG  18          HH22      ARG  18   7.731 -10.319  31.882
  140    H    GLN  19           H        GLN  19  -1.825 -12.665  30.942
  141    HA   GLN  19           HA       GLN  19  -3.087 -14.568  32.791
  142    HB2  GLN  19           HB2      GLN  19  -4.582 -12.527  31.131
  143    HB3  GLN  19           HB3      GLN  19  -5.089 -13.300  32.623
  144    HG2  GLN  19           HG2      GLN  19  -2.959 -11.160  32.285
  145    HG3  GLN  19           HG3      GLN  19  -4.561 -10.933  32.945
  146   HE21  GLN  19          HE22      GLN  19  -2.214 -10.162  34.391
  147   HE22  GLN  19          HE21      GLN  19  -2.076 -11.189  35.797
  148    H    GLY  20           H        GLY  20  -2.039 -14.525  29.560
  149    HA2  GLY  20           HA2      GLY  20  -2.518 -15.999  27.847
  150    HA3  GLY  20           HA3      GLY  20  -3.730 -16.801  28.851
  151    H    GLN  21           H        GLN  21  -3.679 -13.231  28.240
  152    HA   GLN  21           HA       GLN  21  -6.011 -13.584  26.411
  153    HB2  GLN  21           HB2      GLN  21  -5.303 -11.196  28.135
  154    HB3  GLN  21           HB3      GLN  21  -6.680 -11.310  27.046
  155    HG2  GLN  21           HG2      GLN  21  -6.270 -13.095  29.492
  156    HG3  GLN  21           HG3      GLN  21  -7.217 -11.616  29.481
  157   HE21  GLN  21          HE22      GLN  21  -7.104 -14.963  28.126
  158   HE22  GLN  21          HE21      GLN  21  -8.812 -14.994  27.719
  159    H    VAL  22           H        VAL  22  -6.009 -12.198  24.592
  160    HA   VAL  22           HA       VAL  22  -3.381 -11.123  23.822
  161    HB   VAL  22           HB       VAL  22  -3.810 -11.689  21.525
  162   HG11  VAL  22          HG11      VAL  22  -2.733 -13.387  22.987
  163   HG12  VAL  22          HG12      VAL  22  -4.316 -14.152  23.252
  164   HG13  VAL  22          HG13      VAL  22  -3.608 -14.114  21.621
  165   HG21  VAL  22          HG21      VAL  22  -6.489 -12.872  22.404
  166   HG22  VAL  22          HG22      VAL  22  -6.227 -11.475  21.334
  167   HG23  VAL  22          HG23      VAL  22  -5.736 -13.091  20.808
  168    H    MET  23           H        MET  23  -3.457  -9.132  22.610
  169    HA   MET  23           HA       MET  23  -5.849  -7.524  23.257
  170    HB2  MET  23           HB2      MET  23  -3.418  -6.778  23.571
  171    HB3  MET  23           HB3      MET  23  -3.359  -6.544  21.830
  172    HG2  MET  23           HG2      MET  23  -5.564  -5.337  23.544
  173    HG3  MET  23           HG3      MET  23  -3.996  -4.556  23.424
  174    HE1  MET  23           HE1      MET  23  -3.757  -3.202  19.906
  175    HE2  MET  23           HE2      MET  23  -3.042  -3.370  21.536
  176    HE3  MET  23           HE3      MET  23  -3.083  -4.760  20.436
  177    H    TRP  24           H        TRP  24  -7.204  -6.593  21.705
  178    HA   TRP  24           HA       TRP  24  -6.916  -7.403  18.882
  179    HB2  TRP  24           HB2      TRP  24  -8.128  -9.125  20.353
  180    HB3  TRP  24           HB3      TRP  24  -9.390  -7.925  20.574
  181    HD1  TRP  24           HD1      TRP  24  -7.650  -8.950  17.256
  182    HE1  TRP  24           HE1      TRP  24  -9.367 -10.038  15.710
  183    HE3  TRP  24           HE3      TRP  24 -11.630  -9.047  20.439
  184    HZ2  TRP  24           HZ2      TRP  24 -12.167 -10.774  15.798
  185    HZ3  TRP  24           HZ3      TRP  24 -13.813  -9.976  19.691
  186    HH2  TRP  24           HH2      TRP  24 -14.086 -10.791  17.371
  187    H    ALA  25           H        ALA  25  -8.017  -5.694  17.518
  188    HA   ALA  25           HA       ALA  25  -9.099  -3.384  19.080
  189    HB1  ALA  25           HB1      ALA  25  -6.867  -3.275  17.020
  190    HB2  ALA  25           HB2      ALA  25  -7.639  -1.871  17.789
  191    HB3  ALA  25           HB3      ALA  25  -6.693  -2.992  18.767
  192    H    ARG  26           H        ARG  26 -10.210  -1.775  17.757
  193    HA   ARG  26           HA       ARG  26 -11.661  -2.994  15.441
  194    HB2  ARG  26           HB2      ARG  26 -13.359  -3.278  16.894
  195    HB3  ARG  26           HB3      ARG  26 -12.624  -2.257  18.124
  196    HG2  ARG  26           HG2      ARG  26 -13.512  -0.246  17.092
  197    HG3  ARG  26           HG3      ARG  26 -14.259  -1.216  15.800
  198    HD2  ARG  26           HD2      ARG  26 -15.733  -2.292  17.388
  199    HD3  ARG  26           HD3      ARG  26 -14.867  -1.567  18.758
  200    HE   ARG  26           HE       ARG  26 -15.550   0.676  17.551
  201   HH11  ARG  26          HH11      ARG  26 -17.679  -2.112  18.248
  202   HH12  ARG  26          HH12      ARG  26 -19.067  -1.112  18.470
  203   HH21  ARG  26          HH21      ARG  26 -17.231   1.896  17.811
  204   HH22  ARG  26          HH22      ARG  26 -18.837   1.293  18.188
  205    H    ARG  27           H        ARG  27 -12.360  -1.452  13.848
  206    HA   ARG  27           HA       ARG  27 -11.359   1.338  14.274
  207    HB2  ARG  27           HB2      ARG  27 -10.093  -0.019  12.572
  208    HB3  ARG  27           HB3      ARG  27 -11.560  -0.095  11.601
  209    HG2  ARG  27           HG2      ARG  27 -11.550   2.340  11.307
  210    HG3  ARG  27           HG3      ARG  27 -10.189   2.499  12.441
  211    HD2  ARG  27           HD2      ARG  27  -8.783   1.151  10.873
  212    HD3  ARG  27           HD3      ARG  27 -10.141   1.069   9.751
  213    HE   ARG  27           HE       ARG  27 -10.064   3.454   9.443
  214   HH11  ARG  27          HH11      ARG  27  -7.219   2.255  11.254
  215   HH12  ARG  27          HH12      ARG  27  -6.142   3.426  10.531
  216   HH21  ARG  27          HH21      ARG  27  -8.646   5.230   8.886
  217   HH22  ARG  27          HH22      ARG  27  -7.048   5.285   9.593
  218    H    PHE  28           H        PHE  28 -12.634   2.939  12.866
  219    HA   PHE  28           HA       PHE  28 -15.392   2.757  13.796
  220    HB2  PHE  28           HB2      PHE  28 -15.584   5.060  13.020
  221    HB3  PHE  28           HB3      PHE  28 -14.228   4.860  14.099
  222    HD1  PHE  28           HD1      PHE  28 -15.132   5.187  10.465
  223    HD2  PHE  28           HD2      PHE  28 -12.073   5.654  13.480
  224    HE1  PHE  28           HE1      PHE  28 -13.703   6.372   8.829
  225    HE2  PHE  28           HE2      PHE  28 -10.674   6.881  11.844
  226    HZ   PHE  28           HZ       PHE  28 -11.465   7.222   9.517
  227    H    GLY  29           H        GLY  29 -17.202   2.942  12.393
  228    HA2  GLY  29           HA2      GLY  29 -18.446   2.722  10.464
  229    HA3  GLY  29           HA3      GLY  29 -16.968   2.690   9.490
  230    H    GLN  30           H        GLN  30 -15.526   0.598  10.341
  231    HA   GLN  30           HA       GLN  30 -17.008  -1.657   9.404
  232    HB2  GLN  30           HB2      GLN  30 -15.004  -2.839   9.429
  233    HB3  GLN  30           HB3      GLN  30 -14.569  -1.163   9.067
  234    HG2  GLN  30           HG2      GLN  30 -13.739  -0.864  11.339
  235    HG3  GLN  30           HG3      GLN  30 -14.187  -2.525  11.756
  236   HE21  GLN  30          HE22      GLN  30 -12.414  -0.982   8.944
  237   HE22  GLN  30          HE21      GLN  30 -11.063  -2.077   9.030
  238    H    HIS  31           H        HIS  31 -15.846  -0.714  12.622
  239    HA   HIS  31           HA       HIS  31 -16.228  -1.366  14.694
  240    HB2  HIS  31           HB2      HIS  31 -19.023  -1.986  13.738
  241    HB3  HIS  31           HB3      HIS  31 -18.526  -1.670  15.398
  242    HD1  HIS  31           HD1      HIS  31 -20.427   0.163  13.164
  243    HD2  HIS  31           HD2      HIS  31 -16.729   0.944  15.022
  244    HE1  HIS  31           HE1      HIS  31 -20.135   2.692  13.150
  245    H    SER  32           H        SER  32 -15.947  -3.777  12.468
  246    HA   SER  32           HA       SER  32 -16.223  -6.079  14.216
  247    HB2  SER  32           HB2      SER  32 -14.873  -7.048  12.189
  248    HB3  SER  32           HB3      SER  32 -16.561  -6.566  11.958
  249    HG   SER  32           HG       SER  32 -15.209  -5.761  10.282
  250    H    TRP  33           H        TRP  33 -14.155  -7.419  14.681
  251    HA   TRP  33           HA       TRP  33 -12.057  -5.498  15.586
  252    HB2  TRP  33           HB2      TRP  33 -13.108  -8.031  16.815
  253    HB3  TRP  33           HB3      TRP  33 -11.732  -7.100  17.417
  254    HD1  TRP  33           HD1      TRP  33 -15.560  -6.870  17.015
  255    HE1  TRP  33           HE1      TRP  33 -16.495  -5.182  18.677
  256    HE3  TRP  33           HE3      TRP  33 -11.153  -5.182  18.946
  257    HZ2  TRP  33           HZ2      TRP  33 -15.441  -3.316  20.656
  258    HZ3  TRP  33           HZ3      TRP  33 -11.134  -3.426  20.674
  259    HH2  TRP  33           HH2      TRP  33 -13.269  -2.481  21.553
  260    H    GLN  34           H        GLN  34  -9.892  -6.112  15.434
  261    HA   GLN  34           HA       GLN  34  -9.167  -8.505  13.893
  262    HB2  GLN  34           HB2      GLN  34  -7.992  -7.184  12.180
  263    HB3  GLN  34           HB3      GLN  34  -9.728  -6.906  12.127
  264    HG2  GLN  34           HG2      GLN  34  -9.490  -4.724  13.179
  265    HG3  GLN  34           HG3      GLN  34  -7.776  -5.004  13.507
  266   HE21  GLN  34          HE22      GLN  34 -10.119  -4.047  10.999
  267   HE22  GLN  34          HE21      GLN  34  -8.917  -3.778   9.757
  268    H    PHE  35           H        PHE  35  -6.850  -8.833  13.782
  269    HA   PHE  35           HA       PHE  35  -5.423  -7.863  16.156
  270    HB2  PHE  35           HB2      PHE  35  -4.579  -9.633  13.846
  271    HB3  PHE  35           HB3      PHE  35  -3.621  -9.333  15.295
  272    HD1  PHE  35           HD2      PHE  35  -5.227  -9.740  17.575
  273    HD2  PHE  35           HD1      PHE  35  -5.448 -11.827  13.785
  274    HE1  PHE  35           HE2      PHE  35  -6.365 -11.639  18.675
  275    HE2  PHE  35           HE1      PHE  35  -6.527 -13.746  14.934
  276    HZ   PHE  35           HZ       PHE  35  -7.021 -13.639  17.356
  277    HA   PRO  36           HA       PRO  36  -4.107  -4.207  13.961
  278    HB2  PRO  36           HB2      PRO  36  -1.550  -4.541  15.563
  279    HB3  PRO  36           HB3      PRO  36  -2.500  -3.050  15.277
  280    HG2  PRO  36           HG2      PRO  36  -2.747  -4.381  17.612
  281    HG3  PRO  36           HG3      PRO  36  -4.220  -3.772  16.783
  282    HD2  PRO  36           HD2      PRO  36  -3.108  -6.580  16.824
  283    HD3  PRO  36           HD3      PRO  36  -4.802  -6.015  16.959
  284    H    GLN  37           H        GLN  37  -2.902  -3.676  12.045
  285    HA   GLN  37           HA       GLN  37  -0.626  -5.275  11.243
  286    HB2  GLN  37           HB2      GLN  37  -1.694  -6.464   9.389
  287    HB3  GLN  37           HB3      GLN  37  -2.379  -6.963  10.921
  288    HG2  GLN  37           HG2      GLN  37  -4.287  -5.266  10.423
  289    HG3  GLN  37           HG3      GLN  37  -3.634  -5.221   8.782
  290   HE21  GLN  37          HE22      GLN  37  -5.172  -7.257  11.268
  291   HE22  GLN  37          HE21      GLN  37  -5.714  -8.514  10.155
  292    H    GLY  38           H        GLY  38   0.015  -4.859   8.906
  293    HA2  GLY  38           HA2      GLY  38  -1.183  -2.681   7.462
  294    HA3  GLY  38           HA3      GLY  38   0.220  -2.134   8.372
  295    H    GLY  39           H        GLY  39   0.476  -1.860   5.683
  296    HA2  GLY  39           HA2      GLY  39   1.484  -4.221   4.339
  297    HA3  GLY  39           HA3      GLY  39   1.409  -2.571   3.730
  298    H    ILE  40           H        ILE  40   3.571  -4.540   3.813
  299    HA   ILE  40           HA       ILE  40   5.714  -3.354   5.445
  300    HB   ILE  40           HB       ILE  40   5.790  -5.233   3.055
  301   HG12  ILE  40          HG12      ILE  40   5.886  -5.903   6.040
  302   HG13  ILE  40          HG13      ILE  40   4.534  -6.217   4.959
  303   HG21  ILE  40          HG21      ILE  40   8.063  -5.820   3.683
  304   HG22  ILE  40          HG22      ILE  40   7.956  -4.079   3.458
  305   HG23  ILE  40          HG23      ILE  40   7.996  -4.763   5.100
  306   HD11  ILE  40          HD11      ILE  40   6.414  -7.528   3.561
  307   HD12  ILE  40          HD12      ILE  40   7.080  -7.720   5.206
  308   HD13  ILE  40          HD13      ILE  40   5.421  -8.254   4.823
  309    H    ASN  41           H        ASN  41   6.493  -1.356   4.923
  310    HA   ASN  41           HA       ASN  41   5.615  -0.083   2.476
  311    HB2  ASN  41           HB2      ASN  41   7.570   0.944   4.595
  312    HB3  ASN  41           HB3      ASN  41   6.944   1.864   3.236
  313   HD21  ASN  41          HD22      ASN  41   6.057   0.159   6.199
  314   HD22  ASN  41          HD21      ASN  41   4.476   0.908   6.450
  315    HA   PRO  42           HA       PRO  42   8.428  -1.768  -0.219
  316    HB2  PRO  42           HB2      PRO  42   9.248   0.972  -1.228
  317    HB3  PRO  42           HB3      PRO  42   8.800  -0.486  -2.162
  318    HG2  PRO  42           HG2      PRO  42   6.988   1.489  -1.776
  319    HG3  PRO  42           HG3      PRO  42   6.483  -0.220  -1.594
  320    HD2  PRO  42           HD2      PRO  42   7.183   1.777   0.570
  321    HD3  PRO  42           HD3      PRO  42   5.841   0.598   0.504
  322    H    GLY  43           H        GLY  43  10.367  -2.700   0.255
  323    HA2  GLY  43           HA2      GLY  43  12.653  -2.857   0.532
  324    HA3  GLY  43           HA3      GLY  43  12.769  -1.126   0.839
  325    H    GLU  44           H        GLU  44  10.321  -2.058   2.956
  326    HA   GLU  44           HA       GLU  44  12.084  -2.233   5.236
  327    HB2  GLU  44           HB2      GLU  44   9.080  -2.570   4.864
  328    HB3  GLU  44           HB3      GLU  44   9.871  -2.979   6.385
  329    HG2  GLU  44           HG2      GLU  44  10.771  -0.775   6.616
  330    HG3  GLU  44           HG3      GLU  44  10.027  -0.257   5.084
  331    H    SER  45           H        SER  45  12.492  -4.038   6.575
  332    HA   SER  45           HA       SER  45  12.055  -6.710   5.384
  333    HB2  SER  45           HB2      SER  45  13.384  -7.370   7.488
  334    HB3  SER  45           HB3      SER  45  14.244  -6.488   6.219
  335    HG   SER  45           HG       SER  45  14.729  -5.570   8.217
  336    H    ALA  46           H        ALA  46  10.821  -8.281   6.754
  337    HA   ALA  46           HA       ALA  46   8.315  -7.204   7.281
  338    HB1  ALA  46           HB1      ALA  46   7.767  -9.437   8.204
  339    HB2  ALA  46           HB2      ALA  46   8.760  -9.562   6.737
  340    HB3  ALA  46           HB3      ALA  46   9.507  -9.800   8.348
  341    H    GLU  47           H        GLU  47  10.925  -7.852   9.600
  342    HA   GLU  47           HA       GLU  47   9.334  -7.407  11.955
  343    HB2  GLU  47           HB2      GLU  47  11.352  -8.786  11.774
  344    HB3  GLU  47           HB3      GLU  47  12.336  -7.343  11.460
  345    HG2  GLU  47           HG2      GLU  47  11.649  -6.456  13.714
  346    HG3  GLU  47           HG3      GLU  47  10.765  -7.963  13.987
  347    H    GLN  48           H        GLN  48  11.303  -5.277   9.817
  348    HA   GLN  48           HA       GLN  48  11.146  -3.043  11.640
  349    HB2  GLN  48           HB2      GLN  48  11.826  -3.101   8.696
  350    HB3  GLN  48           HB3      GLN  48  11.929  -1.671   9.739
  351    HG2  GLN  48           HG2      GLN  48  13.360  -4.292  10.221
  352    HG3  GLN  48           HG3      GLN  48  14.118  -2.864   9.503
  353   HE21  GLN  48          HE22      GLN  48  15.004  -4.335  11.791
  354   HE22  GLN  48          HE21      GLN  48  14.938  -3.281  13.189
  355    H    ALA  49           H        ALA  49   9.208  -4.271   8.891
  356    HA   ALA  49           HA       ALA  49   7.422  -2.029   8.785
  357    HB1  ALA  49           HB1      ALA  49   5.999  -3.612   7.539
  358    HB2  ALA  49           HB2      ALA  49   7.668  -3.496   6.919
  359    HB3  ALA  49           HB3      ALA  49   7.153  -4.920   7.890
  360    H    MET  50           H        MET  50   7.520  -5.079  10.684
  361    HA   MET  50           HA       MET  50   4.932  -4.853  11.827
  362    HB2  MET  50           HB2      MET  50   6.091  -6.886  12.084
  363    HB3  MET  50           HB3      MET  50   7.524  -6.143  12.768
  364    HG2  MET  50           HG2      MET  50   4.870  -5.980  14.145
  365    HG3  MET  50           HG3      MET  50   5.900  -7.392  14.321
  366    HE1  MET  50           HE1      MET  50   8.871  -6.256  16.386
  367    HE2  MET  50           HE2      MET  50   8.166  -7.479  15.308
  368    HE3  MET  50           HE3      MET  50   8.942  -6.022  14.633
  369    H    TYR  51           H        TYR  51   8.105  -3.488  12.989
  370    HA   TYR  51           HA       TYR  51   6.849  -2.081  15.116
  371    HB2  TYR  51           HB2      TYR  51   9.458  -1.520  13.656
  372    HB3  TYR  51           HB3      TYR  51   8.951  -0.722  15.135
  373    HD1  TYR  51           HD2      TYR  51   8.056  -2.551  17.034
  374    HD2  TYR  51           HD1      TYR  51  11.085  -3.187  14.021
  375    HE1  TYR  51           HE2      TYR  51   9.242  -4.114  18.541
  376    HE2  TYR  51           HE1      TYR  51  12.257  -4.760  15.521
  377    HH   TYR  51           HH       TYR  51  12.339  -5.706  17.670
  378    H    ARG  52           H        ARG  52   7.722  -0.864  11.768
  379    HA   ARG  52           HA       ARG  52   6.871   1.750  11.999
  380    HB2  ARG  52           HB2      ARG  52   7.974   0.616  10.059
  381    HB3  ARG  52           HB3      ARG  52   6.496  -0.275   9.739
  382    HG2  ARG  52           HG2      ARG  52   6.429   1.395   8.148
  383    HG3  ARG  52           HG3      ARG  52   5.328   1.989   9.376
  384    HD2  ARG  52           HD2      ARG  52   6.714   3.788   8.616
  385    HD3  ARG  52           HD3      ARG  52   7.224   3.353  10.295
  386    HE   ARG  52           HE       ARG  52   8.718   1.889   8.363
  387   HH11  ARG  52          HH11      ARG  52   8.509   5.241   9.552
  388   HH12  ARG  52          HH12      ARG  52  10.150   5.625   9.175
  389   HH21  ARG  52          HH21      ARG  52  10.871   2.372   7.887
  390   HH22  ARG  52          HH22      ARG  52  11.539   3.940   8.191
  391    H    GLU  53           H        GLU  53   4.860  -1.094  11.015
  392    HA   GLU  53           HA       GLU  53   2.580   0.565  10.718
  393    HB2  GLU  53           HB2      GLU  53   2.823  -2.445  10.745
  394    HB3  GLU  53           HB3      GLU  53   1.345  -1.552  10.370
  395    HG2  GLU  53           HG2      GLU  53   4.002  -1.212   8.934
  396    HG3  GLU  53           HG3      GLU  53   2.653  -2.174   8.328
  397    H    LEU  54           H        LEU  54   3.731  -1.612  13.359
  398    HA   LEU  54           HA       LEU  54   1.479  -1.490  15.026
  399    HB2  LEU  54           HB2      LEU  54   3.516  -2.875  15.445
  400    HB3  LEU  54           HB3      LEU  54   4.434  -1.403  15.787
  401    HG   LEU  54           HG       LEU  54   2.785  -0.964  17.697
  402   HD11  LEU  54          HD11      LEU  54   2.002  -3.821  16.977
  403   HD12  LEU  54          HD12      LEU  54   1.568  -3.030  18.506
  404   HD13  LEU  54          HD13      LEU  54   0.936  -2.440  16.952
  405   HD21  LEU  54          HD21      LEU  54   3.910  -2.551  19.194
  406   HD22  LEU  54          HD22      LEU  54   4.490  -3.481  17.786
  407   HD23  LEU  54          HD23      LEU  54   5.045  -1.817  18.066
  408    H    PHE  55           H        PHE  55   4.226   0.858  14.702
  409    HA   PHE  55           HA       PHE  55   3.338   2.580  16.765
  410    HB2  PHE  55           HB2      PHE  55   5.589   2.657  15.768
  411    HB3  PHE  55           HB3      PHE  55   4.915   3.241  14.250
  412    HD1  PHE  55           HD2      PHE  55   5.322   4.085  17.872
  413    HD2  PHE  55           HD1      PHE  55   4.439   5.574  13.920
  414    HE1  PHE  55           HE2      PHE  55   5.432   6.413  18.723
  415    HE2  PHE  55           HE1      PHE  55   4.560   7.899  14.767
  416    HZ   PHE  55           HZ       PHE  55   5.054   8.329  17.175
  417    H    GLU  56           H        GLU  56   2.430   2.480  13.271
  418    HA   GLU  56           HA       GLU  56   0.801   4.813  13.526
  419    HB2  GLU  56           HB2      GLU  56   1.041   2.692  11.368
  420    HB3  GLU  56           HB3      GLU  56  -0.068   4.071  11.273
  421    HG2  GLU  56           HG2      GLU  56   1.877   5.622  11.611
  422    HG3  GLU  56           HG3      GLU  56   2.968   4.235  11.585
  423    H    GLU  57           H        GLU  57   0.222   1.415  14.243
  424    HA   GLU  57           HA       GLU  57  -2.668   1.614  14.000
  425    HB2  GLU  57           HB2      GLU  57  -0.742  -0.498  15.042
  426    HB3  GLU  57           HB3      GLU  57  -2.479  -0.699  15.122
  427    HG2  GLU  57           HG2      GLU  57  -1.080  -0.216  12.475
  428    HG3  GLU  57           HG3      GLU  57  -1.233  -1.808  13.209
  429    H    VAL  58           H        VAL  58  -0.324   1.396  16.693
  430    HA   VAL  58           HA       VAL  58  -2.489   2.080  18.658
  431    HB   VAL  58           HB       VAL  58  -1.063   0.504  20.173
  432   HG11  VAL  58          HG11      VAL  58  -3.402   0.039  19.338
  433   HG12  VAL  58          HG12      VAL  58  -2.664  -0.865  17.998
  434   HG13  VAL  58          HG13      VAL  58  -2.390  -1.355  19.705
  435   HG21  VAL  58          HG21      VAL  58   0.105  -1.270  19.180
  436   HG22  VAL  58          HG22      VAL  58  -0.290  -0.708  17.529
  437   HG23  VAL  58          HG23      VAL  58   0.797   0.244  18.555
  438    H    GLY  59           H        GLY  59   0.287   3.411  17.334
  439    HA2  GLY  59           HA2      GLY  59   1.635   5.120  18.067
  440    HA3  GLY  59           HA3      GLY  59   0.730   5.153  19.581
  441    H    LEU  60           H        LEU  60   1.668   2.019  19.349
  442    HA   LEU  60           HA       LEU  60   3.582   2.270  21.432
  443    HB2  LEU  60           HB2      LEU  60   1.746   0.590  21.129
  444    HB3  LEU  60           HB3      LEU  60   2.671  -0.101  19.785
  445    HG   LEU  60           HG       LEU  60   4.436  -0.843  21.320
  446   HD11  LEU  60          HD11      LEU  60   2.661   0.366  23.482
  447   HD12  LEU  60          HD12      LEU  60   4.071  -0.696  23.746
  448   HD13  LEU  60          HD13      LEU  60   4.300   0.913  23.048
  449   HD21  LEU  60          HD21      LEU  60   1.523  -1.430  22.188
  450   HD22  LEU  60          HD22      LEU  60   2.376  -2.239  20.868
  451   HD23  LEU  60          HD23      LEU  60   2.924  -2.475  22.542
  452    H    SER  61           H        SER  61   5.747   1.800  21.414
  453    HA   SER  61           HA       SER  61   7.093   1.719  18.757
  454    HB2  SER  61           HB2      SER  61   8.790   3.208  19.911
  455    HB3  SER  61           HB3      SER  61   7.192   3.929  19.659
  456    HG   SER  61           HG       SER  61   7.920   4.324  21.786
  457    H    ARG  62           H        ARG  62   9.336   0.926  18.870
  458    HA   ARG  62           HA       ARG  62   9.627  -1.702  19.572
  459    HB2  ARG  62           HB2      ARG  62  11.882   0.361  19.573
  460    HB3  ARG  62           HB3      ARG  62  12.047  -1.391  19.433
  461    HG2  ARG  62           HG2      ARG  62  10.549  -1.206  17.359
  462    HG3  ARG  62           HG3      ARG  62  10.866   0.533  17.409
  463    HD2  ARG  62           HD2      ARG  62  13.359  -0.036  17.453
  464    HD3  ARG  62           HD3      ARG  62  12.902  -1.726  17.233
  465    HE   ARG  62           HE       ARG  62  12.505  -1.375  15.023
  466   HH11  ARG  62          HH11      ARG  62  12.735   1.848  16.534
  467   HH12  ARG  62          HH12      ARG  62  12.852   2.687  15.034
  468   HH21  ARG  62          HH21      ARG  62  12.820  -0.254  13.038
  469   HH22  ARG  62          HH22      ARG  62  12.871   1.478  13.013
  470    H    LYS  63           H        LYS  63  10.331   1.115  21.624
  471    HA   LYS  63           HA       LYS  63  11.865  -0.258  23.586
  472    HB2  LYS  63           HB2      LYS  63  12.199   1.764  24.479
  473    HB3  LYS  63           HB3      LYS  63  11.724   2.243  22.874
  474    HG2  LYS  63           HG2      LYS  63  10.392   3.666  24.135
  475    HG3  LYS  63           HG3      LYS  63   9.287   2.312  23.881
  476    HD2  LYS  63           HD2      LYS  63   9.117   2.369  26.193
  477    HD3  LYS  63           HD3      LYS  63  10.637   1.428  26.097
  478    HE2  LYS  63           HE2      LYS  63  11.947   3.535  26.286
  479    HE3  LYS  63           HE3      LYS  63  10.451   4.471  26.377
  480    HZ1  LYS  63           HZ1      LYS  63  11.374   4.075  28.568
  481    HZ2  LYS  63           HZ2      LYS  63   9.930   3.328  28.461
  482    HZ3  LYS  63           HZ3      LYS  63  11.322   2.457  28.382
  483    H    ASP  64           H        ASP  64   8.312  -0.057  23.188
  484    HA   ASP  64           HA       ASP  64   8.164  -1.179  25.930
  485    HB2  ASP  64           HB2      ASP  64   7.128   1.128  25.363
  486    HB3  ASP  64           HB3      ASP  64   5.825   0.170  24.684
  487    H    VAL  65           H        VAL  65   8.624  -2.531  23.282
  488    HA   VAL  65           HA       VAL  65   6.790  -4.773  23.885
  489    HB   VAL  65           HB       VAL  65   6.704  -5.280  21.428
  490   HG11  VAL  65          HG11      VAL  65   4.794  -4.335  22.647
  491   HG12  VAL  65          HG12      VAL  65   5.371  -2.699  22.280
  492   HG13  VAL  65          HG13      VAL  65   4.851  -3.780  20.962
  493   HG21  VAL  65          HG21      VAL  65   7.095  -3.518  19.774
  494   HG22  VAL  65          HG22      VAL  65   7.596  -2.399  21.046
  495   HG23  VAL  65          HG23      VAL  65   8.588  -3.810  20.687
  496    H    ARG  66           H        ARG  66   7.588  -6.865  22.987
  497    HA   ARG  66           HA       ARG  66  10.408  -6.986  22.220
  498    HB2  ARG  66           HB2      ARG  66  10.981  -8.762  23.748
  499    HB3  ARG  66           HB3      ARG  66  10.601  -7.268  24.593
  500    HG2  ARG  66           HG2      ARG  66   8.390  -9.329  24.378
  501    HG3  ARG  66           HG3      ARG  66   9.768  -9.705  25.399
  502    HD2  ARG  66           HD2      ARG  66   8.153  -7.147  25.680
  503    HD3  ARG  66           HD3      ARG  66   7.859  -8.603  26.612
  504    HE   ARG  66           HE       ARG  66  10.308  -6.889  26.715
  505   HH11  ARG  66          HH11      ARG  66   8.541  -9.612  28.238
  506   HH12  ARG  66          HH12      ARG  66   9.301  -9.362  29.789
  507   HH21  ARG  66          HH21      ARG  66  11.352  -6.708  28.763
  508   HH22  ARG  66          HH22      ARG  66  10.911  -7.789  30.056
  509    H    ILE  67           H        ILE  67  10.687  -8.768  20.694
  510    HA   ILE  67           HA       ILE  67   8.158  -9.879  19.732
  511    HB   ILE  67           HB       ILE  67  10.993 -10.378  18.748
  512   HG12  ILE  67          HG12      ILE  67   8.937  -8.515  17.478
  513   HG13  ILE  67          HG13      ILE  67  10.195  -7.932  18.570
  514   HG21  ILE  67          HG21      ILE  67   8.266 -10.904  17.445
  515   HG22  ILE  67          HG22      ILE  67   9.854 -11.226  16.703
  516   HG23  ILE  67          HG23      ILE  67   9.350 -12.145  18.108
  517   HD11  ILE  67          HD11      ILE  67  10.641  -9.301  15.902
  518   HD12  ILE  67          HD12      ILE  67  10.961  -7.618  16.333
  519   HD13  ILE  67          HD13      ILE  67  11.929  -8.910  17.074
  520    H    LEU  68           H        LEU  68   7.338 -11.549  20.700
  521    HA   LEU  68           HA       LEU  68   9.041 -13.474  22.204
  522    HB2  LEU  68           HB2      LEU  68   6.016 -13.163  21.937
  523    HB3  LEU  68           HB3      LEU  68   6.854 -14.351  22.933
  524    HG   LEU  68           HG       LEU  68   6.894 -11.330  23.369
  525   HD11  LEU  68          HD11      LEU  68   5.425 -13.698  24.559
  526   HD12  LEU  68          HD12      LEU  68   5.777 -12.270  25.525
  527   HD13  LEU  68          HD13      LEU  68   4.827 -12.098  24.016
  528   HD21  LEU  68          HD21      LEU  68   8.240 -13.573  24.948
  529   HD22  LEU  68          HD22      LEU  68   9.058 -12.250  24.080
  530   HD23  LEU  68          HD23      LEU  68   8.067 -11.885  25.490
  531    H    ALA  69           H        ALA  69   7.042 -13.215  19.259
  532    HA   ALA  69           HA       ALA  69   7.944 -15.837  18.316
  533    HB1  ALA  69           HB1      ALA  69   4.963 -15.490  18.508
  534    HB2  ALA  69           HB2      ALA  69   5.914 -16.959  18.249
  535    HB3  ALA  69           HB3      ALA  69   5.858 -16.213  19.858
  536    H    SER  70           H        SER  70   7.137 -16.204  16.156
  537    HA   SER  70           HA       SER  70   5.665 -14.283  14.772
  538    HB2  SER  70           HB2      SER  70   7.449 -13.606  13.080
  539    HB3  SER  70           HB3      SER  70   7.528 -12.849  14.677
  540    HG   SER  70           HG       SER  70   9.613 -13.563  13.964
  541    H    THR  71           H        THR  71   5.243 -14.974  12.454
  542    HA   THR  71           HA       THR  71   5.125 -17.865  12.462
  543    HB   THR  71           HB       THR  71   4.238 -17.402  10.062
  544    HG1  THR  71           HG1      THR  71   4.495 -15.414   9.540
  545   HG21  THR  71          HG21      THR  71   2.895 -16.999  12.676
  546   HG22  THR  71          HG22      THR  71   2.056 -16.381  11.214
  547   HG23  THR  71          HG23      THR  71   2.574 -18.060  11.289
  548    H    ARG  72           H        ARG  72   6.247 -19.347  11.384
  549    HA   ARG  72           HA       ARG  72   8.823 -18.588  10.191
  550    HB2  ARG  72           HB2      ARG  72   7.331 -21.256  10.153
  551    HB3  ARG  72           HB3      ARG  72   8.989 -20.982   9.631
  552    HG2  ARG  72           HG2      ARG  72   9.668 -21.456  11.687
  553    HG3  ARG  72           HG3      ARG  72   8.980 -19.924  12.226
  554    HD2  ARG  72           HD2      ARG  72   6.975 -22.112  12.068
  555    HD3  ARG  72           HD3      ARG  72   8.314 -22.496  13.129
  556    HE   ARG  72           HE       ARG  72   6.195 -20.555  13.537
  557   HH11  ARG  72          HH21      ARG  72   9.540 -21.350  14.540
  558   HH12  ARG  72          HH22      ARG  72   9.359 -20.682  16.118
  559   HH21  ARG  72          HH11      ARG  72   5.959 -19.710  15.569
  560   HH22  ARG  72          HH12      ARG  72   7.252 -19.733  16.751
  561    H    ASN  73           H        ASN  73   5.861 -20.067   8.981
  562    HA   ASN  73           HA       ASN  73   6.307 -19.514   6.187
  563    HB2  ASN  73           HB2      ASN  73   4.033 -20.487   5.939
  564    HB3  ASN  73           HB3      ASN  73   5.082 -21.488   6.916
  565   HD21  ASN  73          HD22      ASN  73   3.854 -22.455   8.544
  566   HD22  ASN  73          HD21      ASN  73   2.670 -21.611   9.514
  567    H    TRP  74           H        TRP  74   4.139 -18.513   5.089
  568    HA   TRP  74           HA       TRP  74   3.345 -16.019   6.502
  569    HB2  TRP  74           HB2      TRP  74   3.732 -16.407   3.484
  570    HB3  TRP  74           HB3      TRP  74   3.027 -14.993   4.242
  571    HD1  TRP  74           HD1      TRP  74   6.455 -16.810   4.144
  572    HE1  TRP  74           HE1      TRP  74   8.319 -15.060   4.253
  573    HE3  TRP  74           HE3      TRP  74   3.613 -12.574   4.531
  574    HZ2  TRP  74           HZ2      TRP  74   8.556 -12.259   4.849
  575    HZ3  TRP  74           HZ3      TRP  74   4.665 -10.384   4.939
  576    HH2  TRP  74           HH2      TRP  74   7.122 -10.249   5.313
  577    H    LEU  75           H        LEU  75   1.234 -15.451   6.319
  578    HA   LEU  75           HA       LEU  75  -0.608 -17.638   5.420
  579    HB2  LEU  75           HB2      LEU  75  -1.229 -15.287   7.240
  580    HB3  LEU  75           HB3      LEU  75  -2.241 -16.684   6.895
  581    HG   LEU  75           HG       LEU  75   0.310 -16.571   8.546
  582   HD11  LEU  75          HD11      LEU  75  -2.524 -17.453   9.263
  583   HD12  LEU  75          HD12      LEU  75  -1.120 -17.347  10.358
  584   HD13  LEU  75          HD13      LEU  75  -1.772 -15.877   9.632
  585   HD21  LEU  75          HD21      LEU  75   0.529 -18.610   7.333
  586   HD22  LEU  75          HD22      LEU  75   0.020 -19.005   8.968
  587   HD23  LEU  75          HD23      LEU  75  -1.179 -19.067   7.650
  588    H    ARG  76           H        ARG  76  -0.930 -17.226   3.271
  589    HA   ARG  76           HA       ARG  76  -1.606 -14.424   2.468
  590    HB2  ARG  76           HB2      ARG  76  -1.029 -15.031   0.197
  591    HB3  ARG  76           HB3      ARG  76   0.287 -15.467   1.276
  592    HG2  ARG  76           HG2      ARG  76   0.272 -17.304  -0.061
  593    HG3  ARG  76           HG3      ARG  76  -0.756 -17.880   1.240
  594    HD2  ARG  76           HD2      ARG  76  -2.760 -17.140  -0.282
  595    HD3  ARG  76           HD3      ARG  76  -1.552 -16.866  -1.521
  596    HE   ARG  76           HE       ARG  76  -1.282 -19.116  -1.829
  597   HH11  ARG  76          HH21      ARG  76  -3.185 -18.706   1.193
  598   HH12  ARG  76          HH22      ARG  76  -3.633 -20.374   1.259
  599   HH21  ARG  76          HH11      ARG  76  -1.892 -21.311  -1.691
  600   HH22  ARG  76          HH12      ARG  76  -2.875 -21.880  -0.394
  601    H    TYR  77           H        TYR  77  -3.673 -13.995   1.734
  602    HA   TYR  77           HA       TYR  77  -5.444 -16.299   1.213
  603    HB2  TYR  77           HB2      TYR  77  -7.274 -15.456   2.458
  604    HB3  TYR  77           HB3      TYR  77  -5.913 -15.794   3.506
  605    HD1  TYR  77           HD1      TYR  77  -8.011 -13.130   2.000
  606    HD2  TYR  77           HD2      TYR  77  -4.770 -13.993   4.716
  607    HE1  TYR  77           HE1      TYR  77  -8.249 -10.895   2.987
  608    HE2  TYR  77           HE2      TYR  77  -5.083 -11.815   5.795
  609    HH   TYR  77           HH       TYR  77  -6.336  -9.799   5.853
  610    H    LYS  78           H        LYS  78  -6.964 -15.907  -0.393
  611    HA   LYS  78           HA       LYS  78  -6.702 -13.329  -1.879
  612    HB2  LYS  78           HB2      LYS  78  -7.836 -16.064  -2.568
  613    HB3  LYS  78           HB3      LYS  78  -8.519 -14.624  -3.313
  614    HG2  LYS  78           HG2      LYS  78  -6.909 -15.493  -4.802
  615    HG3  LYS  78           HG3      LYS  78  -6.315 -13.955  -4.164
  616    HD2  LYS  78           HD2      LYS  78  -4.750 -15.076  -2.691
  617    HD3  LYS  78           HD3      LYS  78  -5.435 -16.669  -3.054
  618    HE2  LYS  78           HE2      LYS  78  -4.089 -14.845  -5.109
  619    HE3  LYS  78           HE3      LYS  78  -3.235 -16.096  -4.202
  620    HZ1  LYS  78           HZ1      LYS  78  -5.456 -16.603  -6.112
  621    HZ2  LYS  78           HZ2      LYS  78  -3.877 -16.906  -6.356
  622    HZ3  LYS  78           HZ3      LYS  78  -4.692 -17.759  -5.227
  623    H    LEU  79           H        LEU  79  -8.396 -11.939  -1.933
  624    HA   LEU  79           HA       LEU  79 -10.694 -12.428  -0.082
  625    HB2  LEU  79           HB2      LEU  79 -11.054 -10.130  -0.004
  626    HB3  LEU  79           HB3      LEU  79  -9.428 -10.556   0.487
  627    HG   LEU  79           HG       LEU  79  -8.503  -9.653  -1.597
  628   HD11  LEU  79          HD11      LEU  79 -10.292  -8.133  -2.885
  629   HD12  LEU  79          HD12      LEU  79 -10.036  -9.831  -3.299
  630   HD13  LEU  79          HD13      LEU  79 -11.423  -9.393  -2.296
  631   HD21  LEU  79          HD21      LEU  79  -8.948  -7.298  -1.076
  632   HD22  LEU  79          HD22      LEU  79 -10.395  -7.758  -0.146
  633   HD23  LEU  79          HD23      LEU  79  -8.776  -8.250   0.410
  634    HA   PRO  80           HA       PRO  80 -13.042 -13.496  -3.575
  635    HB2  PRO  80           HB2      PRO  80 -15.613 -12.934  -2.803
  636    HB3  PRO  80           HB3      PRO  80 -14.621 -14.213  -2.033
  637    HG2  PRO  80           HG2      PRO  80 -15.060 -11.376  -1.104
  638    HG3  PRO  80           HG3      PRO  80 -15.205 -12.883  -0.139
  639    HD2  PRO  80           HD2      PRO  80 -12.923 -11.357  -0.146
  640    HD3  PRO  80           HD3      PRO  80 -12.853 -13.140  -0.034
  641    H    LYS  81           H        LYS  81 -14.256 -12.664  -5.442
  642    HA   LYS  81           HA       LYS  81 -13.189 -10.151  -6.138
  643    HB2  LYS  81           HB2      LYS  81 -13.182 -11.237  -7.978
  644    HB3  LYS  81           HB3      LYS  81 -14.414 -12.386  -7.453
  645    HG2  LYS  81           HG2      LYS  81 -16.192 -10.804  -8.068
  646    HG3  LYS  81           HG3      LYS  81 -14.976  -9.671  -8.705
  647    HD2  LYS  81           HD2      LYS  81 -15.353 -12.538  -9.669
  648    HD3  LYS  81           HD3      LYS  81 -16.139 -11.131 -10.408
  649    HE2  LYS  81           HE2      LYS  81 -13.918 -10.134 -10.917
  650    HE3  LYS  81           HE3      LYS  81 -13.115 -11.549 -10.215
  651    HZ1  LYS  81           HZ1      LYS  81 -14.158 -12.915 -11.942
  652    HZ2  LYS  81           HZ2      LYS  81 -14.913 -11.607 -12.581
  653    HZ3  LYS  81           HZ3      LYS  81 -13.288 -11.715 -12.627
  654    H    ARG  82           H        ARG  82 -16.303 -10.847  -4.709
  655    HA   ARG  82           HA       ARG  82 -17.616  -8.446  -5.361
  656    HB2  ARG  82           HB2      ARG  82 -18.899  -8.739  -3.317
  657    HB3  ARG  82           HB3      ARG  82 -18.703 -10.266  -4.186
  658    HG2  ARG  82           HG2      ARG  82 -16.779 -10.772  -2.521
  659    HG3  ARG  82           HG3      ARG  82 -17.354  -9.353  -1.614
  660    HD2  ARG  82           HD2      ARG  82 -19.582 -10.381  -1.448
  661    HD3  ARG  82           HD3      ARG  82 -18.982 -11.784  -2.352
  662    HE   ARG  82           HE       ARG  82 -17.954 -10.894   0.326
  663   HH11  ARG  82          HH21      ARG  82 -19.042 -13.578  -1.755
  664   HH12  ARG  82          HH22      ARG  82 -18.788 -14.783  -0.548
  665   HH21  ARG  82          HH11      ARG  82 -17.621 -12.510   1.914
  666   HH22  ARG  82          HH12      ARG  82 -17.959 -14.164   1.570
  667    H    LEU  83           H        LEU  83 -14.937  -8.950  -3.130
  668    HA   LEU  83           HA       LEU  83 -15.195  -6.258  -1.998
  669    HB2  LEU  83           HB2      LEU  83 -13.145  -8.416  -1.507
  670    HB3  LEU  83           HB3      LEU  83 -13.320  -6.930  -0.577
  671    HG   LEU  83           HG       LEU  83 -15.218  -9.285  -0.698
  672   HD11  LEU  83          HD11      LEU  83 -14.589  -9.716   1.575
  673   HD12  LEU  83          HD12      LEU  83 -13.086  -9.517   0.664
  674   HD13  LEU  83          HD13      LEU  83 -13.672  -8.188   1.676
  675   HD21  LEU  83          HD21      LEU  83 -16.543  -8.154   1.068
  676   HD22  LEU  83          HD22      LEU  83 -15.580  -6.677   0.811
  677   HD23  LEU  83          HD23      LEU  83 -16.624  -7.331  -0.487
  678    H    VAL  84           H        VAL  84 -13.523  -7.823  -4.622
  679    HA   VAL  84           HA       VAL  84 -11.160  -6.174  -4.605
  680    HB   VAL  84           HB       VAL  84 -12.465  -7.707  -6.914
  681   HG11  VAL  84          HG11      VAL  84 -10.124  -7.645  -7.861
  682   HG12  VAL  84          HG12      VAL  84 -10.886  -6.054  -7.783
  683   HG13  VAL  84          HG13      VAL  84  -9.687  -6.527  -6.565
  684   HG21  VAL  84          HG21      VAL  84 -10.983  -9.520  -6.521
  685   HG22  VAL  84          HG22      VAL  84 -10.057  -8.610  -5.304
  686   HG23  VAL  84          HG23      VAL  84 -11.696  -9.168  -4.941
  687    H    ARG  85           H        ARG  85 -10.918  -4.110  -5.405
  688    HA   ARG  85           HA       ARG  85 -13.127  -2.944  -6.994
  689    HB2  ARG  85           HB2      ARG  85 -11.457  -1.941  -4.755
  690    HB3  ARG  85           HB3      ARG  85 -11.494  -0.830  -6.133
  691    HG2  ARG  85           HG2      ARG  85 -13.977  -2.060  -4.944
  692    HG3  ARG  85           HG3      ARG  85 -13.313  -0.480  -4.456
  693    HD2  ARG  85           HD2      ARG  85 -13.391   0.132  -6.971
  694    HD3  ARG  85           HD3      ARG  85 -14.442  -1.252  -7.201
  695    HE   ARG  85           HE       ARG  85 -14.986   1.309  -5.875
  696   HH11  ARG  85          HH22      ARG  85 -16.242  -2.020  -6.245
  697   HH12  ARG  85          HH21      ARG  85 -17.860  -1.587  -5.830
  698   HH21  ARG  85          HH11      ARG  85 -17.133   1.848  -5.304
  699   HH22  ARG  85          HH12      ARG  85 -18.372   0.648  -5.267
  700    H    TRP  86           H        TRP  86 -12.631  -3.634  -8.918
  701    HA   TRP  86           HA       TRP  86 -10.065  -3.441 -10.174
  702    HB2  TRP  86           HB2      TRP  86 -12.889  -3.559 -11.282
  703    HB3  TRP  86           HB3      TRP  86 -11.422  -3.841 -12.230
  704    HD1  TRP  86           HD1      TRP  86 -13.918  -5.629 -10.160
  705    HE1  TRP  86           HE1      TRP  86 -13.205  -7.999  -9.612
  706    HE3  TRP  86           HE3      TRP  86  -9.041  -5.356 -11.677
  707    HZ2  TRP  86           HZ2      TRP  86 -10.797  -9.631  -9.816
  708    HZ3  TRP  86           HZ3      TRP  86  -7.553  -7.340 -11.491
  709    HH2  TRP  86           HH2      TRP  86  -8.426  -9.480 -10.581
  710    H    ASP  87           H        ASP  87 -12.737  -1.213  -9.661
  711    HA   ASP  87           HA       ASP  87 -12.268   0.525 -11.865
  712    HB2  ASP  87           HB2      ASP  87 -14.439   0.181 -10.731
  713    HB3  ASP  87           HB3      ASP  87 -13.809   0.969  -9.282
  714    H    THR  88           H        THR  88 -10.426   0.224  -9.013
  715    HA   THR  88           HA       THR  88  -9.265   2.881  -9.458
  716    HB   THR  88           HB       THR  88 -10.887   2.801  -7.440
  717    HG1  THR  88           HG1      THR  88  -9.605   4.549  -7.605
  718   HG21  THR  88          HG21      THR  88  -9.919   0.648  -6.492
  719   HG22  THR  88          HG22      THR  88  -8.481   1.590  -6.037
  720   HG23  THR  88          HG23      THR  88 -10.081   1.990  -5.354
  721    H    LYS  89           H        LYS  89  -7.017   2.980  -8.618
  722    HA   LYS  89           HA       LYS  89  -5.656   0.382  -8.944
  723    HB2  LYS  89           HB2      LYS  89  -4.878   3.017 -10.247
  724    HB3  LYS  89           HB3      LYS  89  -4.029   1.490 -10.425
  725    HG2  LYS  89           HG2      LYS  89  -6.869   2.058 -11.381
  726    HG3  LYS  89           HG3      LYS  89  -5.422   2.083 -12.387
  727    HD2  LYS  89           HD2      LYS  89  -5.016  -0.327 -11.857
  728    HD3  LYS  89           HD3      LYS  89  -6.544  -0.394 -10.979
  729    HE2  LYS  89           HE2      LYS  89  -6.234   0.351 -13.927
  730    HE3  LYS  89           HE3      LYS  89  -6.620  -1.270 -13.342
  731    HZ1  LYS  89           HZ1      LYS  89  -8.604  -0.096 -14.019
  732    HZ2  LYS  89           HZ2      LYS  89  -8.707  -0.398 -12.418
  733    HZ3  LYS  89           HZ3      LYS  89  -8.344   1.120 -12.970
  734    HA   PRO  90           HA       PRO  90  -3.789  -0.521  -8.699
  735    HB2  PRO  90           HB2      PRO  90  -2.359  -1.870  -6.896
  736    HB3  PRO  90           HB3      PRO  90  -1.671  -0.567  -7.924
  737    HG2  PRO  90           HG2      PRO  90  -2.641  -0.334  -5.047
  738    HG3  PRO  90           HG3      PRO  90  -1.074   0.223  -5.725
  739    HD2  PRO  90           HD2      PRO  90  -3.239   1.885  -5.439
  740    HD3  PRO  90           HD3      PRO  90  -2.084   2.054  -6.794
  741    H    VAL  91           H        VAL  91  -4.923  -2.449  -8.551
  742    HA   VAL  91           HA       VAL  91  -7.043  -2.624  -6.548
  743    HB   VAL  91           HB       VAL  91  -7.680  -2.902  -8.818
  744   HG11  VAL  91          HG11      VAL  91  -5.593  -5.090  -9.141
  745   HG12  VAL  91          HG12      VAL  91  -6.856  -4.689 -10.313
  746   HG13  VAL  91          HG13      VAL  91  -5.604  -3.504  -9.947
  747   HG21  VAL  91          HG21      VAL  91  -7.600  -5.717  -7.674
  748   HG22  VAL  91          HG22      VAL  91  -8.722  -4.436  -7.149
  749   HG23  VAL  91          HG23      VAL  91  -8.772  -5.041  -8.815
  750    H    CYS  92           H        CYS  92  -7.158  -4.266  -4.944
  751    HA   CYS  92           HA       CYS  92  -4.772  -6.040  -4.682
  752    HB2  CYS  92           HB2      CYS  92  -5.495  -4.474  -2.728
  753    HB3  CYS  92           HB3      CYS  92  -6.903  -5.522  -2.567
  754    HG   CYS  92           HG       CYS  92  -3.699  -6.484  -2.598
  755    H    ILE  93           H        ILE  93  -5.099  -8.263  -4.834
  756    HA   ILE  93           HA       ILE  93  -7.921  -9.238  -4.698
  757    HB   ILE  93           HB       ILE  93  -7.634 -10.869  -6.268
  758   HG12  ILE  93          HG12      ILE  93  -5.510 -11.848  -5.810
  759   HG13  ILE  93          HG13      ILE  93  -5.646 -11.469  -7.510
  760   HG21  ILE  93          HG21      ILE  93  -7.171  -9.699  -8.330
  761   HG22  ILE  93          HG22      ILE  93  -7.994  -8.627  -7.189
  762   HG23  ILE  93          HG23      ILE  93  -6.254  -8.445  -7.480
  763   HD11  ILE  93          HD11      ILE  93  -3.982  -9.978  -5.452
  764   HD12  ILE  93          HD12      ILE  93  -3.408 -10.991  -6.778
  765   HD13  ILE  93          HD13      ILE  93  -4.186  -9.447  -7.142
  766    H    GLY  94           H        GLY  94  -4.754  -9.380  -3.330
  767    HA2  GLY  94           HA2      GLY  94  -5.573 -10.877  -1.105
  768    HA3  GLY  94           HA3      GLY  94  -4.690 -11.948  -2.215
  769    H    GLN  95           H        GLN  95  -3.660 -11.258   0.286
  770    HA   GLN  95           HA       GLN  95  -1.205  -9.804  -0.447
  771    HB2  GLN  95           HB2      GLN  95  -1.267  -8.316   1.418
  772    HB3  GLN  95           HB3      GLN  95  -2.745  -8.103   0.496
  773    HG2  GLN  95           HG2      GLN  95  -2.419  -9.550   3.153
  774    HG3  GLN  95           HG3      GLN  95  -3.128  -7.960   2.901
  775   HE21  GLN  95          HE22      GLN  95  -3.631 -11.448   2.566
  776   HE22  GLN  95          HE21      GLN  95  -5.368 -11.354   2.284
  777    H    LYS  96           H        LYS  96   0.627 -10.488   0.725
  778    HA   LYS  96           HA       LYS  96   0.297 -13.180   1.968
  779    HB2  LYS  96           HB2      LYS  96   1.748 -12.851  -0.035
  780    HB3  LYS  96           HB3      LYS  96   2.653 -11.604   0.816
  781    HG2  LYS  96           HG2      LYS  96   3.391 -13.334   2.463
  782    HG3  LYS  96           HG3      LYS  96   2.584 -14.579   1.493
  783    HD2  LYS  96           HD2      LYS  96   3.993 -14.017  -0.430
  784    HD3  LYS  96           HD3      LYS  96   4.715 -12.652   0.446
  785    HE2  LYS  96           HE2      LYS  96   5.756 -14.188   2.082
  786    HE3  LYS  96           HE3      LYS  96   4.958 -15.572   1.327
  787    HZ1  LYS  96           HZ1      LYS  96   6.259 -15.154  -0.689
  788    HZ2  LYS  96           HZ2      LYS  96   7.000 -13.862  -0.006
  789    HZ3  LYS  96           HZ3      LYS  96   7.252 -15.364   0.585
  790    H    GLN  97           H        GLN  97   0.303 -13.166   4.281
  791    HA   GLN  97           HA       GLN  97   1.475 -10.741   5.511
  792    HB2  GLN  97           HB2      GLN  97  -0.925 -10.769   5.528
  793    HB3  GLN  97           HB3      GLN  97  -0.929 -12.269   6.470
  794    HG2  GLN  97           HG2      GLN  97  -0.200 -11.196   8.421
  795    HG3  GLN  97           HG3      GLN  97   0.742 -10.005   7.551
  796   HE21  GLN  97          HE22      GLN  97  -2.830 -10.778   7.466
  797   HE22  GLN  97          HE21      GLN  97  -3.276  -9.100   7.774
  798    H    LYS  98           H        LYS  98   2.979 -10.879   7.019
  799    HA   LYS  98           HA       LYS  98   3.595 -13.528   8.272
  800    HB2  LYS  98           HB2      LYS  98   5.414 -12.305   7.096
  801    HB3  LYS  98           HB3      LYS  98   5.198 -10.921   8.193
  802    HG2  LYS  98           HG2      LYS  98   6.241 -11.995   9.906
  803    HG3  LYS  98           HG3      LYS  98   5.796 -13.629   9.359
  804    HD2  LYS  98           HD2      LYS  98   7.783 -11.924   7.842
  805    HD3  LYS  98           HD3      LYS  98   8.294 -12.857   9.235
  806    HE2  LYS  98           HE2      LYS  98   6.720 -14.297   7.080
  807    HE3  LYS  98           HE3      LYS  98   8.372 -13.811   6.707
  808    HZ1  LYS  98           HZ1      LYS  98   9.193 -15.087   8.545
  809    HZ2  LYS  98           HZ2      LYS  98   7.693 -15.493   9.066
  810    HZ3  LYS  98           HZ3      LYS  98   8.248 -16.068   7.640
  811    H    TRP  99           H        TRP  99   3.750 -13.536  10.655
  812    HA   TRP  99           HA       TRP  99   2.236 -11.301  11.930
  813    HB2  TRP  99           HB2      TRP  99   1.834 -14.292  12.129
  814    HB3  TRP  99           HB3      TRP  99   1.148 -13.125  13.259
  815    HD1  TRP  99           HD1      TRP  99   0.656 -14.461   9.736
  816    HE1  TRP  99           HE1      TRP  99  -1.573 -13.584   8.831
  817    HE3  TRP  99           HE3      TRP  99  -0.397 -11.056  13.390
  818    HZ2  TRP  99           HZ2      TRP  99  -3.635 -11.734   9.669
  819    HZ3  TRP  99           HZ3      TRP  99  -2.428  -9.654  13.259
  820    HH2  TRP  99           HH2      TRP  99  -4.088 -10.017  11.427
  821    H    PHE 100           H        PHE 100   2.814 -10.794  14.014
  822    HA   PHE 100           HA       PHE 100   5.231 -12.128  15.164
  823    HB2  PHE 100           HB2      PHE 100   4.560  -9.166  14.864
  824    HB3  PHE 100           HB3      PHE 100   5.875  -9.794  15.843
  825    HD1  PHE 100           HD1      PHE 100   4.622  -9.452  12.316
  826    HD2  PHE 100           HD2      PHE 100   7.981 -10.397  14.878
  827    HE1  PHE 100           HE1      PHE 100   6.154  -9.394  10.370
  828    HE2  PHE 100           HE2      PHE 100   9.485 -10.366  12.917
  829    HZ   PHE 100           HZ       PHE 100   8.577  -9.885  10.661
  830    H    LEU 101           H        LEU 101   4.942 -12.667  17.317
  831    HA   LEU 101           HA       LEU 101   2.616 -11.535  18.785
  832    HB2  LEU 101           HB2      LEU 101   3.260 -14.096  18.714
  833    HB3  LEU 101           HB3      LEU 101   4.530 -13.652  19.829
  834    HG   LEU 101           HG       LEU 101   1.633 -13.990  20.198
  835   HD11  LEU 101          HD11      LEU 101   3.763 -14.142  22.364
  836   HD12  LEU 101          HD12      LEU 101   2.239 -15.055  22.205
  837   HD13  LEU 101          HD13      LEU 101   3.602 -15.440  21.167
  838   HD21  LEU 101          HD21      LEU 101   1.289 -12.582  22.058
  839   HD22  LEU 101          HD22      LEU 101   2.954 -11.945  22.025
  840   HD23  LEU 101          HD23      LEU 101   1.761 -11.542  20.757
  841    H    LEU 102           H        LEU 102   3.121  -9.836  20.160
  842    HA   LEU 102           HA       LEU 102   5.910  -9.724  21.187
  843    HB2  LEU 102           HB2      LEU 102   4.196  -7.256  21.009
  844    HB3  LEU 102           HB3      LEU 102   5.932  -7.374  21.129
  845    HG   LEU 102           HG       LEU 102   4.298  -8.023  18.652
  846   HD11  LEU 102          HD11      LEU 102   6.054  -5.597  19.187
  847   HD12  LEU 102          HD12      LEU 102   5.043  -5.910  17.767
  848   HD13  LEU 102          HD13      LEU 102   4.272  -5.604  19.333
  849   HD21  LEU 102          HD21      LEU 102   7.300  -7.757  19.060
  850   HD22  LEU 102          HD22      LEU 102   6.406  -9.246  18.621
  851   HD23  LEU 102          HD23      LEU 102   6.495  -7.900  17.475
  852    H    GLN 103           H        GLN 103   6.052  -8.966  23.427
  853    HA   GLN 103           HA       GLN 103   3.394  -9.037  24.838
  854    HB2  GLN 103           HB2      GLN 103   4.480 -10.625  25.740
  855    HB3  GLN 103           HB3      GLN 103   6.088  -9.865  25.718
  856    HG2  GLN 103           HG2      GLN 103   5.572  -8.562  27.669
  857    HG3  GLN 103           HG3      GLN 103   3.837  -8.583  27.347
  858   HE21  GLN 103          HE22      GLN 103   2.628 -10.610  27.625
  859   HE22  GLN 103          HE21      GLN 103   3.162 -11.730  28.881
  860    H    LEU 104           H        LEU 104   2.668  -7.079  25.654
  861    HA   LEU 104           HA       LEU 104   3.947  -4.562  25.163
  862    HB2  LEU 104           HB2      LEU 104   1.393  -5.537  26.074
  863    HB3  LEU 104           HB3      LEU 104   2.045  -4.710  27.442
  864    HG   LEU 104           HG       LEU 104   0.781  -3.106  26.527
  865   HD11  LEU 104          HD11      LEU 104   2.076  -1.356  25.532
  866   HD12  LEU 104          HD12      LEU 104   3.061  -2.190  26.727
  867   HD13  LEU 104          HD13      LEU 104   3.322  -2.491  24.990
  868   HD21  LEU 104          HD21      LEU 104   1.503  -3.942  23.714
  869   HD22  LEU 104          HD22      LEU 104  -0.053  -4.177  24.587
  870   HD23  LEU 104          HD23      LEU 104   0.470  -2.555  24.168
  871    H    VAL 105           H        VAL 105   5.364  -3.367  26.600
  872    HA   VAL 105           HA       VAL 105   6.594  -5.030  28.686
  873    HB   VAL 105           HB       VAL 105   7.351  -2.400  27.430
  874   HG11  VAL 105          HG11      VAL 105   8.318  -2.408  29.660
  875   HG12  VAL 105          HG12      VAL 105   8.947  -4.052  29.423
  876   HG13  VAL 105          HG13      VAL 105   9.588  -2.695  28.464
  877   HG21  VAL 105          HG21      VAL 105   8.997  -3.619  26.175
  878   HG22  VAL 105          HG22      VAL 105   8.762  -5.078  27.178
  879   HG23  VAL 105          HG23      VAL 105   7.515  -4.570  26.033
  880    H    SER 106           H        SER 106   5.270  -1.681  28.544
  881    HA   SER 106           HA       SER 106   5.207  -1.467  31.456
  882    HB2  SER 106           HB2      SER 106   4.028   0.237  29.226
  883    HB3  SER 106           HB3      SER 106   3.995   0.662  30.945
  884    HG   SER 106           HG       SER 106   6.192   0.491  29.181
  885    H    GLY 107           H        GLY 107   3.030  -2.633  28.986
  886    HA2  GLY 107           HA2      GLY 107   1.114  -4.039  29.704
  887    HA3  GLY 107           HA3      GLY 107   0.781  -2.840  30.959
  888    H    ASP 108           H        ASP 108  -1.230  -3.362  29.294
  889    HA   ASP 108           HA       ASP 108  -1.267  -2.282  26.768
  890    HB2  ASP 108           HB2      ASP 108  -3.437  -2.924  26.704
  891    HB3  ASP 108           HB3      ASP 108  -2.810  -3.943  28.002
  892    H    ALA 109           H        ALA 109  -1.513  -0.595  29.706
  893    HA   ALA 109           HA       ALA 109  -2.877   1.773  29.067
  894    HB1  ALA 109           HB1      ALA 109  -1.908   1.237  31.290
  895    HB2  ALA 109           HB2      ALA 109  -0.273   1.448  30.613
  896    HB3  ALA 109           HB3      ALA 109  -1.376   2.837  30.717
  897    H    GLU 110           H        GLU 110   0.263   0.669  27.855
  898    HA   GLU 110           HA       GLU 110   0.899   3.293  26.830
  899    HB2  GLU 110           HB2      GLU 110   2.410   0.702  27.046
  900    HB3  GLU 110           HB3      GLU 110   2.984   1.906  25.890
  901    HG2  GLU 110           HG2      GLU 110   2.482   2.432  28.829
  902    HG3  GLU 110           HG3      GLU 110   4.056   2.080  28.109
  903    H    ILE 111           H        ILE 111  -1.430   2.022  25.812
  904    HA   ILE 111           HA       ILE 111  -0.840   1.914  22.886
  905    HB   ILE 111           HB       ILE 111  -3.288   0.952  24.416
  906   HG12  ILE 111          HG12      ILE 111  -1.417  -0.708  22.652
  907   HG13  ILE 111          HG13      ILE 111  -1.158  -0.536  24.403
  908   HG21  ILE 111          HG21      ILE 111  -2.676   1.068  21.445
  909   HG22  ILE 111          HG22      ILE 111  -4.011   0.115  22.119
  910   HG23  ILE 111          HG23      ILE 111  -4.017   1.869  22.291
  911   HD11  ILE 111          HD11      ILE 111  -3.596  -1.803  23.083
  912   HD12  ILE 111          HD12      ILE 111  -2.335  -2.600  24.034
  913   HD13  ILE 111          HD13      ILE 111  -3.462  -1.470  24.809
  914    H    ASN 112           H        ASN 112  -1.571   3.520  21.607
  915    HA   ASN 112           HA       ASN 112  -3.502   5.555  22.644
  916    HB2  ASN 112           HB2      ASN 112  -1.332   6.658  22.543
  917    HB3  ASN 112           HB3      ASN 112  -0.999   5.960  20.956
  918   HD21  ASN 112          HD22      ASN 112  -0.639   8.251  20.199
  919   HD22  ASN 112          HD21      ASN 112  -2.070   9.159  19.740
  920    H    MET 113           H        MET 113  -5.299   5.685  21.317
  921    HA   MET 113           HA       MET 113  -5.336   3.975  18.888
  922    HB2  MET 113           HB2      MET 113  -7.554   5.350  20.441
  923    HB3  MET 113           HB3      MET 113  -7.787   4.251  19.086
  924    HG2  MET 113           HG2      MET 113  -6.121   3.085  21.249
  925    HG3  MET 113           HG3      MET 113  -7.740   3.558  21.761
  926    HE1  MET 113           HE1      MET 113  -6.542  -0.051  19.272
  927    HE2  MET 113           HE2      MET 113  -5.635   1.486  19.237
  928    HE3  MET 113           HE3      MET 113  -5.801   0.581  20.759
  929    H    GLN 114           H        GLN 114  -4.706   7.252  19.485
  930    HA   GLN 114           HA       GLN 114  -5.648   8.034  16.827
  931    HB2  GLN 114           HB2      GLN 114  -6.153  10.283  17.664
  932    HB3  GLN 114           HB3      GLN 114  -7.314   9.018  18.067
  933    HG2  GLN 114           HG2      GLN 114  -6.481   8.894  20.378
  934    HG3  GLN 114           HG3      GLN 114  -5.238  10.094  20.030
  935   HE21  GLN 114          HE22      GLN 114  -5.975  12.344  19.449
  936   HE22  GLN 114          HE21      GLN 114  -7.512  12.904  20.072
  937    H    THR 115           H        THR 115  -3.756   7.470  16.200
  938    HA   THR 115           HA       THR 115  -1.246   8.643  17.033
  939    HB   THR 115           HB       THR 115  -0.647   7.233  14.899
  940    HG1  THR 115           HG1      THR 115  -2.239   5.656  14.437
  941   HG21  THR 115          HG21      THR 115  -1.923   5.959  17.405
  942   HG22  THR 115          HG22      THR 115  -0.859   5.103  16.263
  943   HG23  THR 115          HG23      THR 115  -0.219   6.447  17.226
  944    H    SER 116           H        SER 116  -2.980   8.385  13.984
  945    HA   SER 116           HA       SER 116  -2.182  10.956  12.897
  946    HB2  SER 116           HB2      SER 116  -4.419   9.061  12.066
  947    HB3  SER 116           HB3      SER 116  -3.726  10.371  11.094
  948    HG   SER 116           HG       SER 116  -2.773   8.384  10.521
  949    H    SER 117           H        SER 117  -4.043  12.523  12.131
  950    HA   SER 117           HA       SER 117  -5.430  13.594  14.346
  951    HB2  SER 117           HB2      SER 117  -6.139  13.918  11.402
  952    HB3  SER 117           HB3      SER 117  -6.445  15.073  12.710
  953    HG   SER 117           HG       SER 117  -4.207  15.430  12.878
  954    H    THR 118           H        THR 118  -6.379  11.239  11.845
  955    HA   THR 118           HA       THR 118  -9.064  10.823  12.837
  956    HB   THR 118           HB       THR 118  -8.335   8.689  11.310
  957    HG1  THR 118           HG1      THR 118  -7.366   9.539   9.461
  958   HG21  THR 118          HG21      THR 118 -10.487   9.738  11.284
  959   HG22  THR 118          HG22      THR 118  -9.820  11.206  10.527
  960   HG23  THR 118          HG23      THR 118  -9.859   9.660   9.634
  961    HA   PRO 119           HA       PRO 119  -7.553   7.852  15.893
  962    HB2  PRO 119           HB2      PRO 119 -10.331   6.749  15.647
  963    HB3  PRO 119           HB3      PRO 119  -9.410   7.201  17.115
  964    HG2  PRO 119           HG2      PRO 119 -11.427   8.775  16.128
  965    HG3  PRO 119           HG3      PRO 119  -9.941   9.492  16.845
  966    HD2  PRO 119           HD2      PRO 119 -10.634   9.134  13.915
  967    HD3  PRO 119           HD3      PRO 119  -9.830  10.509  14.740
  968    H    GLU 120           H        GLU 120  -6.295   6.192  15.088
  969    HA   GLU 120           HA       GLU 120  -7.015   4.901  12.577
  970    HB2  GLU 120           HB2      GLU 120  -4.643   4.656  14.450
  971    HB3  GLU 120           HB3      GLU 120  -4.877   3.541  13.103
  972    HG2  GLU 120           HG2      GLU 120  -4.713   6.577  12.817
  973    HG3  GLU 120           HG3      GLU 120  -3.398   5.452  12.490
  974    H    PHE 121           H        PHE 121  -7.644   4.364  15.895
  975    HA   PHE 121           HA       PHE 121  -9.240   2.039  15.129
  976    HB2  PHE 121           HB2      PHE 121  -7.266   2.103  17.416
  977    HB3  PHE 121           HB3      PHE 121  -8.695   1.073  17.466
  978    HD1  PHE 121           HD2      PHE 121  -8.898  -0.061  14.747
  979    HD2  PHE 121           HD1      PHE 121  -5.431   0.641  17.212
  980    HE1  PHE 121           HE2      PHE 121  -7.780  -2.003  13.724
  981    HE2  PHE 121           HE1      PHE 121  -4.344  -1.327  16.238
  982    HZ   PHE 121           HZ       PHE 121  -5.503  -2.652  14.461
  983    H    ASP 122           H        ASP 122 -10.974   1.737  16.579
  984    HA   ASP 122           HA       ASP 122 -11.997   4.245  17.832
  985    HB2  ASP 122           HB2      ASP 122 -13.144   3.659  15.778
  986    HB3  ASP 122           HB3      ASP 122 -13.367   1.995  16.322
  987    H    GLY 123           H        GLY 123 -11.035   0.930  18.371
  988    HA2  GLY 123           HA2      GLY 123 -11.683   1.187  21.179
  989    HA3  GLY 123           HA3      GLY 123 -12.640  -0.054  20.347
  990    H    TRP 124           H        TRP 124 -10.686  -0.473  22.433
  991    HA   TRP 124           HA       TRP 124  -9.072  -2.501  21.045
  992    HB2  TRP 124           HB2      TRP 124  -7.102  -2.034  21.989
  993    HB3  TRP 124           HB3      TRP 124  -7.702  -0.391  21.983
  994    HD1  TRP 124           HD1      TRP 124  -6.178  -2.856  24.168
  995    HE1  TRP 124           HE1      TRP 124  -6.340  -2.206  26.670
  996    HE3  TRP 124           HE3      TRP 124  -9.552   0.998  23.843
  997    HZ2  TRP 124           HZ2      TRP 124  -8.062  -0.647  28.302
  998    HZ3  TRP 124           HZ3      TRP 124 -10.448   2.043  25.908
  999    HH2  TRP 124           HH2      TRP 124  -9.728   1.224  28.148
 1000    H    ARG 125           H        ARG 125  -8.948  -4.453  22.307
 1001    HA   ARG 125           HA       ARG 125 -10.176  -4.499  24.949
 1002    HB2  ARG 125           HB2      ARG 125 -11.880  -6.129  24.476
 1003    HB3  ARG 125           HB3      ARG 125 -12.148  -4.725  23.456
 1004    HG2  ARG 125           HG2      ARG 125 -10.953  -6.011  21.582
 1005    HG3  ARG 125           HG3      ARG 125 -11.051  -7.441  22.601
 1006    HD2  ARG 125           HD2      ARG 125 -13.435  -5.752  21.728
 1007    HD3  ARG 125           HD3      ARG 125 -12.889  -7.220  20.911
 1008    HE   ARG 125           HE       ARG 125 -13.485  -7.523  23.774
 1009   HH11  ARG 125          HH11      ARG 125 -14.924  -7.586  20.515
 1010   HH12  ARG 125          HH12      ARG 125 -16.222  -8.633  20.962
 1011   HH21  ARG 125          HH21      ARG 125 -15.268  -8.844  24.383
 1012   HH22  ARG 125          HH22      ARG 125 -16.368  -9.423  23.185
 1013    H    TRP 126           H        TRP 126  -9.929  -6.729  25.886
 1014    HA   TRP 126           HA       TRP 126  -7.614  -8.175  24.711
 1015    HB2  TRP 126           HB2      TRP 126  -8.057  -7.127  27.503
 1016    HB3  TRP 126           HB3      TRP 126  -7.123  -8.599  27.243
 1017    HD1  TRP 126           HD1      TRP 126  -6.994  -4.826  26.196
 1018    HE1  TRP 126           HE1      TRP 126  -4.581  -4.150  26.037
 1019    HE3  TRP 126           HE3      TRP 126  -4.868  -9.452  26.489
 1020    HZ2  TRP 126           HZ2      TRP 126  -1.966  -5.436  25.972
 1021    HZ3  TRP 126           HZ3      TRP 126  -2.434  -9.712  26.267
 1022    HH2  TRP 126           HH2      TRP 126  -0.948  -7.714  26.082
 1023    H    VAL 127           H        VAL 127  -7.939 -10.337  24.518
 1024    HA   VAL 127           HA       VAL 127 -10.440 -11.566  25.574
 1025    HB   VAL 127           HB       VAL 127 -10.641 -12.432  23.110
 1026   HG11  VAL 127          HG11      VAL 127 -11.301  -9.524  23.780
 1027   HG12  VAL 127          HG12      VAL 127 -12.020 -10.455  22.459
 1028   HG13  VAL 127          HG13      VAL 127 -12.309 -10.945  24.140
 1029   HG21  VAL 127          HG21      VAL 127  -8.506 -11.558  22.269
 1030   HG22  VAL 127          HG22      VAL 127  -9.900 -11.029  21.326
 1031   HG23  VAL 127          HG23      VAL 127  -9.114  -9.898  22.446
 1032    H    SER 128           H        SER 128 -10.507 -13.952  25.260
 1033    HA   SER 128           HA       SER 128  -7.951 -15.285  25.531
 1034    HB2  SER 128           HB2      SER 128 -10.741 -16.353  24.916
 1035    HB3  SER 128           HB3      SER 128  -9.355 -17.315  25.483
 1036    HG   SER 128           HG       SER 128 -10.821 -16.666  27.196
 1037    H    TYR 129           H        TYR 129  -7.075 -16.869  23.971
 1038    HA   TYR 129           HA       TYR 129  -6.639 -15.672  21.510
 1039    HB2  TYR 129           HB2      TYR 129  -6.171 -18.578  21.422
 1040    HB3  TYR 129           HB3      TYR 129  -5.060 -17.248  21.212
 1041    HD1  TYR 129           HD1      TYR 129  -6.793 -19.368  23.734
 1042    HD2  TYR 129           HD2      TYR 129  -3.455 -16.706  22.993
 1043    HE1  TYR 129           HE1      TYR 129  -5.863 -19.933  25.945
 1044    HE2  TYR 129           HE2      TYR 129  -2.538 -17.284  25.201
 1045    HH   TYR 129           HH       TYR 129  -4.109 -19.559  27.482
 1046    H    TRP 130           H        TRP 130  -9.026 -18.254  22.234
 1047    HA   TRP 130           HA       TRP 130  -9.477 -18.696  19.384
 1048    HB2  TRP 130           HB2      TRP 130 -10.899 -19.970  21.730
 1049    HB3  TRP 130           HB3      TRP 130 -10.755 -20.591  20.085
 1050    HD1  TRP 130           HD1      TRP 130  -9.359 -21.190  23.337
 1051    HE1  TRP 130           HE1      TRP 130  -6.996 -22.172  23.309
 1052    HE3  TRP 130           HE3      TRP 130  -8.164 -20.351  18.409
 1053    HZ2  TRP 130           HZ2      TRP 130  -4.799 -22.365  21.477
 1054    HZ3  TRP 130           HZ3      TRP 130  -5.907 -20.933  17.562
 1055    HH2  TRP 130           HH2      TRP 130  -4.212 -21.893  19.093
 1056    H    TYR 131           H        TYR 131 -11.153 -16.956  21.931
 1057    HA   TYR 131           HA       TYR 131 -13.729 -16.738  20.914
 1058    HB2  TYR 131           HB2      TYR 131 -13.101 -15.949  23.087
 1059    HB3  TYR 131           HB3      TYR 131 -11.981 -14.773  22.428
 1060    HD1  TYR 131           HD2      TYR 131 -15.612 -15.640  22.703
 1061    HD2  TYR 131           HD1      TYR 131 -12.706 -12.600  21.758
 1062    HE1  TYR 131           HE2      TYR 131 -17.385 -13.915  22.843
 1063    HE2  TYR 131           HE1      TYR 131 -14.453 -10.860  21.947
 1064    HH   TYR 131           HH       TYR 131 -17.892 -11.620  22.731
 1065    HA   PRO 132           HA       PRO 132 -12.602 -12.939  18.212
 1066    HB2  PRO 132           HB2      PRO 132 -10.082 -12.742  17.102
 1067    HB3  PRO 132           HB3      PRO 132 -10.556 -12.006  18.671
 1068    HG2  PRO 132           HG2      PRO 132  -9.165 -14.656  18.266
 1069    HG3  PRO 132           HG3      PRO 132  -8.685 -13.297  19.336
 1070    HD2  PRO 132           HD2      PRO 132 -10.087 -15.318  20.329
 1071    HD3  PRO 132           HD3      PRO 132 -10.550 -13.655  20.774
 1072    H    VAL 133           H        VAL 133 -11.274 -16.175  17.621
 1073    HA   VAL 133           HA       VAL 133 -11.197 -16.014  14.776
 1074    HB   VAL 133           HB       VAL 133 -11.576 -18.501  16.495
 1075   HG11  VAL 133          HG11      VAL 133 -11.946 -18.821  14.049
 1076   HG12  VAL 133          HG12      VAL 133 -10.339 -18.146  13.736
 1077   HG13  VAL 133          HG13      VAL 133 -10.513 -19.678  14.629
 1078   HG21  VAL 133          HG21      VAL 133  -9.102 -18.742  16.414
 1079   HG22  VAL 133          HG22      VAL 133  -8.970 -17.158  15.628
 1080   HG23  VAL 133          HG23      VAL 133  -9.560 -17.283  17.295
 1081    H    ARG 134           H        ARG 134 -13.828 -16.976  17.095
 1082    HA   ARG 134           HA       ARG 134 -15.483 -17.777  14.864
 1083    HB2  ARG 134           HB2      ARG 134 -17.281 -18.106  16.531
 1084    HB3  ARG 134           HB3      ARG 134 -15.824 -19.076  16.689
 1085    HG2  ARG 134           HG2      ARG 134 -16.644 -18.448  18.872
 1086    HG3  ARG 134           HG3      ARG 134 -15.080 -17.690  18.583
 1087    HD2  ARG 134           HD2      ARG 134 -16.457 -15.965  19.514
 1088    HD3  ARG 134           HD3      ARG 134 -16.305 -15.676  17.781
 1089    HE   ARG 134           HE       ARG 134 -18.561 -16.116  17.448
 1090   HH11  ARG 134          HH11      ARG 134 -17.761 -16.995  20.815
 1091   HH12  ARG 134          HH12      ARG 134 -19.411 -17.102  21.307
 1092   HH21  ARG 134          HH21      ARG 134 -20.741 -16.291  18.116
 1093   HH22  ARG 134          HH22      ARG 134 -21.131 -16.704  19.743
 1094    H    GLN 135           H        GLN 135 -14.698 -14.685  15.631
 1095    HA   GLN 135           HA       GLN 135 -17.436 -13.656  15.133
 1096    HB2  GLN 135           HB2      GLN 135 -14.913 -12.555  16.330
 1097    HB3  GLN 135           HB3      GLN 135 -16.041 -11.398  15.626
 1098    HG2  GLN 135           HG2      GLN 135 -17.816 -12.004  17.072
 1099    HG3  GLN 135           HG3      GLN 135 -17.109 -13.556  17.484
 1100   HE21  GLN 135          HE22      GLN 135 -15.087 -13.590  18.884
 1101   HE22  GLN 135          HE21      GLN 135 -15.002 -12.331  20.084
 1102    H    VAL 136           H        VAL 136 -14.537 -14.274  13.252
 1103    HA   VAL 136           HA       VAL 136 -15.398 -12.214  11.292
 1104    HB   VAL 136           HB       VAL 136 -13.130 -12.503  10.414
 1105   HG11  VAL 136          HG11      VAL 136 -12.102 -11.136  12.079
 1106   HG12  VAL 136          HG12      VAL 136 -13.818 -10.746  12.096
 1107   HG13  VAL 136          HG13      VAL 136 -13.142 -11.784  13.370
 1108   HG21  VAL 136          HG21      VAL 136 -11.366 -13.575  11.663
 1109   HG22  VAL 136          HG22      VAL 136 -12.499 -14.138  12.900
 1110   HG23  VAL 136          HG23      VAL 136 -12.596 -14.767  11.236
 1111    H    VAL 137           H        VAL 137 -14.886 -12.865   8.923
 1112    HA   VAL 137           HA       VAL 137 -16.679 -15.043   8.298
 1113    HB   VAL 137           HB       VAL 137 -16.599 -14.333   6.098
 1114   HG11  VAL 137          HG11      VAL 137 -15.768 -11.747   7.463
 1115   HG12  VAL 137          HG12      VAL 137 -16.768 -11.952   6.019
 1116   HG13  VAL 137          HG13      VAL 137 -17.386 -12.490   7.589
 1117   HG21  VAL 137          HG21      VAL 137 -14.638 -12.927   5.177
 1118   HG22  VAL 137          HG22      VAL 137 -13.728 -13.500   6.613
 1119   HG23  VAL 137          HG23      VAL 137 -14.400 -14.662   5.444
 1120    H    SER 138           H        SER 138 -15.981 -16.726   6.587
 1121    HA   SER 138           HA       SER 138 -14.486 -18.607   7.863
 1122    HB2  SER 138           HB2      SER 138 -14.947 -18.375   4.870
 1123    HB3  SER 138           HB3      SER 138 -14.744 -19.880   5.804
 1124    HG   SER 138           HG       SER 138 -16.964 -19.427   5.404
 1125    H    PHE 139           H        PHE 139 -13.248 -16.683   5.016
 1126    HA   PHE 139           HA       PHE 139 -10.758 -18.080   5.071
 1127    HB2  PHE 139           HB2      PHE 139  -9.988 -16.519   3.414
 1128    HB3  PHE 139           HB3      PHE 139 -11.597 -17.088   3.041
 1129    HD1  PHE 139           HD2      PHE 139  -9.580 -14.151   4.078
 1130    HD2  PHE 139           HD1      PHE 139 -13.513 -15.536   2.948
 1131    HE1  PHE 139           HE2      PHE 139 -10.304 -11.813   3.676
 1132    HE2  PHE 139           HE1      PHE 139 -14.207 -13.207   2.516
 1133    HZ   PHE 139           HZ       PHE 139 -12.609 -11.332   2.886
 1134    H    LYS 140           H        LYS 140 -11.836 -15.125   6.714
 1135    HA   LYS 140           HA       LYS 140  -9.119 -14.534   7.674
 1136    HB2  LYS 140           HB2      LYS 140 -11.806 -13.418   8.536
 1137    HB3  LYS 140           HB3      LYS 140 -10.216 -12.857   9.105
 1138    HG2  LYS 140           HG2      LYS 140  -9.578 -12.442   6.678
 1139    HG3  LYS 140           HG3      LYS 140 -11.259 -12.771   6.243
 1140    HD2  LYS 140           HD2      LYS 140 -10.261 -10.529   8.037
 1141    HD3  LYS 140           HD3      LYS 140 -10.841 -10.381   6.369
 1142    HE2  LYS 140           HE2      LYS 140 -13.075 -11.256   7.090
 1143    HE3  LYS 140           HE3      LYS 140 -12.496 -11.325   8.760
 1144    HZ1  LYS 140           HZ1      LYS 140 -12.173  -8.871   8.649
 1145    HZ2  LYS 140           HZ2      LYS 140 -12.725  -8.836   7.106
 1146    HZ3  LYS 140           HZ3      LYS 140 -13.734  -9.240   8.316
 1147    H    ARG 141           H        ARG 141 -12.062 -16.101   8.990
 1148    HA   ARG 141           HA       ARG 141 -11.100 -16.742  11.563
 1149    HB2  ARG 141           HB2      ARG 141 -12.498 -18.825   9.797
 1150    HB3  ARG 141           HB3      ARG 141 -12.245 -18.906  11.528
 1151    HG2  ARG 141           HG2      ARG 141 -13.658 -16.684  11.577
 1152    HG3  ARG 141           HG3      ARG 141 -14.193 -17.249   9.994
 1153    HD2  ARG 141           HD2      ARG 141 -14.877 -19.411  10.980
 1154    HD3  ARG 141           HD3      ARG 141 -14.425 -18.794  12.591
 1155    HE   ARG 141           HE       ARG 141 -16.134 -16.889  11.452
 1156   HH11  ARG 141          HH11      ARG 141 -16.417 -20.295  12.473
 1157   HH12  ARG 141          HH12      ARG 141 -18.106 -20.200  12.806
 1158   HH21  ARG 141          HH21      ARG 141 -18.376 -16.767  11.900
 1159   HH22  ARG 141          HH22      ARG 141 -19.249 -18.147  12.461
 1160    H    ASP 142           H        ASP 142 -10.363 -18.566   8.537
 1161    HA   ASP 142           HA       ASP 142  -8.750 -20.528   9.761
 1162    HB2  ASP 142           HB2      ASP 142  -9.561 -20.709   7.461
 1163    HB3  ASP 142           HB3      ASP 142  -8.536 -19.359   6.958
 1164    H    VAL 143           H        VAL 143  -7.825 -17.348   8.420
 1165    HA   VAL 143           HA       VAL 143  -5.023 -17.618   8.939
 1166    HB   VAL 143           HB       VAL 143  -6.857 -15.225   8.513
 1167   HG11  VAL 143          HG11      VAL 143  -4.950 -14.355   9.781
 1168   HG12  VAL 143          HG12      VAL 143  -3.818 -15.223   8.715
 1169   HG13  VAL 143          HG13      VAL 143  -4.806 -13.881   8.087
 1170   HG21  VAL 143          HG21      VAL 143  -6.491 -16.832   6.597
 1171   HG22  VAL 143          HG22      VAL 143  -5.903 -15.205   6.286
 1172   HG23  VAL 143          HG23      VAL 143  -4.754 -16.502   6.701
 1173    H    TYR 144           H        TYR 144  -7.672 -16.056  10.866
 1174    HA   TYR 144           HA       TYR 144  -6.027 -15.159  12.986
 1175    HB2  TYR 144           HB2      TYR 144  -8.967 -15.951  12.839
 1176    HB3  TYR 144           HB3      TYR 144  -8.221 -15.378  14.317
 1177    HD1  TYR 144           HD1      TYR 144  -7.222 -13.745  11.082
 1178    HD2  TYR 144           HD2      TYR 144  -9.837 -13.623  14.527
 1179    HE1  TYR 144           HE1      TYR 144  -7.863 -11.450  10.519
 1180    HE2  TYR 144           HE2      TYR 144 -10.487 -11.325  13.951
 1181    HH   TYR 144           HH       TYR 144 -10.326  -9.591  12.359
 1182    H    ARG 145           H        ARG 145  -7.715 -18.282  12.500
 1183    HA   ARG 145           HA       ARG 145  -6.973 -19.501  14.951
 1184    HB2  ARG 145           HB2      ARG 145  -8.657 -20.526  13.634
 1185    HB3  ARG 145           HB3      ARG 145  -7.706 -20.457  12.160
 1186    HG2  ARG 145           HG2      ARG 145  -6.220 -22.233  12.955
 1187    HG3  ARG 145           HG3      ARG 145  -7.154 -22.344  14.478
 1188    HD2  ARG 145           HD2      ARG 145  -9.208 -22.816  13.073
 1189    HD3  ARG 145           HD3      ARG 145  -8.179 -22.742  11.636
 1190    HE   ARG 145           HE       ARG 145  -7.293 -24.806  12.069
 1191   HH11  ARG 145          HH11      ARG 145  -9.258 -23.888  14.909
 1192   HH12  ARG 145          HH12      ARG 145  -9.220 -25.464  15.600
 1193   HH21  ARG 145          HH21      ARG 145  -7.261 -26.894  13.002
 1194   HH22  ARG 145          HH22      ARG 145  -8.063 -27.203  14.500
 1195    H    ARG 146           H        ARG 146  -5.298 -19.720  11.719
 1196    HA   ARG 146           HA       ARG 146  -3.082 -21.180  12.622
 1197    HB2  ARG 146           HB2      ARG 146  -3.608 -19.265  10.321
 1198    HB3  ARG 146           HB3      ARG 146  -1.928 -19.598  10.730
 1199    HG2  ARG 146           HG2      ARG 146  -2.432 -21.165   9.100
 1200    HG3  ARG 146           HG3      ARG 146  -2.404 -22.041  10.635
 1201    HD2  ARG 146           HD2      ARG 146  -4.955 -21.883  10.627
 1202    HD3  ARG 146           HD3      ARG 146  -4.815 -21.232   8.987
 1203    HE   ARG 146           HE       ARG 146  -4.024 -23.953   9.942
 1204   HH11  ARG 146          HH11      ARG 146  -5.117 -22.000   7.170
 1205   HH12  ARG 146          HH12      ARG 146  -4.544 -23.129   5.991
 1206   HH21  ARG 146          HH21      ARG 146  -3.533 -25.555   8.376
 1207   HH22  ARG 146          HH22      ARG 146  -3.807 -25.257   6.700
 1208    H    VAL 147           H        VAL 147  -3.398 -17.568  12.556
 1209    HA   VAL 147           HA       VAL 147  -0.876 -16.989  13.573
 1210    HB   VAL 147           HB       VAL 147  -3.537 -15.544  13.998
 1211   HG11  VAL 147          HG11      VAL 147  -1.932 -14.701  15.651
 1212   HG12  VAL 147          HG12      VAL 147  -0.708 -14.472  14.377
 1213   HG13  VAL 147          HG13      VAL 147  -2.199 -13.494  14.388
 1214   HG21  VAL 147          HG21      VAL 147  -2.769 -14.098  12.176
 1215   HG22  VAL 147          HG22      VAL 147  -1.278 -15.074  12.027
 1216   HG23  VAL 147          HG23      VAL 147  -2.843 -15.753  11.617
 1217    H    MET 148           H        MET 148  -3.845 -17.838  15.331
 1218    HA   MET 148           HA       MET 148  -2.792 -17.124  17.893
 1219    HB2  MET 148           HB2      MET 148  -5.253 -18.713  17.118
 1220    HB3  MET 148           HB3      MET 148  -4.826 -18.325  18.792
 1221    HG2  MET 148           HG2      MET 148  -5.267 -16.211  16.656
 1222    HG3  MET 148           HG3      MET 148  -6.517 -16.826  17.717
 1223    HE1  MET 148           HE1      MET 148  -4.216 -14.218  16.937
 1224    HE2  MET 148           HE2      MET 148  -3.730 -13.435  18.444
 1225    HE3  MET 148           HE3      MET 148  -2.869 -14.890  17.894
 1226    H    LYS 149           H        LYS 149  -3.383 -20.313  16.269
 1227    HA   LYS 149           HA       LYS 149  -2.119 -21.829  18.364
 1228    HB2  LYS 149           HB2      LYS 149  -3.622 -22.930  17.122
 1229    HB3  LYS 149           HB3      LYS 149  -2.971 -22.406  15.557
 1230    HG2  LYS 149           HG2      LYS 149  -1.339 -24.211  17.325
 1231    HG3  LYS 149           HG3      LYS 149  -2.673 -24.872  16.369
 1232    HD2  LYS 149           HD2      LYS 149  -1.749 -24.196  14.291
 1233    HD3  LYS 149           HD3      LYS 149  -0.683 -23.018  15.053
 1234    HE2  LYS 149           HE2      LYS 149   0.717 -24.771  14.381
 1235    HE3  LYS 149           HE3      LYS 149   0.565 -24.830  16.148
 1236    HZ1  LYS 149           HZ1      LYS 149   0.417 -27.050  15.134
 1237    HZ2  LYS 149           HZ2      LYS 149  -0.984 -26.697  15.890
 1238    HZ3  LYS 149           HZ3      LYS 149  -0.882 -26.617  14.249
 1239    H    GLU 150           H        GLU 150  -0.679 -20.151  15.571
 1240    HA   GLU 150           HA       GLU 150   1.799 -21.337  15.672
 1241    HB2  GLU 150           HB2      GLU 150   0.572 -19.022  14.480
 1242    HB3  GLU 150           HB3      GLU 150   2.033 -18.447  15.173
 1243    HG2  GLU 150           HG2      GLU 150   2.013 -20.974  13.506
 1244    HG3  GLU 150           HG3      GLU 150   2.046 -19.374  12.803
 1245    H    PHE 151           H        PHE 151   0.556 -18.620  17.579
 1246    HA   PHE 151           HA       PHE 151   3.096 -18.512  19.123
 1247    HB2  PHE 151           HB2      PHE 151   0.829 -16.527  19.056
 1248    HB3  PHE 151           HB3      PHE 151   2.475 -16.299  19.625
 1249    HD1  PHE 151           HD1      PHE 151   3.937 -17.619  17.058
 1250    HD2  PHE 151           HD2      PHE 151   0.816 -14.651  17.609
 1251    HE1  PHE 151           HE1      PHE 151   4.310 -16.793  14.849
 1252    HE2  PHE 151           HE2      PHE 151   1.366 -13.699  15.413
 1253    HZ   PHE 151           HZ       PHE 151   3.091 -14.824  13.973
 1254    H    ALA 152           H        ALA 152  -0.079 -19.724  19.542
 1255    HA   ALA 152           HA       ALA 152  -0.859 -19.088  22.093
 1256    HB1  ALA 152           HB1      ALA 152  -2.286 -20.430  20.607
 1257    HB2  ALA 152           HB2      ALA 152  -1.094 -21.739  20.557
 1258    HB3  ALA 152           HB3      ALA 152  -1.972 -21.385  22.054
 1259    H    SER 153           H        SER 153   1.425 -21.605  21.110
 1260    HA   SER 153           HA       SER 153   1.688 -22.834  23.659
 1261    HB2  SER 153           HB2      SER 153   3.711 -22.802  21.381
 1262    HB3  SER 153           HB3      SER 153   3.523 -24.049  22.631
 1263    HG   SER 153           HG       SER 153   2.506 -24.673  20.664
 1264    H    VAL 154           H        VAL 154   3.282 -20.041  22.161
 1265    HA   VAL 154           HA       VAL 154   5.399 -19.854  24.138
 1266    HB   VAL 154           HB       VAL 154   4.225 -17.680  22.365
 1267   HG11  VAL 154          HG11      VAL 154   6.373 -16.535  22.721
 1268   HG12  VAL 154          HG12      VAL 154   5.544 -16.766  24.275
 1269   HG13  VAL 154          HG13      VAL 154   6.900 -17.822  23.827
 1270   HG21  VAL 154          HG21      VAL 154   6.283 -18.154  20.938
 1271   HG22  VAL 154          HG22      VAL 154   6.545 -19.615  21.898
 1272   HG23  VAL 154          HG23      VAL 154   5.076 -19.440  20.911
 1273    H    VAL 155           H        VAL 155   2.085 -18.479  23.755
 1274    HA   VAL 155           HA       VAL 155   2.328 -16.722  25.944
 1275    HB   VAL 155           HB       VAL 155  -0.243 -18.110  25.125
 1276   HG11  VAL 155          HG11      VAL 155   0.546 -15.600  26.692
 1277   HG12  VAL 155          HG12      VAL 155  -1.086 -15.741  25.969
 1278   HG13  VAL 155          HG13      VAL 155  -0.529 -16.916  27.181
 1279   HG21  VAL 155          HG21      VAL 155   0.807 -15.517  23.962
 1280   HG22  VAL 155          HG22      VAL 155   0.707 -17.072  23.101
 1281   HG23  VAL 155          HG23      VAL 155  -0.774 -16.286  23.637
 1282    H    MET 156           H        MET 156   1.156 -20.209  25.964
 1283    HA   MET 156           HA       MET 156   0.446 -20.179  28.639
 1284    HB2  MET 156           HB2      MET 156   1.586 -22.405  26.900
 1285    HB3  MET 156           HB3      MET 156   1.004 -22.684  28.545
 1286    HG2  MET 156           HG2      MET 156  -1.138 -22.739  27.878
 1287    HG3  MET 156           HG3      MET 156  -1.000 -21.113  27.230
 1288    HE1  MET 156           HE1      MET 156  -3.047 -21.849  25.811
 1289    HE2  MET 156           HE2      MET 156  -1.970 -20.689  24.993
 1290    HE3  MET 156           HE3      MET 156  -2.658 -22.065  24.095
 1291    H    SER 157           H        SER 157   3.626 -20.902  27.199
 1292    HA   SER 157           HA       SER 157   4.905 -21.387  29.697
 1293    HB2  SER 157           HB2      SER 157   5.496 -22.205  27.377
 1294    HB3  SER 157           HB3      SER 157   6.159 -20.595  27.039
 1295    HG   SER 157           HG       SER 157   7.749 -22.147  27.774
 1296    H    LEU 158           H        LEU 158   4.353 -18.470  27.796
 1297    HA   LEU 158           HA       LEU 158   6.109 -16.714  29.152
 1298    HB2  LEU 158           HB2      LEU 158   4.940 -16.333  26.924
 1299    HB3  LEU 158           HB3      LEU 158   3.410 -16.205  27.795
 1300    HG   LEU 158           HG       LEU 158   4.356 -14.215  29.039
 1301   HD11  LEU 158          HD11      LEU 158   6.750 -14.599  28.472
 1302   HD12  LEU 158          HD12      LEU 158   6.377 -14.380  26.757
 1303   HD13  LEU 158          HD13      LEU 158   6.187 -13.018  27.897
 1304   HD21  LEU 158          HD21      LEU 158   3.707 -14.411  26.108
 1305   HD22  LEU 158          HD22      LEU 158   2.646 -13.980  27.476
 1306   HD23  LEU 158          HD23      LEU 158   3.893 -12.833  26.869
 1307    H    GLN 159           H        GLN 159   2.752 -17.703  29.815
 1308    HA   GLN 159           HA       GLN 159   2.448 -16.014  32.155
 1309    HB2  GLN 159           HB2      GLN 159   1.097 -18.720  31.808
 1310    HB3  GLN 159           HB3      GLN 159   0.586 -17.360  32.798
 1311    HG2  GLN 159           HG2      GLN 159   0.105 -16.088  30.641
 1312    HG3  GLN 159           HG3      GLN 159   0.493 -17.550  29.776
 1313   HE21  GLN 159          HE22      GLN 159  -1.576 -16.665  32.616
 1314   HE22  GLN 159          HE21      GLN 159  -2.893 -17.747  32.165
 1315    H    GLU 160           H        GLU 160   3.553 -19.373  31.691
 1316    HA   GLU 160           HA       GLU 160   3.643 -20.012  34.429
 1317    HB2  GLU 160           HB2      GLU 160   4.890 -21.301  31.978
 1318    HB3  GLU 160           HB3      GLU 160   5.058 -21.994  33.597
 1319    HG2  GLU 160           HG2      GLU 160   2.631 -22.079  33.860
 1320    HG3  GLU 160           HG3      GLU 160   2.410 -21.386  32.265
 1321    H    ASN 161           H        ASN 161   6.085 -18.517  32.416
 1322    HA   ASN 161           HA       ASN 161   8.318 -19.262  34.161
 1323    HB2  ASN 161           HB2      ASN 161   7.952 -17.569  31.676
 1324    HB3  ASN 161           HB3      ASN 161   9.385 -17.349  32.660
 1325   HD21  ASN 161          HD22      ASN 161   7.675 -19.730  30.640
 1326   HD22  ASN 161          HD21      ASN 161   9.047 -20.802  30.444
 1327    H    THR 162           H        THR 162   5.850 -16.831  34.322
 1328    HA   THR 162           HA       THR 162   5.756 -14.676  34.835
 1329    HB   THR 162           HB       THR 162   5.894 -14.460  37.128
 1330    HG1  THR 162           HG1      THR 162   8.029 -15.335  37.521
 1331   HG21  THR 162          HG21      THR 162   4.693 -16.422  37.911
 1332   HG22  THR 162          HG22      THR 162   4.241 -16.039  36.234
 1333   HG23  THR 162          HG23      THR 162   5.355 -17.381  36.563
 1334    HA   PRO 163           HA       PRO 163  10.151 -14.215  33.755
 1335    HB2  PRO 163           HB2      PRO 163  10.137 -13.301  31.172
 1336    HB3  PRO 163           HB3      PRO 163   9.886 -15.009  31.628
 1337    HG2  PRO 163           HG2      PRO 163   7.783 -12.911  31.018
 1338    HG3  PRO 163           HG3      PRO 163   7.889 -14.594  30.415
 1339    HD2  PRO 163           HD2      PRO 163   6.347 -13.841  32.591
 1340    HD3  PRO 163           HD3      PRO 163   7.067 -15.465  32.388
 1341    H    LYS 164           H        LYS 164  11.364 -12.113  32.647
 1342    HA   LYS 164           HA       LYS 164  10.354  -9.781  34.154
 1343    HB2  LYS 164           HB2      LYS 164  13.017 -10.073  32.723
 1344    HB3  LYS 164           HB3      LYS 164  12.583  -8.916  33.984
 1345    HG2  LYS 164           HG2      LYS 164  12.950 -11.933  34.306
 1346    HG3  LYS 164           HG3      LYS 164  14.059 -10.677  34.843
 1347    HD2  LYS 164           HD2      LYS 164  12.476  -9.879  36.511
 1348    HD3  LYS 164           HD3      LYS 164  11.214 -10.981  35.918
 1349    HE2  LYS 164           HE2      LYS 164  12.575 -12.938  36.483
 1350    HE3  LYS 164           HE3      LYS 164  13.892 -11.894  37.048
 1351    HZ1  LYS 164           HZ1      LYS 164  11.192 -12.033  38.273
 1352    HZ2  LYS 164           HZ2      LYS 164  12.555 -12.686  38.891
 1353    HZ3  LYS 164           HZ3      LYS 164  12.415 -11.067  38.786