*HEADER    DNA BINDING PROTEIN                     29-JAN-11   2L93              
*TITLE     SOLUTION STRUCTURE OF THE C-TERMINAL DOMAIN OF SALMONELLA H-NS        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DNA-BINDING PROTEIN H-NS;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: C-TERMINAL DOMAIN, RESIDUES 91-137;                        
*COMPND   5 SYNONYM: H-NS, HISTONE-LIKE PROTEIN HLP-II, PROTEIN B1, PROTEIN H1;  
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM;                         
*SOURCE   3 ORGANISM_TAXID: 90371;                                               
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET21A                                     
*KEYWDS    H-NS, AT HOOK, DNA BINDING PROTEIN                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.LI                                                                  
*REVDAT   1   15-JUN-11 2L93    0                                                


# 780 atoms read from pdb file prm10.pdb.
# 7 TYR PHI:  (6 LYS C)-(7 TYR N)-(7 TYR CA)-(7 TYR C) -160.2 -100.2
 &rst     iat =    91,    93,    95,   112,
   r1 = -161.2, r2 = -160.2, r3 = -100.2, r4 = -99.2,
   rk2 =   80.0, rk3 =   80.0,    &end

# 7 TYR PSI:  (7 TYR N)-(7 TYR CA)-(7 TYR C)-(8 SER N) 111.5 171.5
 &rst     iat =    93,    95,   112,   114,
   r1 = 110.5, r2 = 111.5, r3 = 171.5, r4 = 172.5,
 &end

# 8 SER PHI:  (7 TYR C)-(8 SER N)-(8 SER CA)-(8 SER C) -160.1 -100.1
 &rst     iat =   112,   114,   116,   123,
   r1 = -161.1, r2 = -160.1, r3 = -100.1, r4 = -99.1,
 &end

# 8 SER PSI:  (8 SER N)-(8 SER CA)-(8 SER C)-(9 TYR N) 121.0 181.0
 &rst     iat =   114,   116,   123,   125,
   r1 = 120.0, r2 = 121.0, r3 = 181.0, r4 = 182.0,
 &end

# 9 TYR PHI:  (8 SER C)-(9 TYR N)-(9 TYR CA)-(9 TYR C) -168.5 -108.5
 &rst     iat =   123,   125,   127,   144,
   r1 = -169.5, r2 = -168.5, r3 = -108.5, r4 = -107.5,
 &end

# 9 TYR PSI:  (9 TYR N)-(9 TYR CA)-(9 TYR C)-(10 VAL N) 117.7 177.7
 &rst     iat =   125,   127,   144,   146,
   r1 = 116.7, r2 = 117.7, r3 = 177.7, r4 = 178.7,
 &end

# 13 ASN PHI:  (12 GLU C)-(13 ASN N)-(13 ASN CA)-(13 ASN C) -124.1 -64.1
 &rst     iat =   187,   189,   191,   201,
   r1 = -125.1, r2 = -124.1, r3 = -64.1, r4 = -63.1,
 &end

# 13 ASN PSI:  (13 ASN N)-(13 ASN CA)-(13 ASN C)-(14 GLY N) -25.4  34.6
 &rst     iat =   189,   191,   201,   203,
   r1 = -26.4, r2 = -25.4, r3 =  34.6, r4 =  35.6,
 &end

# 15 GLU PHI:  (14 GLY C)-(15 GLU N)-(15 GLU CA)-(15 GLU C) -140.0 -48.6
 &rst     iat =   208,   210,   212,   223,
   r1 = -141.0, r2 = -140.0, r3 = -48.6, r4 = -47.6,
 &end

# 15 GLU PSI:  (15 GLU N)-(15 GLU CA)-(15 GLU C)-(16 THR N)  98.7 158.7
 &rst     iat =   210,   212,   223,   225,
   r1 =  97.7, r2 =  98.7, r3 = 158.7, r4 = 159.7,
 &end

# 16 THR PHI:  (15 GLU C)-(16 THR N)-(16 THR CA)-(16 THR C) -117.3 -57.3
 &rst     iat =   223,   225,   227,   237,
   r1 = -118.3, r2 = -117.3, r3 = -57.3, r4 = -56.3,
 &end

# 16 THR PSI:  (16 THR N)-(16 THR CA)-(16 THR C)-(17 LYS N) -71.1 -11.1
 &rst     iat =   225,   227,   237,   239,
   r1 = -72.1, r2 = -71.1, r3 = -11.1, r4 = -10.1,
 &end

# 17 LYS PHI:  (16 THR C)-(17 LYS N)-(17 LYS CA)-(17 LYS C) -180.8 -120.8
 &rst     iat =   237,   239,   241,   259,
   r1 = -181.8, r2 = -180.8, r3 = -120.8, r4 = -119.8,
 &end

# 17 LYS PSI:  (17 LYS N)-(17 LYS CA)-(17 LYS C)-(18 THR N) 130.0 190.0
 &rst     iat =   239,   241,   259,   261,
   r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
 &end

# 18 THR PHI:  (17 LYS C)-(18 THR N)-(18 THR CA)-(18 THR C) -160.9 -100.9
 &rst     iat =   259,   261,   263,   273,
   r1 = -161.9, r2 = -160.9, r3 = -100.9, r4 = -99.9,
 &end

# 18 THR PSI:  (18 THR N)-(18 THR CA)-(18 THR C)-(19 TRP N) 119.0 179.0
 &rst     iat =   261,   263,   273,   275,
   r1 = 118.0, r2 = 119.0, r3 = 179.0, r4 = 180.0,
 &end

# 19 TRP PHI:  (18 THR C)-(19 TRP N)-(19 TRP CA)-(19 TRP C) -154.4 -94.4
 &rst     iat =   273,   275,   277,   297,
   r1 = -155.4, r2 = -154.4, r3 = -94.4, r4 = -93.4,
 &end

# 19 TRP PSI:  (19 TRP N)-(19 TRP CA)-(19 TRP C)-(20 THR N)  97.8 157.8
 &rst     iat =   275,   277,   297,   299,
   r1 =  96.8, r2 =  97.8, r3 = 157.8, r4 = 158.8,
 &end

# 20 THR PHI:  (19 TRP C)-(20 THR N)-(20 THR CA)-(20 THR C) -120.0 -30.0
 &rst     iat =   297,   299,   301,   311,
   r1 = -121.0, r2 = -120.0, r3 = -30.0, r4 = -29.0,
 &end

# 20 THR PSI:  (20 THR N)-(20 THR CA)-(20 THR C)-(21 GLY N) -60.0   0.0
 &rst     iat =   299,   301,   311,   313,
   r1 = -61.0, r2 = -60.0, r3 =   0.0, r4 =   1.0,
 &end

# 21 GLY PHI:  (20 THR C)-(21 GLY N)-(21 GLY CA)-(21 GLY C)  30.0 120.0
 &rst     iat =   311,   313,   315,   318,
   r1 =  29.0, r2 =  30.0, r3 = 120.0, r4 = 121.0,
 &end

# 21 GLY PSI:  (21 GLY N)-(21 GLY CA)-(21 GLY C)-(22 GLN N) -60.0  60.0
 &rst     iat =   313,   315,   318,   320,
   r1 = -61.0, r2 = -60.0, r3 =  60.0, r4 =  61.0,
 &end

# 22 GLN PHI:  (21 GLY C)-(22 GLN N)-(22 GLN CA)-(22 GLN C) -180.0   0.0
 &rst     iat =   318,   320,   322,   335,
   r1 = -181.0, r2 = -180.0, r3 =   0.0, r4 =   1.0,
 &end

# 22 GLN PSI:  (22 GLN N)-(22 GLN CA)-(22 GLN C)-(23 GLY N) 115.0 180.0
 &rst     iat =   320,   322,   335,   337,
   r1 = 114.0, r2 = 115.0, r3 = 180.0, r4 = 181.0,
 &end

# 24 ARG PHI:  (23 GLY C)-(24 ARG N)-(24 ARG CA)-(24 ARG C) -137.0 -57.4
 &rst     iat =   342,   344,   346,   366,
   r1 = -138.0, r2 = -137.0, r3 = -57.4, r4 = -56.4,
 &end

# 24 ARG PSI:  (24 ARG N)-(24 ARG CA)-(24 ARG C)-(25 THR N)  99.0 159.0
 &rst     iat =   344,   346,   366,   368,
   r1 =  98.0, r2 =  99.0, r3 = 159.0, r4 = 160.0,
 &end

# 25 THR PHI:  (24 ARG C)-(25 THR N)-(25 THR CA)-(25 THR C) -129.8 -53.8
 &rst     iat =   366,   368,   370,   380,
   r1 = -130.8, r2 = -129.8, r3 = -53.8, r4 = -52.8,
 &end

# 25 THR PSI:  (25 THR N)-(25 THR CA)-(25 THR C)-(26 PRO N)  94.0 154.0
 &rst     iat =   368,   370,   380,   382,
   r1 =  93.0, r2 =  94.0, r3 = 154.0, r4 = 155.0,
 &end

# 28 VAL PHI:  (27 ALA C)-(28 VAL N)-(28 VAL CA)-(28 VAL C) -94.4 -34.4
 &rst     iat =   404,   406,   408,   420,
   r1 = -95.4, r2 = -94.4, r3 = -34.4, r4 = -33.4,
 &end

# 28 VAL PSI:  (28 VAL N)-(28 VAL CA)-(28 VAL C)-(29 ILE N) -72.3 -12.3
 &rst     iat =   406,   408,   420,   422,
   r1 = -73.3, r2 = -72.3, r3 = -12.3, r4 = -11.3,
 &end

# 29 ILE PHI:  (28 VAL C)-(29 ILE N)-(29 ILE CA)-(29 ILE C) -94.1 -34.1
 &rst     iat =   420,   422,   424,   439,
   r1 = -95.1, r2 = -94.1, r3 = -34.1, r4 = -33.1,
 &end

# 29 ILE PSI:  (29 ILE N)-(29 ILE CA)-(29 ILE C)-(30 LYS N) -69.1  -9.1
 &rst     iat =   422,   424,   439,   441,
   r1 = -70.1, r2 = -69.1, r3 =  -9.1, r4 =  -8.1,
 &end

# 30 LYS PHI:  (29 ILE C)-(30 LYS N)-(30 LYS CA)-(30 LYS C) -90.4 -30.4
 &rst     iat =   439,   441,   443,   461,
   r1 = -91.4, r2 = -90.4, r3 = -30.4, r4 = -29.4,
 &end

# 30 LYS PSI:  (30 LYS N)-(30 LYS CA)-(30 LYS C)-(31 LYS N) -76.2 -16.2
 &rst     iat =   441,   443,   461,   463,
   r1 = -77.2, r2 = -76.2, r3 = -16.2, r4 = -15.2,
 &end

# 31 LYS PHI:  (30 LYS C)-(31 LYS N)-(31 LYS CA)-(31 LYS C) -92.0 -32.0
 &rst     iat =   461,   463,   465,   483,
   r1 = -93.0, r2 = -92.0, r3 = -32.0, r4 = -31.0,
 &end

# 31 LYS PSI:  (31 LYS N)-(31 LYS CA)-(31 LYS C)-(32 ALA N) -72.7 -12.7
 &rst     iat =   463,   465,   483,   485,
   r1 = -73.7, r2 = -72.7, r3 = -12.7, r4 = -11.7,
 &end

# 32 ALA PHI:  (31 LYS C)-(32 ALA N)-(32 ALA CA)-(32 ALA C) -99.6 -39.6
 &rst     iat =   483,   485,   487,   493,
   r1 = -100.6, r2 = -99.6, r3 = -39.6, r4 = -38.6,
 &end

# 32 ALA PSI:  (32 ALA N)-(32 ALA CA)-(32 ALA C)-(33 MET N) -69.2  -9.2
 &rst     iat =   485,   487,   493,   495,
   r1 = -70.2, r2 = -69.2, r3 =  -9.2, r4 =  -8.2,
 &end

# 33 MET PHI:  (32 ALA C)-(33 MET N)-(33 MET CA)-(33 MET C) -93.7 -33.7
 &rst     iat =   493,   495,   497,   510,
   r1 = -94.7, r2 = -93.7, r3 = -33.7, r4 = -32.7,
 &end

# 33 MET PSI:  (33 MET N)-(33 MET CA)-(33 MET C)-(34 GLU N) -73.8 -13.8
 &rst     iat =   495,   497,   510,   512,
   r1 = -74.8, r2 = -73.8, r3 = -13.8, r4 = -12.8,
 &end

# 34 GLU PHI:  (33 MET C)-(34 GLU N)-(34 GLU CA)-(34 GLU C) -101.0 -41.0
 &rst     iat =   510,   512,   514,   525,
   r1 = -102.0, r2 = -101.0, r3 = -41.0, r4 = -40.0,
 &end

# 34 GLU PSI:  (34 GLU N)-(34 GLU CA)-(34 GLU C)-(35 GLU N) -64.2  -4.2
 &rst     iat =   512,   514,   525,   527,
   r1 = -65.2, r2 = -64.2, r3 =  -4.2, r4 =  -3.2,
 &end

# 35 GLU PHI:  (34 GLU C)-(35 GLU N)-(35 GLU CA)-(35 GLU C) -111.4 -51.4
 &rst     iat =   525,   527,   529,   540,
   r1 = -112.4, r2 = -111.4, r3 = -51.4, r4 = -50.4,
 &end

# 35 GLU PSI:  (35 GLU N)-(35 GLU CA)-(35 GLU C)-(36 GLN N) -67.6  -7.6
 &rst     iat =   527,   529,   540,   542,
   r1 = -68.6, r2 = -67.6, r3 =  -7.6, r4 =  -6.6,
 &end

# 36 GLN PHI:  (35 GLU C)-(36 GLN N)-(36 GLN CA)-(36 GLN C) -134.1 -74.1
 &rst     iat =   540,   542,   544,   557,
   r1 = -135.1, r2 = -134.1, r3 = -74.1, r4 = -73.1,
 &end

# 36 GLN PSI:  (36 GLN N)-(36 GLN CA)-(36 GLN C)-(37 GLY N) -34.5  25.5
 &rst     iat =   542,   544,   557,   559,
   r1 = -35.5, r2 = -34.5, r3 =  25.5, r4 =  26.5,
 &end

# 37 GLY PHI:  (36 GLN C)-(37 GLY N)-(37 GLY CA)-(37 GLY C)  39.6  99.6
 &rst     iat =   557,   559,   561,   564,
   r1 =  38.6, r2 =  39.6, r3 =  99.6, r4 = 100.6,
 &end

# 37 GLY PSI:  (37 GLY N)-(37 GLY CA)-(37 GLY C)-(38 LYS N)  -8.4  51.6
 &rst     iat =   559,   561,   564,   566,
   r1 =  -9.4, r2 =  -8.4, r3 =  51.6, r4 =  52.6,
 &end

# 39 GLN PHI:  (38 LYS C)-(39 GLN N)-(39 GLN CA)-(39 GLN C) -152.1 -92.1
 &rst     iat =   586,   588,   590,   603,
   r1 = -153.1, r2 = -152.1, r3 = -92.1, r4 = -91.1,
 &end

# 39 GLN PSI:  (39 GLN N)-(39 GLN CA)-(39 GLN C)-(40 LEU N) 128.3 188.3
 &rst     iat =   588,   590,   603,   605,
   r1 = 127.3, r2 = 128.3, r3 = 188.3, r4 = 189.3,
 &end

# 40 LEU PHI:  (39 GLN C)-(40 LEU N)-(40 LEU CA)-(40 LEU C) -87.0 -27.0
 &rst     iat =   603,   605,   607,   622,
   r1 = -88.0, r2 = -87.0, r3 = -27.0, r4 = -26.0,
 &end

# 40 LEU PSI:  (40 LEU N)-(40 LEU CA)-(40 LEU C)-(41 GLU N) -74.8 -14.8
 &rst     iat =   605,   607,   622,   624,
   r1 = -75.8, r2 = -74.8, r3 = -14.8, r4 = -13.8,
 &end

# 41 GLU PHI:  (40 LEU C)-(41 GLU N)-(41 GLU CA)-(41 GLU C) -93.7 -33.7
 &rst     iat =   622,   624,   626,   637,
   r1 = -94.7, r2 = -93.7, r3 = -33.7, r4 = -32.7,
 &end

# 41 GLU PSI:  (41 GLU N)-(41 GLU CA)-(41 GLU C)-(42 ASP N) -69.5  -9.5
 &rst     iat =   624,   626,   637,   639,
   r1 = -70.5, r2 = -69.5, r3 =  -9.5, r4 =  -8.5,
 &end

# 42 ASP PHI:  (41 GLU C)-(42 ASP N)-(42 ASP CA)-(42 ASP C) -93.8 -33.8
 &rst     iat =   637,   639,   641,   649,
   r1 = -94.8, r2 = -93.8, r3 = -33.8, r4 = -32.8,
 &end

# 42 ASP PSI:  (42 ASP N)-(42 ASP CA)-(42 ASP C)-(43 PHE N) -70.0 -10.0
 &rst     iat =   639,   641,   649,   651,
   r1 = -71.0, r2 = -70.0, r3 = -10.0, r4 =  -9.0,
 &end

# 43 PHE PHI:  (42 ASP C)-(43 PHE N)-(43 PHE CA)-(43 PHE C) -122.0 -62.0
 &rst     iat =   649,   651,   653,   669,
   r1 = -123.0, r2 = -122.0, r3 = -62.0, r4 = -61.0,
 &end

# 43 PHE PSI:  (43 PHE N)-(43 PHE CA)-(43 PHE C)-(44 LEU N) -34.6  25.4
 &rst     iat =   651,   653,   669,   671,
   r1 = -35.6, r2 = -34.6, r3 =  25.4, r4 =  26.4,
 &end

# 44 LEU PHI:  (43 PHE C)-(44 LEU N)-(44 LEU CA)-(44 LEU C) -112.7 -52.7
 &rst     iat =   669,   671,   673,   688,
   r1 = -113.7, r2 = -112.7, r3 = -52.7, r4 = -51.7,
 &end

# 44 LEU PSI:  (44 LEU N)-(44 LEU CA)-(44 LEU C)-(45 ILE N) 100.7 160.7
 &rst     iat =   671,   673,   688,   690,
   r1 =  99.7, r2 = 100.7, r3 = 160.7, r4 = 161.7,
 &end

# 45 ILE PHI:  (44 LEU C)-(45 ILE N)-(45 ILE CA)-(45 ILE C) -123.3 -63.3
 &rst     iat =   688,   690,   692,   707,
   r1 = -124.3, r2 = -123.3, r3 = -63.3, r4 = -62.3,
 &end

# 45 ILE PSI:  (45 ILE N)-(45 ILE CA)-(45 ILE C)-(46 LYS N) -64.8  -4.8
 &rst     iat =   690,   692,   707,   709,
   r1 = -65.8, r2 = -64.8, r3 =  -4.8, r4 =  -3.8,
 &end

#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,11,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 150., rk3=150.,  &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=13,21,16,17, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=25,30,28,29, &end
#
#  chirality for residue 3 atoms:  CB CD HG2 HG3
 &rst iat=27,33,31,32, &end
#
#  chirality for residue 3 atoms:  CG NE HD2 HD3
 &rst iat=30,36,34,35, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=23,45,26,27, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=57,51,55,56, &end
#
#  chirality for residue 4 atoms:  CB CD HG2 HG3
 &rst iat=54,48,52,53, &end
#
#  chirality for residue 4 atoms:  CG N HD2 HD3
 &rst iat=51,47,49,50, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=47,59,58,54, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=61,69,64,65, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=73,78,76,77, &end
#
#  chirality for residue 6 atoms:  CB CD HG2 HG3
 &rst iat=75,81,79,80, &end
#
#  chirality for residue 6 atoms:  CD NZ HE2 HE3
 &rst iat=81,87,85,86, &end
#
#  chirality for residue 6 atoms:  CG CE HD2 HD3
 &rst iat=78,84,82,83, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=71,91,74,75, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=95,100,98,99, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=93,112,96,97, &end
#
#  chirality for residue 8 atoms:  CA OG HB2 HB3
 &rst iat=116,121,119,120, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=114,123,117,118, &end
#
#  chirality for residue 9 atoms:  CA CG HB2 HB3
 &rst iat=127,132,130,131, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=125,144,128,129, &end
#
#  chirality for residue 10 atoms:  CA CG1 CG2 HB
 &rst iat=148,152,156,151, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=146,160,149,150, &end
#
#  chirality for residue 11 atoms:  CA CG HB2 HB3
 &rst iat=164,169,167,168, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=162,172,165,166, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=176,181,179,180, &end
#
#  chirality for residue 12 atoms:  CB CD HG2 HG3
 &rst iat=178,184,182,183, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=174,187,177,178, &end
#
#  chirality for residue 13 atoms:  CA CG HB2 HB3
 &rst iat=191,196,194,195, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=189,201,192,193, &end
#
#  chirality for residue 14 atoms:  N C HA2 HA3
 &rst iat=203,208,206,207, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=212,217,215,216, &end
#
#  chirality for residue 15 atoms:  CB CD HG2 HG3
 &rst iat=214,220,218,219, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=210,223,213,214, &end
#
#  chirality for residue 16 atoms:  CA CG2 OG1 HB
 &rst iat=227,231,235,230, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=225,237,228,229, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=241,246,244,245, &end
#
#  chirality for residue 17 atoms:  CB CD HG2 HG3
 &rst iat=243,249,247,248, &end
#
#  chirality for residue 17 atoms:  CD NZ HE2 HE3
 &rst iat=249,255,253,254, &end
#
#  chirality for residue 17 atoms:  CG CE HD2 HD3
 &rst iat=246,252,250,251, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=239,259,242,243, &end
#
#  chirality for residue 18 atoms:  CA CG2 OG1 HB
 &rst iat=263,267,271,266, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=261,273,264,265, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=277,282,280,281, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=275,297,278,279, &end
#
#  chirality for residue 20 atoms:  CA CG2 OG1 HB
 &rst iat=301,305,309,304, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=299,311,302,303, &end
#
#  chirality for residue 21 atoms:  N C HA2 HA3
 &rst iat=313,318,316,317, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=322,327,325,326, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=324,330,328,329, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=320,335,323,324, &end
#
#  chirality for residue 23 atoms:  N C HA2 HA3
 &rst iat=337,342,340,341, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=346,351,349,350, &end
#
#  chirality for residue 24 atoms:  CB CD HG2 HG3
 &rst iat=348,354,352,353, &end
#
#  chirality for residue 24 atoms:  CG NE HD2 HD3
 &rst iat=351,357,355,356, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=344,366,347,348, &end
#
#  chirality for residue 25 atoms:  CA CG2 OG1 HB
 &rst iat=370,374,378,373, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=368,380,371,372, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=392,386,390,391, &end
#
#  chirality for residue 26 atoms:  CB CD HG2 HG3
 &rst iat=389,383,387,388, &end
#
#  chirality for residue 26 atoms:  CG N HD2 HD3
 &rst iat=386,382,384,385, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=382,394,393,389, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=396,404,399,400, &end
#
#  chirality for residue 28 atoms:  CA CG1 CG2 HB
 &rst iat=408,412,416,411, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=406,420,409,410, &end
#
#  chirality for residue 29 atoms:  CA CG2 CG1 HB
 &rst iat=424,428,432,427, &end
#
#  chirality for residue 29 atoms:  CB CD1 HG12 HG13
 &rst iat=426,435,433,434, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=422,439,425,426, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=443,448,446,447, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=445,451,449,450, &end
#
#  chirality for residue 30 atoms:  CD NZ HE2 HE3
 &rst iat=451,457,455,456, &end
#
#  chirality for residue 30 atoms:  CG CE HD2 HD3
 &rst iat=448,454,452,453, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=441,461,444,445, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=465,470,468,469, &end
#
#  chirality for residue 31 atoms:  CB CD HG2 HG3
 &rst iat=467,473,471,472, &end
#
#  chirality for residue 31 atoms:  CD NZ HE2 HE3
 &rst iat=473,479,477,478, &end
#
#  chirality for residue 31 atoms:  CG CE HD2 HD3
 &rst iat=470,476,474,475, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=463,483,466,467, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=485,493,488,489, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=497,502,500,501, &end
#
#  chirality for residue 33 atoms:  CB SD HG2 HG3
 &rst iat=499,505,503,504, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=495,510,498,499, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=514,519,517,518, &end
#
#  chirality for residue 34 atoms:  CB CD HG2 HG3
 &rst iat=516,522,520,521, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=512,525,515,516, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=529,534,532,533, &end
#
#  chirality for residue 35 atoms:  CB CD HG2 HG3
 &rst iat=531,537,535,536, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=527,540,530,531, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=544,549,547,548, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=546,552,550,551, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=542,557,545,546, &end
#
#  chirality for residue 37 atoms:  N C HA2 HA3
 &rst iat=559,564,562,563, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=568,573,571,572, &end
#
#  chirality for residue 38 atoms:  CB CD HG2 HG3
 &rst iat=570,576,574,575, &end
#
#  chirality for residue 38 atoms:  CD NZ HE2 HE3
 &rst iat=576,582,580,581, &end
#
#  chirality for residue 38 atoms:  CG CE HD2 HD3
 &rst iat=573,579,577,578, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=566,586,569,570, &end
#
#  chirality for residue 39 atoms:  CA CG HB2 HB3
 &rst iat=590,595,593,594, &end
#
#  chirality for residue 39 atoms:  CB CD HG2 HG3
 &rst iat=592,598,596,597, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=588,603,591,592, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=607,612,610,611, &end
#
#  chirality for residue 40 atoms:  CB CD1 CD2 HG
 &rst iat=609,614,618,613, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=605,622,608,609, &end
#
#  chirality for residue 41 atoms:  CA CG HB2 HB3
 &rst iat=626,631,629,630, &end
#
#  chirality for residue 41 atoms:  CB CD HG2 HG3
 &rst iat=628,634,632,633, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=624,637,627,628, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=641,646,644,645, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=639,649,642,643, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=653,658,656,657, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=651,669,654,655, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=673,678,676,677, &end
#
#  chirality for residue 44 atoms:  CB CD1 CD2 HG
 &rst iat=675,680,684,679, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=671,688,674,675, &end
#
#  chirality for residue 45 atoms:  CA CG2 CG1 HB
 &rst iat=692,696,700,695, &end
#
#  chirality for residue 45 atoms:  CB CD1 HG12 HG13
 &rst iat=694,703,701,702, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=690,707,693,694, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=711,716,714,715, &end
#
#  chirality for residue 46 atoms:  CB CD HG2 HG3
 &rst iat=713,719,717,718, &end
#
#  chirality for residue 46 atoms:  CD NZ HE2 HE3
 &rst iat=719,725,723,724, &end
#
#  chirality for residue 46 atoms:  CG CE HD2 HD3
 &rst iat=716,722,720,721, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=709,729,712,713, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=733,738,736,737, &end
#
#  chirality for residue 47 atoms:  CB CD HG2 HG3
 &rst iat=735,741,739,740, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=731,744,734,735, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=748,753,751,752, &end
#
#  chirality for residue 48 atoms:  CB CD1 CD2 HG
 &rst iat=750,755,759,754, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=746,763,749,750, &end
#
#  chirality for residue 49 atoms:  CA CG HB2 HB3
 &rst iat=767,772,770,771, &end
#
#  chirality for residue 49 atoms:  CB CD HG2 HG3
 &rst iat=769,775,773,774, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=765,778,768,769, &end
#
#  trans-omega constraint for residue 2
 &rst iat=15,13,11,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 150., rk3=150.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=25,23,21,15, &end
#
#  trans-omega constraint for residue 4
 &rst iat=57,47,45,25, &end
#
#  trans-omega constraint for residue 5
 &rst iat=63,61,59,57, &end
#
#  trans-omega constraint for residue 6
 &rst iat=73,71,69,63, &end
#
#  trans-omega constraint for residue 7
 &rst iat=95,93,91,73, &end
#
#  trans-omega constraint for residue 8
 &rst iat=116,114,112,95, &end
#
#  trans-omega constraint for residue 9
 &rst iat=127,125,123,116, &end
#
#  trans-omega constraint for residue 10
 &rst iat=148,146,144,127, &end
#
#  trans-omega constraint for residue 11
 &rst iat=164,162,160,148, &end
#
#  trans-omega constraint for residue 12
 &rst iat=176,174,172,164, &end
#
#  trans-omega constraint for residue 13
 &rst iat=191,189,187,176, &end
#
#  trans-omega constraint for residue 14
 &rst iat=205,203,201,191, &end
#
#  trans-omega constraint for residue 15
 &rst iat=212,210,208,205, &end
#
#  trans-omega constraint for residue 16
 &rst iat=227,225,223,212, &end
#
#  trans-omega constraint for residue 17
 &rst iat=241,239,237,227, &end
#
#  trans-omega constraint for residue 18
 &rst iat=263,261,259,241, &end
#
#  trans-omega constraint for residue 19
 &rst iat=277,275,273,263, &end
#
#  trans-omega constraint for residue 20
 &rst iat=301,299,297,277, &end
#
#  trans-omega constraint for residue 21
 &rst iat=315,313,311,301, &end
#
#  trans-omega constraint for residue 22
 &rst iat=322,320,318,315, &end
#
#  trans-omega constraint for residue 23
 &rst iat=339,337,335,322, &end
#
#  trans-omega constraint for residue 24
 &rst iat=346,344,342,339, &end
#
#  trans-omega constraint for residue 25
 &rst iat=370,368,366,346, &end
#
#  trans-omega constraint for residue 26
 &rst iat=392,382,380,370, &end
#
#  trans-omega constraint for residue 27
 &rst iat=398,396,394,392, &end
#
#  trans-omega constraint for residue 28
 &rst iat=408,406,404,398, &end
#
#  trans-omega constraint for residue 29
 &rst iat=424,422,420,408, &end
#
#  trans-omega constraint for residue 30
 &rst iat=443,441,439,424, &end
#
#  trans-omega constraint for residue 31
 &rst iat=465,463,461,443, &end
#
#  trans-omega constraint for residue 32
 &rst iat=487,485,483,465, &end
#
#  trans-omega constraint for residue 33
 &rst iat=497,495,493,487, &end
#
#  trans-omega constraint for residue 34
 &rst iat=514,512,510,497, &end
#
#  trans-omega constraint for residue 35
 &rst iat=529,527,525,514, &end
#
#  trans-omega constraint for residue 36
 &rst iat=544,542,540,529, &end
#
#  trans-omega constraint for residue 37
 &rst iat=561,559,557,544, &end
#
#  trans-omega constraint for residue 38
 &rst iat=568,566,564,561, &end
#
#  trans-omega constraint for residue 39
 &rst iat=590,588,586,568, &end
#
#  trans-omega constraint for residue 40
 &rst iat=607,605,603,590, &end
#
#  trans-omega constraint for residue 41
 &rst iat=626,624,622,607, &end
#
#  trans-omega constraint for residue 42
 &rst iat=641,639,637,626, &end
#
#  trans-omega constraint for residue 43
 &rst iat=653,651,649,641, &end
#
#  trans-omega constraint for residue 44
 &rst iat=673,671,669,653, &end
#
#  trans-omega constraint for residue 45
 &rst iat=692,690,688,673, &end
#
#  trans-omega constraint for residue 46
 &rst iat=711,709,707,692, &end
#
#  trans-omega constraint for residue 47
 &rst iat=733,731,729,711, &end
#
#  trans-omega constraint for residue 48
 &rst iat=748,746,744,733, &end
#
#  trans-omega constraint for residue 49
 &rst iat=767,765,763,748, &end
#
#  9 TYR  HN      17 LYS  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 260, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05, 
      rk2=100.0, rk3=100.0, ir6=1, ialtd=1,
 &end
#
#  7 TYR  HN      19 TRP  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat=  94, 298, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
# 16 THR  HN       9 TYR  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 226, 145, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
# 17 LYS  HN       9 TYR  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 145, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
# 19 TRP  HN       7 TYR  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 113, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
# 31 LYS  HN      27 ALA  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 405, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
# 32 ALA  HN      28 VAL  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 421, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
# 33 MET  HN      29 ILE  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 496, 440, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
# 34 GLU  HN      30 LYS  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 462, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
# 43 PHE  HN      40 LEU  O       1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 623, r1= 0.00, r2= 1.80, r3= 2.30, r4= 3.05,  &end
#
#  9 TYR  N      17 LYS  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 125, 260, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
#  7 TYR  N      19 TRP  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat=  93, 298, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
# 16 THR  N       9 TYR  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 225, 145, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
# 17 LYS  N       9 TYR  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 239, 145, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
# 19 TRP  N       7 TYR  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 113, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
# 31 LYS  N      27 ALA  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 405, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
# 32 ALA  N      28 VAL  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 485, 421, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
# 33 MET  N      29 ILE  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 495, 440, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
# 34 GLU  N      30 LYS  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 512, 462, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
# 43 PHE  N      40 LEU  O       2.5 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 623, r1= 0.00, r2= 2.50, r3= 3.30, r4= 4.05,  &end
#
#   19 TRP  HN           18 THR  HB          4.50    (#      3:20  Unique         2.40, 2.48 A)
 &rst
  ixpk= 3, nxpk= 20, iat= 276, 266, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#   25 THR  HN           25 THR  HB          4.50    (#      4:20  Unique         2.57, 2.62 A)
 &rst
  ixpk= 4, nxpk= 20, iat= 369, 373, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   16 THR  HN           16 THR  HB          3.50    (#      5:20  Unique         2.24, 2.46 A)
 &rst
  ixpk= 5, nxpk= 20, iat= 226, 230, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 TYR  HN            8 SER  HB-         4.50    (#      6:20  Unique         2.25, 3.59 A)
 &rst
  ixpk= 6, nxpk= 20, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 119, 120,
 &end
#
#    8 SER  HN            8 SER  HB+         6.00    (#      7:20  Unique         2.75, 3.34 A)
 &rst
  ixpk= 7, nxpk= 20, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 119, 120,
 &end
#
#   28 VAL  HN           28 VAL  HA          4.50    (#      8:20  Unique         2.87, 2.88 A)
 &rst
  ixpk= 8, nxpk= 20, iat= 407, 409, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 LYS  HN           16 THR  HA          4.50    (#      9:20  Unique         3.47, 3.51 A)
 &rst
  ixpk= 9, nxpk= 20, iat= 240, 228, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 ALA  HN            4 PRO  HA          2.80    (#     10:20  Unique         2.22, 2.36 A)
 &rst
  ixpk= 10, nxpk= 20, iat=  62,  58, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   46 LYS  HN           45 ILE  HA          4.50    (#     11:20  Unique         3.43, 3.56 A)
 &rst
  ixpk= 11, nxpk= 20, iat= 710, 693, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 ILE  HN           45 ILE  HA          6.00    (#     12:20  Unique         2.96, 3.00 A)
 &rst
  ixpk= 12, nxpk= 20, iat= 691, 693, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   27 ALA  HN           26 PRO  HA          4.50    (#     13:20  Unique         2.24, 2.26 A)
 &rst
  ixpk= 13, nxpk= 20, iat= 397, 393, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 ASP  HN           10 VAL  HA          2.80    (#     14:20  Unique         2.16, 2.25 A)
 &rst
  ixpk= 14, nxpk= 20, iat= 163, 149, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   10 VAL  HN           10 VAL  HA          6.00    (#     15:20  Unique         2.95, 2.98 A)
 &rst
  ixpk= 15, nxpk= 20, iat= 147, 149, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   19 TRP  HH2          25 THR  HA          4.50    (#     16:20  Unique         2.73, 2.91 A)
 &rst
  ixpk= 16, nxpk= 20, iat= 291, 371, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   19 TRP  HN           18 THR  HA          3.50    (#     17:20  Unique         2.31, 2.35 A)
 &rst
  ixpk= 17, nxpk= 20, iat= 276, 264, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 GLU  HN           41 GLU  HA          3.50    (#     18:20  Unique         2.79, 2.83 A)
 &rst
  ixpk= 18, nxpk= 20, iat= 625, 627, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 ASP  HN           41 GLU  HA          6.00    (#     19:20  Unique         3.46, 3.56 A)
 &rst
  ixpk= 19, nxpk= 20, iat= 640, 627, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   44 LEU  HN           41 GLU  HA          6.00    (#     20:20  Unique         2.62, 2.90 A)
 &rst
  ixpk= 20, nxpk= 20, iat= 672, 627, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    7 TYR  HE           41 GLU  HA          4.50    (#     21:20  Unique         3.72, 6.10 A)
 &rst
  ixpk= 21, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 104, 109,
 &end
#
#   30 LYS  HN           30 LYS  HA          4.50    (#     22:20  Unique         2.83, 2.84 A)
 &rst
  ixpk= 22, nxpk= 20, iat= 442, 444, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 GLU  HN           12 GLU  HA          3.50    (#     23:20  Unique         2.82, 2.90 A)
 &rst
  ixpk= 23, nxpk= 20, iat= 175, 177, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 LYS  HN           31 LYS  HA          3.50    (#     24:20  Unique         2.85, 2.88 A)
 &rst
  ixpk= 24, nxpk= 20, iat= 464, 466, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 MET  HN           33 MET  HA          4.50    (#     25:20  Unique         2.86, 2.89 A)
 &rst
  ixpk= 25, nxpk= 20, iat= 496, 498, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 LYS  HN           33 MET  HA          3.50    (#     26:20  Unique         2.43, 2.70 A)
 &rst
  ixpk= 26, nxpk= 20, iat= 567, 498, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 LEU  HN           40 LEU  HA          3.50    (#     27:20  Unique         2.77, 2.82 A)
 &rst
  ixpk= 27, nxpk= 20, iat= 606, 608, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 PHE  HD           40 LEU  HA          3.50    (#     28:20  Unique         2.25, 4.49 A)
 &rst
  ixpk= 28, nxpk= 20, iat=  -1, 608, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 660, 668,
 &end
#
#   34 GLU  HN           34 GLU  HA          3.50    (#     29:20  Unique         2.86, 2.88 A)
 &rst
  ixpk= 29, nxpk= 20, iat= 513, 515, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 GLU  HN           35 GLU  HA          4.50    (#     30:20  Unique         2.95, 2.98 A)
 &rst
  ixpk= 30, nxpk= 20, iat= 528, 530, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 ASP  HN           42 ASP  HA          4.50    (#     31:20  Unique         2.89, 2.91 A)
 &rst
  ixpk= 31, nxpk= 20, iat= 640, 642, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    9 TYR  HN            8 SER  HA          3.50    (#     32:20  Unique         2.25, 2.33 A)
 &rst
  ixpk= 32, nxpk= 20, iat= 126, 117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 SER  HN            7 TYR  HA          3.50    (#     33:20  Unique         2.28, 2.35 A)
 &rst
  ixpk= 33, nxpk= 20, iat= 115,  96, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    6 LYS  HN            6 LYS  HA          4.50    (#     35:20  Unique         2.90, 2.92 A)
 &rst
  ixpk= 35, nxpk= 20, iat=  72,  74, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   47 GLU  HN           47 GLU  HA          4.50    (#     36:20  Unique         2.30, 2.93 A)
 &rst
  ixpk= 36, nxpk= 20, iat= 732, 734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:37      47 GLU  HA          3.50    (#     37:20  Single Ambig)
 &rst
  ixpk= 37, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 747, 766,
 &end
#
#   24 ARG  HN           24 ARG  HA          4.50    (#     38:20  Unique         2.84, 2.89 A)
 &rst
  ixpk= 38, nxpk= 20, iat= 345, 347, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   46 LYS  HN            0 AMB  20-1:39     3.50    (#     39:20  Single Ambig)
 &rst
  ixpk= 39, nxpk= 20, iat= 710,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 712, 674,
 &end
#
#    0 AMB  20-2:40       0 AMB  20-1:40     3.50    (#     40:20  Double Ambig)
 &rst
  ixpk= 40, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 732,  94,
 igr2= 712,  74,
 &end
#
#   45 ILE  HN           44 LEU  HA          2.80    (#     41:20  Unique         2.07, 2.18 A)
 &rst
  ixpk= 41, nxpk= 20, iat= 691, 674, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   44 LEU  HN           44 LEU  HA          4.50    (#     42:20  Unique         2.82, 2.85 A)
 &rst
  ixpk= 42, nxpk= 20, iat= 672, 674, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 TYR  HD           44 LEU  HA          3.50    (#     43:20  Unique         2.20, 3.91 A)
 &rst
  ixpk= 43, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 102, 111,
 &end
#
#   25 THR  HN           24 ARG  HA          2.80    (#     44:20  Unique         2.14, 2.20 A)
 &rst
  ixpk= 44, nxpk= 20, iat= 369, 347, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    9 TYR  HN            9 TYR  HA          4.50    (#     45:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 45, nxpk= 20, iat= 126, 128, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 VAL  HN            9 TYR  HA          3.50    (#     46:20  Unique         2.29, 2.38 A)
 &rst
  ixpk= 46, nxpk= 20, iat= 147, 128, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   15 GLU  HN           15 GLU  HA          4.50    (#     47:20  Unique         2.77, 2.84 A)
 &rst
  ixpk= 47, nxpk= 20, iat= 211, 213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   16 THR  HN           15 GLU  HA          2.80    (#     48:20  Unique         2.07, 2.15 A)
 &rst
  ixpk= 48, nxpk= 20, iat= 226, 213, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   39 GLN  HN           38 LYS  HA          2.80    (#     49:20  Unique         2.33, 2.41 A)
 &rst
  ixpk= 49, nxpk= 20, iat= 589, 569, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   38 LYS  HN           38 LYS  HA          4.50    (#     50:20  Unique         2.90, 2.92 A)
 &rst
  ixpk= 50, nxpk= 20, iat= 567, 569, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:51      48 LEU  HA          2.80    (#     51:20  Single Ambig)
 &rst
  ixpk= 51, nxpk= 20, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 766, 747,
 &end
#
#    0 AMB  20-2:52      32 ALA  HA          3.50    (#     52:20  Single Ambig)
 &rst
  ixpk= 52, nxpk= 20, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 486, 543,
 &end
#
#   23 GLY  HN           22 GLN  HA          4.50    (#     53:20  Unique         2.26, 2.33 A)
 &rst
  ixpk= 53, nxpk= 20, iat= 338, 323, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 THR  HN           17 LYS  HA          6.00    (#     54:20  Unique         2.29, 2.35 A)
 &rst
  ixpk= 54, nxpk= 20, iat= 262, 242, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    5 ALA  HN            5 ALA  HA          6.00    (#     55:20  Unique         2.87, 2.92 A)
 &rst
  ixpk= 55, nxpk= 20, iat=  62,  64, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    6 LYS  HN            5 ALA  HA          2.80    (#     56:20  Unique         2.23, 2.34 A)
 &rst
  ixpk= 56, nxpk= 20, iat=  72,  64, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    2 ALA  HN            1 ALA  HA          6.00    (#     57:20  Unique         2.30, 2.34 A)
 &rst
  ixpk= 57, nxpk= 20, iat=  14,   6, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    3 ARG  HN            2 ALA  HA          4.50    (#     58:20  Unique         2.38, 2.73 A)
 &rst
  ixpk= 58, nxpk= 20, iat=  24,  16, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 GLY  HN            0 AMB  20-1:59     2.80    (#     59:20  Single Ambig)
 &rst
  ixpk= 59, nxpk= 20, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 562, 563, 562, 563,
 &end
#
#   38 LYS  HN            0 AMB  20-1:60     4.50    (#     60:20  Single Ambig)
 &rst
  ixpk= 60, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:61      14 GLY  HA-         3.50    (#     61:20  Single Ambig)
 &rst
  ixpk= 61, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 211, 204,
 igr2= 206, 207,
 &end
#
#    0 AMB  20-2:62       0 AMB  20-1:62     2.80    (#     62:20  Double Ambig)
 &rst
  ixpk= 62, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 211, 204,
 igr2= 206, 207, 206, 207,
 &end
#
#   24 ARG  HN           23 GLY  HA-         3.50    (#     63:20  Unique         2.17, 2.66 A)
 &rst
  ixpk= 63, nxpk= 20, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 340, 341,
 &end
#
#   23 GLY  HN           23 GLY  HA+         6.00    (#     64:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 64, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 340, 341,
 &end
#
#   24 ARG  HN           23 GLY  HA+         4.50    (#     65:20  Unique         2.17, 2.66 A)
 &rst
  ixpk= 65, nxpk= 20, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 340, 341,
 &end
#
#    7 TYR  HE           21 GLY  HA-         4.50    (#     66:20  Unique         2.20, 4.39 A)
 &rst
  ixpk= 66, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 104, 109,
 igr2= 316, 317,
 &end
#
#   44 LEU  HN           44 LEU  HB-         3.50    (#     67:20  Unique         2.02, 2.65 A)
 &rst
  ixpk= 67, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 676, 677,
 &end
#
#   44 LEU  HN           44 LEU  HB+         4.50    (#     68:20  Unique         2.02, 2.65 A)
 &rst
  ixpk= 68, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 676, 677,
 &end
#
#    0 AMB  20-2:71       0 AMB  20-1:71     4.50    (#     71:20  Double Ambig)
 &rst
  ixpk= 71, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 766, 747,
 igr2= 751, 752, 751, 752,
 &end
#
#    0 AMB  20-2:72      48 LEU  HB-         4.50    (#     72:20  Single Ambig)
 &rst
  ixpk= 72, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 766, 747,
 igr2= 751, 752,
 &end
#
#    7 TYR  HD            7 TYR  HB-         4.50    (#     74:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 74, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 102, 111,
 igr2=  98,  99,
 &end
#
#    7 TYR  HD            7 TYR  HB+         4.50    (#     75:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 75, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 102, 111,
 igr2=  98,  99,
 &end
#
#    0 AMB  20-2:76       0 AMB  20-1:76     6.00    (#     76:20  Double Ambig)
 &rst
  ixpk= 76, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=  94, 732,
 igr2=  98,  99, 723, 724,
 &end
#
#   12 GLU  HN           11 ASP  HB-         3.50    (#     78:20  Unique         2.36, 3.24 A)
 &rst
  ixpk= 78, nxpk= 20, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 167, 168,
 &end
#
#   12 GLU  HN           11 ASP  HB+         4.50    (#     80:20  Unique         2.36, 3.24 A)
 &rst
  ixpk= 80, nxpk= 20, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 167, 168,
 &end
#
#   11 ASP  HN           11 ASP  HB+         4.50    (#     81:20  Unique         2.46, 3.03 A)
 &rst
  ixpk= 81, nxpk= 20, iat= 163,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 167, 168,
 &end
#
#   40 LEU  HN           40 LEU  HB+         3.50    (#     83:20  Unique         2.07, 2.92 A)
 &rst
  ixpk= 83, nxpk= 20, iat= 606,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 610, 611,
 &end
#
#   41 GLU  HN           40 LEU  HB+         4.50    (#     84:20  Unique         2.79, 3.30 A)
 &rst
  ixpk= 84, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 610, 611,
 &end
#
#   40 LEU  HN           40 LEU  HB-         3.50    (#     86:20  Unique         2.07, 2.92 A)
 &rst
  ixpk= 86, nxpk= 20, iat= 606,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 610, 611,
 &end
#
#   41 GLU  HN           40 LEU  HB-         4.50    (#     87:20  Unique         2.79, 3.30 A)
 &rst
  ixpk= 87, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 610, 611,
 &end
#
#   42 ASP  HN           42 ASP  HB-         3.50    (#     88:20  Unique         2.38, 2.70 A)
 &rst
  ixpk= 88, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 644, 645,
 &end
#
#   42 ASP  HN           42 ASP  HB+         4.50    (#     89:20  Unique         2.38, 2.70 A)
 &rst
  ixpk= 89, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 644, 645,
 &end
#
#    9 TYR  HD            9 TYR  HB-         3.50    (#     90:20  Unique         2.39, 3.08 A)
 &rst
  ixpk= 90, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 134, 143,
 igr2= 130, 131,
 &end
#
#   10 VAL  HN            9 TYR  HB+         4.50    (#     91:20  Unique         2.11, 2.97 A)
 &rst
  ixpk= 91, nxpk= 20, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 130, 131,
 &end
#
#    9 TYR  HD            9 TYR  HB+         3.50    (#     92:20  Unique         2.39, 3.08 A)
 &rst
  ixpk= 92, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 134, 143,
 igr2= 130, 131,
 &end
#
#   10 VAL  HN            9 TYR  HB-         4.50    (#     93:20  Unique         2.11, 2.97 A)
 &rst
  ixpk= 93, nxpk= 20, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 130, 131,
 &end
#
#   43 PHE  HD           43 PHE  HB-         4.50    (#     94:20  Unique         2.39, 3.08 A)
 &rst
  ixpk= 94, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 660, 668,
 igr2= 656, 657,
 &end
#
#   43 PHE  HN           43 PHE  HB+         4.50    (#     95:20  Unique         2.46, 3.12 A)
 &rst
  ixpk= 95, nxpk= 20, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 656, 657,
 &end
#
#   43 PHE  HD           43 PHE  HB+         4.50    (#     96:20  Unique         2.39, 3.08 A)
 &rst
  ixpk= 96, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 660, 668,
 igr2= 656, 657,
 &end
#
#    7 TYR  HD           43 PHE  HB+         4.50    (#     97:20  Unique         2.19, 4.87 A)
 &rst
  ixpk= 97, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 102, 111,
 igr2= 656, 657,
 &end
#
#   13 ASN  HN            0 AMB  20-1:98     3.50    (#     98:20  Single Ambig)
 &rst
  ixpk= 98, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 194, 195, 194, 195,
 &end
#
#    0 AMB  20-2:99       0 AMB  20-1:99     3.50    (#     99:20  Double Ambig)
 &rst
  ixpk= 99, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 199, 200, 199, 200,
 igr2= 194, 195, 194, 195,
 &end
#
#   13 ASN  HD2-          0 AMB  20-1:100    4.50    (#    100:20  Single Ambig)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 199, 200,
 igr2= 194, 195, 194, 195,
 &end
#
#   45 ILE  HN           45 ILE  HB          4.50    (#    101:20  Unique         2.64, 3.06 A)
 &rst
  ixpk= 101, nxpk= 20, iat= 691, 695, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 GLU  HN           34 GLU  HG-         3.50    (#    102:20  Unique         2.23, 3.02 A)
 &rst
  ixpk= 102, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 520, 521,
 &end
#
#   35 GLU  HN           35 GLU  HG+         3.50    (#    103:20  Unique         2.31, 3.27 A)
 &rst
  ixpk= 103, nxpk= 20, iat= 528,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 535, 536,
 &end
#
#   35 GLU  HN            0 AMB  20-1:104    4.50    (#    104:20  Single Ambig)
 &rst
  ixpk= 104, nxpk= 20, iat= 528,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 535, 536, 520, 521,
 &end
#
#   12 GLU  HN            0 AMB  20-1:106    4.50    (#    106:20  Single Ambig)
 &rst
  ixpk= 106, nxpk= 20, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 182, 183, 182, 183,
 &end
#
#   18 THR  HN           17 LYS  HB-         3.50    (#    107:20  Unique         1.99, 3.10 A)
 &rst
  ixpk= 107, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 244, 245,
 &end
#
#   17 LYS  HN           17 LYS  HB+         6.00    (#    108:20  Unique         2.78, 3.40 A)
 &rst
  ixpk= 108, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 244, 245,
 &end
#
#    0 AMB  20-2:109      0 AMB  20-1:109    3.50    (#    109:20  Double Ambig)
 &rst
  ixpk= 109, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 589, 606,
 igr2= 596, 597, 596, 597, 596, 597,
 &end
#
#   36 GLN  HN           36 GLN  HG+         6.00    (#    110:20  Unique         2.73, 3.53 A)
 &rst
  ixpk= 110, nxpk= 20, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 550, 551,
 &end
#
#   22 GLN  HN            0 AMB  20-1:111    6.00    (#    111:20  Single Ambig)
 &rst
  ixpk= 111, nxpk= 20, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 328, 329, 328, 329,
 &end
#
#   33 MET  HN            0 AMB  20-1:112    3.50    (#    112:20  Single Ambig)
 &rst
  ixpk= 112, nxpk= 20, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 500, 501, 500, 501,
 &end
#
#   34 GLU  HN            0 AMB  20-1:113    3.50    (#    113:20  Single Ambig)
 &rst
  ixpk= 113, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 500, 501, 500, 501,
 &end
#
#   39 GLN  HN           38 LYS  HB-         4.50    (#    114:20  Unique         2.17, 2.93 A)
 &rst
  ixpk= 114, nxpk= 20, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 571, 572,
 &end
#
#   46 LYS  HN           46 LYS  HB+         6.00    (#    115:20  Unique         2.33, 2.76 A)
 &rst
  ixpk= 115, nxpk= 20, iat= 710,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 714, 715,
 &end
#
#   46 LYS  HN           46 LYS  HB-         4.50    (#    116:20  Unique         2.33, 2.76 A)
 &rst
  ixpk= 116, nxpk= 20, iat= 710,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 714, 715,
 &end
#
#   38 LYS  HN           38 LYS  HB+         4.50    (#    117:20  Unique         2.26, 3.03 A)
 &rst
  ixpk= 117, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 571, 572,
 &end
#
#   19 TRP  HE3          19 TRP  HB-         6.00    (#    118:20  Unique         2.46, 3.14 A)
 &rst
  ixpk= 118, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 280, 281,
 &end
#
#    9 TYR  HE           19 TRP  HB-         4.50    (#    119:20  Unique         2.50, 6.01 A)
 &rst
  ixpk= 119, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 136, 141,
 igr2= 280, 281,
 &end
#
#   19 TRP  HE3          19 TRP  HB+         4.50    (#    120:20  Unique         2.46, 3.14 A)
 &rst
  ixpk= 120, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 280, 281,
 &end
#
#   31 LYS  HN            0 AMB  20-1:121    2.80    (#    121:20  Single Ambig)
 &rst
  ixpk= 121, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 468, 469, 468, 469,
 &end
#
#   30 LYS  HN           30 LYS  HB-         3.50    (#    123:20  Unique         2.18, 2.49 A)
 &rst
  ixpk= 123, nxpk= 20, iat= 442,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 446, 447,
 &end
#
#   30 LYS  HN           30 LYS  HB+         4.50    (#    124:20  Unique         2.18, 2.49 A)
 &rst
  ixpk= 124, nxpk= 20, iat= 442,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 446, 447,
 &end
#
#   10 VAL  HN           10 VAL  HB          4.50    (#    125:20  Unique         2.44, 2.81 A)
 &rst
  ixpk= 125, nxpk= 20, iat= 147, 151, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   32 ALA  HN            0 AMB  20-1:126    4.50    (#    126:20  Single Ambig)
 &rst
  ixpk= 126, nxpk= 20, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 468, 469, 468, 469,
 &end
#
#   28 VAL  HN           28 VAL  HB          3.50    (#    127:20  Unique         2.49, 2.54 A)
 &rst
  ixpk= 127, nxpk= 20, iat= 407, 411, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 TYR  HD           28 VAL  HB          6.00    (#    128:20  Unique         2.42, 4.44 A)
 &rst
  ixpk= 128, nxpk= 20, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 134, 143,
 &end
#
#   41 GLU  HN           39 GLN  HB-         6.00    (#    129:20  Unique         2.99, 3.34 A)
 &rst
  ixpk= 129, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 593, 594,
 &end
#
#    0 AMB  20-2:130     39 GLN  HB-         3.50    (#    130:20  Single Ambig)
 &rst
  ixpk= 130, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 606, 589,
 igr2= 593, 594,
 &end
#
#   35 GLU  HN            0 AMB  20-1:131    2.80    (#    131:20  Single Ambig)
 &rst
  ixpk= 131, nxpk= 20, iat= 528,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 532, 533, 532, 533,
 &end
#
#   36 GLN  HN            0 AMB  20-1:132    4.50    (#    132:20  Single Ambig)
 &rst
  ixpk= 132, nxpk= 20, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 532, 533, 532, 533,
 &end
#
#    0 AMB  20-2:133      0 AMB  20-1:133    3.50    (#    133:20  Double Ambig)
 &rst
  ixpk= 133, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 606, 589,
 igr2= 593, 594, 593, 594,
 &end
#
#   33 MET  HN           33 MET  HG-         3.50    (#    134:20  Unique         2.32, 3.01 A)
 &rst
  ixpk= 134, nxpk= 20, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 503, 504,
 &end
#
#   33 MET  HN           33 MET  HG+         4.50    (#    135:20  Unique         2.32, 3.01 A)
 &rst
  ixpk= 135, nxpk= 20, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 503, 504,
 &end
#
#   15 GLU  HN            0 AMB  20-1:136    3.50    (#    136:20  Single Ambig)
 &rst
  ixpk= 136, nxpk= 20, iat= 211,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 215, 216, 215, 216,
 &end
#
#   24 ARG  HN            0 AMB  20-1:137    4.50    (#    137:20  Single Ambig)
 &rst
  ixpk= 137, nxpk= 20, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 349, 350, 349, 350,
 &end
#
#   34 GLU  HN           34 GLU  HB-         3.50    (#    138:20  Unique         2.36, 3.02 A)
 &rst
  ixpk= 138, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 517, 518,
 &end
#
#   35 GLU  HN           34 GLU  HB+         4.50    (#    139:20  Unique         2.52, 3.35 A)
 &rst
  ixpk= 139, nxpk= 20, iat= 528,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 517, 518,
 &end
#
#   34 GLU  HN           34 GLU  HB+         3.50    (#    140:20  Unique         2.36, 3.02 A)
 &rst
  ixpk= 140, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 517, 518,
 &end
#
#   22 GLN  HN           22 GLN  HB+         4.50    (#    141:20  Unique         2.38, 3.11 A)
 &rst
  ixpk= 141, nxpk= 20, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 325, 326,
 &end
#
#   36 GLN  HN           36 GLN  HB-         4.50    (#    142:20  Unique         2.62, 3.27 A)
 &rst
  ixpk= 142, nxpk= 20, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 547, 548,
 &end
#
#   47 GLU  HN           47 GLU  HB+         4.50    (#    143:20  Unique         2.19, 3.15 A)
 &rst
  ixpk= 143, nxpk= 20, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 736, 737,
 &end
#
#    0 AMB  20-2:144      0 AMB  20-1:144    3.50    (#    144:20  Double Ambig)
 &rst
  ixpk= 144, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 766, 747,
 igr2= 770, 771, 770, 771, 736, 737, 736, 737, 770, 771,
      
 &end
#
#   41 GLU  HN            0 AMB  20-1:145    3.50    (#    145:20  Single Ambig)
 &rst
  ixpk= 145, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 629, 630, 629, 630,
 &end
#
#   12 GLU  HN           12 GLU  HB-         4.50    (#    146:20  Unique         2.28, 3.06 A)
 &rst
  ixpk= 146, nxpk= 20, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 179, 180,
 &end
#
#   12 GLU  HN           12 GLU  HB+         4.50    (#    147:20  Unique         2.28, 3.06 A)
 &rst
  ixpk= 147, nxpk= 20, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 179, 180,
 &end
#
#   45 ILE  HN           45 ILE  HG1-        4.50    (#    148:20  Unique         1.88, 2.76 A)
 &rst
  ixpk= 148, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 701, 702,
 &end
#
#   44 LEU  HN           44 LEU  HG          4.50    (#    149:20  Unique         2.87, 3.74 A)
 &rst
  ixpk= 149, nxpk= 20, iat= 672, 679, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   19 TRP  HZ3          40 LEU  MDY         4.50    (#    151:20  Unique         2.24, 3.97 A)
 &rst
  ixpk= 151, nxpk= 20, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   45 ILE  HN            0 AMB  20-1:152    6.00    (#    152:20  Single Ambig)
 &rst
  ixpk= 152, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    7 TYR  HD            0 AMB  20-1:153    6.00    (#    153:20  Single Ambig)
 &rst
  ixpk= 153, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.19, r4=10.69,
 igr1= 102, 111,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    7 TYR  HE            0 AMB  20-1:154    6.00    (#    154:20  Single Ambig)
 &rst
  ixpk= 154, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.19, r4=10.69,
 igr1= 104, 109,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#   19 TRP  HZ3          40 LEU  MDX         4.50    (#    156:20  Unique         2.24, 3.97 A)
 &rst
  ixpk= 156, nxpk= 20, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   12 GLU  HN           28 VAL  MGY         6.00    (#    160:20  Unique         5.75, 7.79 A)
 &rst
  ixpk= 160, nxpk= 20, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   28 VAL  HN           28 VAL  MGY         3.50    (#    161:20  Unique         2.19, 3.86 A)
 &rst
  ixpk= 161, nxpk= 20, iat= 407,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    9 TYR  HD           28 VAL  MGY         3.50    (#    162:20  Unique         2.39, 5.28 A)
 &rst
  ixpk= 162, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 134, 143,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    9 TYR  HE           28 VAL  MGY         4.50    (#    163:20  Unique         2.52, 6.04 A)
 &rst
  ixpk= 163, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 136, 141,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   19 TRP  HN           18 THR  MG2         6.00    (#    165:20  Unique         3.69, 4.46 A)
 &rst
  ixpk= 165, nxpk= 20, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 268, 269, 270,
 &end
#
#   18 THR  HN           18 THR  MG2         4.50    (#    166:20  Unique         2.88, 3.92 A)
 &rst
  ixpk= 166, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 268, 269, 270,
 &end
#
#   17 LYS  HN           16 THR  MG2         4.50    (#    167:20  Unique         2.73, 3.92 A)
 &rst
  ixpk= 167, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 232, 233, 234,
 &end
#
#   16 THR  HN           16 THR  MG2         6.00    (#    168:20  Unique         2.40, 4.48 A)
 &rst
  ixpk= 168, nxpk= 20, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 232, 233, 234,
 &end
#
#   11 ASP  HN            0 AMB  20-1:169    3.50    (#    169:20  Single Ambig)
 &rst
  ixpk= 169, nxpk= 20, iat= 163,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   10 VAL  HN            0 AMB  20-1:170    3.50    (#    170:20  Single Ambig)
 &rst
  ixpk= 170, nxpk= 20, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#    0 AMB  20-2:171      0 AMB  20-1:171    3.50    (#    171:20  Double Ambig)
 &rst
  ixpk= 171, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 204, 211,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   30 LYS  HN           25 THR  MG2         4.50    (#    172:20  Unique         2.48, 3.50 A)
 &rst
  ixpk= 172, nxpk= 20, iat= 442,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 375, 376, 377,
 &end
#
#   19 TRP  HH2          25 THR  MG2         6.00    (#    173:20  Unique         2.61, 4.01 A)
 &rst
  ixpk= 173, nxpk= 20, iat= 291,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 375, 376, 377,
 &end
#
#    0 AMB  20-2:174     28 VAL  MGX         6.00    (#    174:20  Single Ambig)
 &rst
  ixpk= 174, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 147, 397,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   28 VAL  HN           28 VAL  MGX         6.00    (#    175:20  Unique         2.19, 3.86 A)
 &rst
  ixpk= 175, nxpk= 20, iat= 407,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    5 ALA  HN            5 ALA  MB          3.50    (#    176:20  Unique         2.46, 3.29 A)
 &rst
  ixpk= 176, nxpk= 20, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  66,  67,  68,
 &end
#
#    6 LYS  HN            5 ALA  MB          4.50    (#    177:20  Unique         2.45, 3.38 A)
 &rst
  ixpk= 177, nxpk= 20, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  66,  67,  68,
 &end
#
#   33 MET  HN           32 ALA  MB          3.50    (#    178:20  Unique         2.68, 3.54 A)
 &rst
  ixpk= 178, nxpk= 20, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 490, 491, 492,
 &end
#
#   32 ALA  HN           32 ALA  MB          2.80    (#    179:20  Unique         2.39, 2.86 A)
 &rst
  ixpk= 179, nxpk= 20, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 490, 491, 492,
 &end
#
#   43 PHE  HE           32 ALA  MB          3.50    (#    180:20  Unique         2.47, 4.15 A)
 &rst
  ixpk= 180, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 662, 666,
 igr2= 490, 491, 492,
 &end
#
#   43 PHE  HZ           32 ALA  MB          3.50    (#    181:20  Unique         2.24, 2.72 A)
 &rst
  ixpk= 181, nxpk= 20, iat= 664,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 490, 491, 492,
 &end
#
#   27 ALA  HN           27 ALA  MB          4.50    (#    182:20  Unique         2.37, 2.84 A)
 &rst
  ixpk= 182, nxpk= 20, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 401, 402, 403,
 &end
#
#   28 VAL  HN           27 ALA  MB          3.50    (#    183:20  Unique         2.61, 3.44 A)
 &rst
  ixpk= 183, nxpk= 20, iat= 407,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 401, 402, 403,
 &end
#
#   45 ILE  HN           45 ILE  MG2         6.00    (#    184:20  Unique         2.89, 4.38 A)
 &rst
  ixpk= 184, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 697, 698, 699,
 &end
#
#   46 LYS  HN           45 ILE  MG2         4.50    (#    185:20  Unique         3.72, 4.76 A)
 &rst
  ixpk= 185, nxpk= 20, iat= 710,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 697, 698, 699,
 &end
#
#   40 LEU  HN           33 MET  ME          4.50    (#    186:20  Unique         2.77, 4.70 A)
 &rst
  ixpk= 186, nxpk= 20, iat= 606,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 507, 508, 509,
 &end
#
#   43 PHE  HD           29 ILE  MG2         6.00    (#    187:20  Unique         2.70, 5.03 A)
 &rst
  ixpk= 187, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 660, 668,
 igr2= 429, 430, 431,
 &end
#
#   43 PHE  HE           29 ILE  MG2         6.00    (#    188:20  Unique         2.84, 5.28 A)
 &rst
  ixpk= 188, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 662, 666,
 igr2= 429, 430, 431,
 &end
#
#    9 TYR  HD           29 ILE  MD1         4.50    (#    189:20  Unique         2.41, 5.16 A)
 &rst
  ixpk= 189, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 134, 143,
 igr2= 436, 437, 438,
 &end
#
#   19 TRP  HE3          29 ILE  MD1         6.00    (#    190:20  Unique         2.59, 3.65 A)
 &rst
  ixpk= 190, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 436, 437, 438,
 &end
#
#    0 AMB  20-2:191     29 ILE  MD1         6.00    (#    191:20  Single Ambig)
 &rst
  ixpk= 191, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 293, 136, 141,
 igr2= 436, 437, 438,
 &end
#
#    8 SER  HA            8 SER  HB-         3.50    (#    198:20  Unique         2.38, 2.64 A)
 &rst
  ixpk= 198, nxpk= 20, iat= 117,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 119, 120,
 &end
#
#    8 SER  HA            8 SER  HB+         3.50    (#    199:20  Unique         2.38, 2.64 A)
 &rst
  ixpk= 199, nxpk= 20, iat= 117,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 119, 120,
 &end
#
#    3 ARG  HA            4 PRO  HD+         3.50    (#    201:20  Unique         2.10, 2.50 A)
 &rst
  ixpk= 201, nxpk= 20, iat=  26,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  49,  50,
 &end
#
#    3 ARG  HA            4 PRO  HD-         3.50    (#    202:20  Unique         2.10, 2.50 A)
 &rst
  ixpk= 202, nxpk= 20, iat=  26,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  49,  50,
 &end
#
#   44 LEU  HA           44 LEU  HB-         4.50    (#    203:20  Unique         2.09, 2.58 A)
 &rst
  ixpk= 203, nxpk= 20, iat= 674,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 676, 677,
 &end
#
#   41 GLU  HA           44 LEU  HB-         6.00    (#    204:20  Unique         2.17, 2.79 A)
 &rst
  ixpk= 204, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 676, 677,
 &end
#
#   44 LEU  HA           44 LEU  HB+         4.50    (#    205:20  Unique         2.09, 2.58 A)
 &rst
  ixpk= 205, nxpk= 20, iat= 674,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 676, 677,
 &end
#
#   48 LEU  HA           48 LEU  HB+         4.50    (#    206:20  Unique         2.32, 2.75 A)
 &rst
  ixpk= 206, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 751, 752,
 &end
#
#   48 LEU  HA           48 LEU  HB-         4.50    (#    207:20  Unique         2.32, 2.75 A)
 &rst
  ixpk= 207, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 751, 752,
 &end
#
#    7 TYR  HA            7 TYR  HB-         4.50    (#    208:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 208, nxpk= 20, iat=  96,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  98,  99,
 &end
#
#   40 LEU  HA           40 LEU  HB+         4.50    (#    212:20  Unique         2.34, 2.80 A)
 &rst
  ixpk= 212, nxpk= 20, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 610, 611,
 &end
#
#   40 LEU  HA           40 LEU  HB-         4.50    (#    213:20  Unique         2.34, 2.80 A)
 &rst
  ixpk= 213, nxpk= 20, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 610, 611,
 &end
#
#   42 ASP  HA           42 ASP  HB-         3.50    (#    214:20  Unique         2.49, 2.78 A)
 &rst
  ixpk= 214, nxpk= 20, iat= 642,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 644, 645,
 &end
#
#   42 ASP  HA           42 ASP  HB+         3.50    (#    215:20  Unique         2.49, 2.78 A)
 &rst
  ixpk= 215, nxpk= 20, iat= 642,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 644, 645,
 &end
#
#    9 TYR  HA            9 TYR  HB-         3.50    (#    216:20  Unique         2.34, 2.41 A)
 &rst
  ixpk= 216, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 130, 131,
 &end
#
#    9 TYR  HA            9 TYR  HB+         3.50    (#    217:20  Unique         2.34, 2.41 A)
 &rst
  ixpk= 217, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 130, 131,
 &end
#
#   13 ASN  HA            0 AMB  20-1:218    2.80    (#    218:20  Single Ambig)
 &rst
  ixpk= 218, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 194, 195, 194, 195,
 &end
#
#   41 GLU  HA           41 GLU  HG+         4.50    (#    219:20  Unique         2.43, 3.16 A)
 &rst
  ixpk= 219, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 632, 633,
 &end
#
#   41 GLU  HA           41 GLU  HG-         4.50    (#    220:20  Unique         2.43, 3.16 A)
 &rst
  ixpk= 220, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 632, 633,
 &end
#
#    0 AMB  20-2:221      0 AMB  20-1:221    4.50    (#    221:20  Double Ambig)
 &rst
  ixpk= 221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 530, 642,
 igr2= 535, 536, 632, 633,
 &end
#
#   35 GLU  HA           35 GLU  HG-         3.50    (#    222:20  Unique         2.35, 3.01 A)
 &rst
  ixpk= 222, nxpk= 20, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 535, 536,
 &end
#
#   34 GLU  HA           34 GLU  HG+         4.50    (#    223:20  Unique         2.36, 3.16 A)
 &rst
  ixpk= 223, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 520, 521,
 &end
#
#   15 GLU  HA           15 GLU  HG+         8.00    (#    224:20  Unique         2.42, 3.49 A)
 &rst
  ixpk= 224, nxpk= 20, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 218, 219,
 &end
#
#   15 GLU  HA           15 GLU  HG-         6.00    (#    225:20  Unique         2.42, 3.49 A)
 &rst
  ixpk= 225, nxpk= 20, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 218, 219,
 &end
#
#   12 GLU  HA            0 AMB  20-1:226    3.50    (#    226:20  Single Ambig)
 &rst
  ixpk= 226, nxpk= 20, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 182, 183, 182, 183,
 &end
#
#    0 AMB  20-2:227      0 AMB  20-1:227    4.50    (#    227:20  Double Ambig)
 &rst
  ixpk= 227, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 734, 749,
 igr2= 739, 740, 739, 740,
 &end
#
#   17 LYS  HA           17 LYS  HB-         3.50    (#    228:20  Unique         2.41, 2.81 A)
 &rst
  ixpk= 228, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 244, 245,
 &end
#
#    0 AMB  20-2:229      0 AMB  20-1:229    4.50    (#    229:20  Double Ambig)
 &rst
  ixpk= 229, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  74, 302,
 igr2=  76,  77,  76,  77,
 &end
#
#    0 AMB  20-2:230      6 LYS  HB-         4.50    (#    230:20  Single Ambig)
 &rst
  ixpk= 230, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  74, 302,
 igr2=  76,  77,
 &end
#
#    0 AMB  20-2:231      0 AMB  20-1:231    3.50    (#    231:20  Double Ambig)
 &rst
  ixpk= 231, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 591, 545,
 igr2= 596, 597, 596, 597, 550, 551,
 &end
#
#   36 GLN  HA           36 GLN  HG-         4.50    (#    232:20  Unique         2.52, 3.10 A)
 &rst
  ixpk= 232, nxpk= 20, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 550, 551,
 &end
#
#    0 AMB  20-2:233     38 LYS  HB-         3.50    (#    233:20  Single Ambig)
 &rst
  ixpk= 233, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 498, 569,
 igr2= 571, 572,
 &end
#
#   46 LYS  HA           46 LYS  HB+         4.50    (#    234:20  Double Ambig)
 &rst
  ixpk= 234, nxpk= 20, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 714, 715,
 &end
#
#   46 LYS  HA           46 LYS  HB-         4.50    (#    235:20  Single Ambig)
 &rst
  ixpk= 235, nxpk= 20, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 714, 715,
 &end
#
#    0 AMB  20-2:236      0 AMB  20-1:236    3.50    (#    236:20  Double Ambig)
 &rst
  ixpk= 236, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 498, 569,
 igr2= 571, 572, 571, 572,
 &end
#
#   19 TRP  HA           19 TRP  HB-         4.50    (#    237:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 237, nxpk= 20, iat= 278,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 280, 281,
 &end
#
#   10 VAL  HA           10 VAL  HB          4.50    (#    238:20  Unique         2.33, 2.85 A)
 &rst
  ixpk= 238, nxpk= 20, iat= 149, 151, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 LYS  HA            0 AMB  20-1:239    3.50    (#    239:20  Single Ambig)
 &rst
  ixpk= 239, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 468, 469, 468, 469,
 &end
#
#    4 PRO  HA            4 PRO  HB-         3.50    (#    240:20  Unique         2.28, 2.61 A)
 &rst
  ixpk= 240, nxpk= 20, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  55,  56,
 &end
#
#    4 PRO  HA            4 PRO  HB+         6.00    (#    241:20  Unique         2.28, 2.61 A)
 &rst
  ixpk= 241, nxpk= 20, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  55,  56,
 &end
#
#   39 GLN  HA           39 GLN  HB-         3.50    (#    242:20  Unique         2.49, 2.78 A)
 &rst
  ixpk= 242, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 593, 594,
 &end
#
#   35 GLU  HA            0 AMB  20-1:243    2.80    (#    243:20  Single Ambig)
 &rst
  ixpk= 243, nxpk= 20, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 532, 533, 532, 533,
 &end
#
#   39 GLN  HA           39 GLN  HB+         4.50    (#    244:20  Unique         2.49, 2.78 A)
 &rst
  ixpk= 244, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 593, 594,
 &end
#
#   33 MET  HA           33 MET  HG-         4.50    (#    245:20  Unique         2.35, 2.76 A)
 &rst
  ixpk= 245, nxpk= 20, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 503, 504,
 &end
#
#   33 MET  HA           33 MET  HG+         3.50    (#    246:20  Unique         2.35, 2.76 A)
 &rst
  ixpk= 246, nxpk= 20, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 503, 504,
 &end
#
#   15 GLU  HA            0 AMB  20-1:247    3.50    (#    247:20  Single Ambig)
 &rst
  ixpk= 247, nxpk= 20, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 215, 216, 215, 216,
 &end
#
#   24 ARG  HA            0 AMB  20-1:248    3.50    (#    248:20  Single Ambig)
 &rst
  ixpk= 248, nxpk= 20, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 349, 350, 349, 350,
 &end
#
#   34 GLU  HA           34 GLU  HB-         3.50    (#    249:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 249, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 517, 518,
 &end
#
#   22 GLN  HA           22 GLN  HB-         3.50    (#    250:20  Unique         2.37, 2.75 A)
 &rst
  ixpk= 250, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 325, 326,
 &end
#
#   34 GLU  HA           34 GLU  HB+         3.50    (#    251:20  Unique         2.29, 2.72 A)
 &rst
  ixpk= 251, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 517, 518,
 &end
#
#   22 GLN  HA           22 GLN  HB+         4.50    (#    252:20  Unique         2.37, 2.75 A)
 &rst
  ixpk= 252, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 325, 326,
 &end
#
#   36 GLN  HA           36 GLN  HB+         3.50    (#    253:20  Unique         2.39, 2.75 A)
 &rst
  ixpk= 253, nxpk= 20, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 547, 548,
 &end
#
#   32 ALA  HA           36 GLN  HB-         6.00    (#    254:20  Unique         2.27, 3.62 A)
 &rst
  ixpk= 254, nxpk= 20, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 547, 548,
 &end
#
#   36 GLN  HA           36 GLN  HB-         4.50    (#    255:20  Unique         2.39, 2.75 A)
 &rst
  ixpk= 255, nxpk= 20, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 547, 548,
 &end
#
#   47 GLU  HA           47 GLU  HB-         4.50    (#    256:20  Unique         2.37, 2.76 A)
 &rst
  ixpk= 256, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 736, 737,
 &end
#
#    0 AMB  20-2:257      0 AMB  20-1:257    4.50    (#    257:20  Double Ambig)
 &rst
  ixpk= 257, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 734, 749,
 igr2= 736, 737, 770, 771, 770, 771,
 &end
#
#   49 GLU  HA            0 AMB  20-1:258    3.50    (#    258:20  Single Ambig)
 &rst
  ixpk= 258, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 770, 771, 770, 771,
 &end
#
#    3 ARG  HA            3 ARG  HB-         6.00    (#    259:20  Unique         2.43, 2.77 A)
 &rst
  ixpk= 259, nxpk= 20, iat=  26,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  28,  29,
 &end
#
#   41 GLU  HA            0 AMB  20-1:262    2.80    (#    262:20  Single Ambig)
 &rst
  ixpk= 262, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 629, 630, 629, 630,
 &end
#
#   12 GLU  HA           12 GLU  HB-         3.50    (#    263:20  Unique         2.49, 2.79 A)
 &rst
  ixpk= 263, nxpk= 20, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 179, 180,
 &end
#
#   12 GLU  HA           12 GLU  HB+         3.50    (#    264:20  Unique         2.49, 2.79 A)
 &rst
  ixpk= 264, nxpk= 20, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 179, 180,
 &end
#
#   17 LYS  HA           17 LYS  HD+         6.00    (#    265:20  Unique         2.19, 3.62 A)
 &rst
  ixpk= 265, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 250, 251,
 &end
#
#   38 LYS  HA            0 AMB  20-1:266    4.50    (#    266:20  Single Ambig)
 &rst
  ixpk= 266, nxpk= 20, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 577, 578, 577, 578,
 &end
#
#    4 PRO  HA            0 AMB  20-1:267    6.00    (#    267:20  Double Ambig)
 &rst
  ixpk= 267, nxpk= 20, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2=  52,  53,  52,  53,
 &end
#
#   41 GLU  HA           44 LEU  HG          4.50    (#    268:20  Unique         2.34, 3.20 A)
 &rst
  ixpk= 268, nxpk= 20, iat= 627, 679, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    3 ARG  HA            0 AMB  20-1:269    6.00    (#    269:20  Single Ambig)
 &rst
  ixpk= 269, nxpk= 20, iat=  26,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2=  31,  32,  31,  32,
 &end
#
#    0 AMB  20-2:270      0 AMB  20-1:270    4.50    (#    270:20  Double Ambig)
 &rst
  ixpk= 270, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 347, 608,
 igr2= 352, 353, 613,
 &end
#
#    0 AMB  20-2:272     38 LYS  HG-         4.50    (#    272:20  Single Ambig)
 &rst
  ixpk= 272, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 569, 498,
 igr2= 574, 575,
 &end
#
#   44 LEU  HA           48 LEU  MDY         6.00    (#    273:20  Unique         4.29, 6.29 A)
 &rst
  ixpk= 273, nxpk= 20, iat= 674,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#   41 GLU  HA           48 LEU  MDY         4.50    (#    274:20  Unique         2.41, 4.47 A)
 &rst
  ixpk= 274, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:276      0 AMB  20-1:276    6.00    (#    276:20  Double Ambig)
 &rst
  ixpk= 276, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=  74, 302,
 igr2=  79,  80,  79,  80,
 &end
#
#   31 LYS  HA            0 AMB  20-1:278    4.50    (#    278:20  Single Ambig)
 &rst
  ixpk= 278, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 471, 472, 471, 472,
 &end
#
#   40 LEU  HA           40 LEU  MDY         6.00    (#    280:20  Unique         2.17, 3.66 A)
 &rst
  ixpk= 280, nxpk= 20, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   44 LEU  HA            0 AMB  20-1:282    4.50    (#    282:20  Double Ambig)
 &rst
  ixpk= 282, nxpk= 20, iat= 674,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#   41 GLU  HA            0 AMB  20-1:283    6.00    (#    283:20  Single Ambig)
 &rst
  ixpk= 283, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#   40 LEU  HA           40 LEU  MDX         3.50    (#    290:20  Unique         2.17, 3.66 A)
 &rst
  ixpk= 290, nxpk= 20, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   48 LEU  HA           48 LEU  MDX         4.50    (#    292:20  Unique         2.17, 3.88 A)
 &rst
  ixpk= 292, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:299     20 THR  MG2         2.80    (#    299:20  Single Ambig)
 &rst
  ixpk= 299, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 304, 302,
 igr2= 306, 307, 308,
 &end
#
#    5 ALA  HA           20 THR  MG2         4.50    (#    300:20  Unique         2.29, 3.43 A)
 &rst
  ixpk= 300, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 306, 307, 308,
 &end
#
#    8 SER  HA           18 THR  MG2         4.50    (#    302:20  Unique         2.53, 3.98 A)
 &rst
  ixpk= 302, nxpk= 20, iat= 117,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 268, 269, 270,
 &end
#
#   18 THR  HA           18 THR  MG2         3.50    (#    303:20  Unique         2.44, 3.07 A)
 &rst
  ixpk= 303, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 268, 269, 270,
 &end
#
#   18 THR  HB           18 THR  MG2         2.80    (#    304:20  Unique         2.42, 2.65 A)
 &rst
  ixpk= 304, nxpk= 20, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 268, 269, 270,
 &end
#
#   16 THR  HA           16 THR  MG2         3.50    (#    307:20  Unique         2.38, 3.29 A)
 &rst
  ixpk= 307, nxpk= 20, iat= 228,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 232, 233, 234,
 &end
#
#   10 VAL  HA            0 AMB  20-1:308    2.80    (#    308:20  Single Ambig)
 &rst
  ixpk= 308, nxpk= 20, iat= 149,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   14 GLY  HA-           0 AMB  20-1:309    3.50    (#    309:20  Single Ambig)
 &rst
  ixpk= 309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 206, 207,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   18 THR  HB            5 ALA  MB          3.50    (#    315:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 315, nxpk= 20, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  66,  67,  68,
 &end
#
#    5 ALA  HA            5 ALA  MB          3.50    (#    316:20  Unique         2.45, 2.67 A)
 &rst
  ixpk= 316, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  66,  67,  68,
 &end
#
#   32 ALA  HA           32 ALA  MB          2.80    (#    318:20  Unique         2.43, 2.66 A)
 &rst
  ixpk= 318, nxpk= 20, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 490, 491, 492,
 &end
#
#    0 AMB  20-2:323     45 ILE  MG2         6.00    (#    323:20  Single Ambig)
 &rst
  ixpk= 323, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 674, 712,
 igr2= 697, 698, 699,
 &end
#
#   45 ILE  HA           45 ILE  MG2         3.50    (#    324:20  Unique         2.26, 3.00 A)
 &rst
  ixpk= 324, nxpk= 20, iat= 693,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 697, 698, 699,
 &end
#
#   33 MET  HA           33 MET  ME          6.00    (#    325:20  Unique         4.65, 5.46 A)
 &rst
  ixpk= 325, nxpk= 20, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 507, 508, 509,
 &end
#
#   39 GLN  HA           33 MET  ME          6.00    (#    326:20  Unique         2.27, 4.43 A)
 &rst
  ixpk= 326, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 507, 508, 509,
 &end
#
#   40 LEU  HA           33 MET  ME          6.00    (#    327:20  Unique         2.88, 5.23 A)
 &rst
  ixpk= 327, nxpk= 20, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 507, 508, 509,
 &end
#
#   44 LEU  HA           45 ILE  MD1         4.50    (#    328:20  Single Ambig)
 &rst
  ixpk= 328, nxpk= 20, iat= 674,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 704, 705, 706,
 &end
#
#    7 TYR  HA           44 LEU  HA          3.50    (#    336:20  Unique         2.00, 2.32 A)
 &rst
  ixpk= 336, nxpk= 20, iat=  96, 674, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 MET  HG-           0 AMB  20-1:343    3.50    (#    343:20  Single Ambig)
 &rst
  ixpk= 343, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 503, 504,
 igr2= 500, 501, 500, 501,
 &end
#
#    0 AMB  20-2:344      0 AMB  20-1:344    4.50    (#    344:20  Double Ambig)
 &rst
  ixpk= 344, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 444, 340, 341, 340, 341,
 igr2= 500, 501, 500, 501, 328, 329, 328, 329,
 &end
#
#    0 AMB  20-2:345     30 LYS  HB-         4.50    (#    345:20  Single Ambig)
 &rst
  ixpk= 345, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 399, 444,
 igr2= 446, 447,
 &end
#
#    0 AMB  20-2:346      0 AMB  20-1:346    4.50    (#    346:20  Double Ambig)
 &rst
  ixpk= 346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 399, 444,
 igr2= 446, 447, 446, 447,
 &end
#
#   28 VAL  HA            0 AMB  20-1:347    4.50    (#    347:20  Single Ambig)
 &rst
  ixpk= 347, nxpk= 20, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 468, 469, 468, 469,
 &end
#
#   28 VAL  HA           28 VAL  HB          4.50    (#    348:20  Unique         2.45, 2.86 A)
 &rst
  ixpk= 348, nxpk= 20, iat= 409, 411, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 PRO  HA           26 PRO  HB-         3.50    (#    349:20  Unique         2.29, 2.68 A)
 &rst
  ixpk= 349, nxpk= 20, iat= 393,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 390, 391,
 &end
#
#    0 AMB  20-2:351      0 AMB  20-1:351    3.50    (#    351:20  Double Ambig)
 &rst
  ixpk= 351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
 igr1=  34,  35,  34,  35, 355, 356, 355, 356, 355, 356,
      
 igr2=  28,  29,  28,  29, 349, 350, 349, 350, 349, 350,
      
 &end
#
#    0 AMB  20-2:352      0 AMB  20-1:352    3.50    (#    352:20  Double Ambig)
 &rst
  ixpk= 352, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1= 477, 478, 477, 478, 477, 478, 455, 456, 455, 456,
      
 igr2= 474, 475, 474, 475, 474, 475, 474, 475,
 &end
#
#    0 AMB  20-2:353      0 AMB  20-1:353    4.50    (#    353:20  Double Ambig)
 &rst
  ixpk= 353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.00, r4= 9.50,
 igr1= 455, 456, 455, 456, 455, 456, 477, 478,
 igr2= 452, 453, 452, 453, 452, 453, 452, 453,
 &end
#
#    0 AMB  20-2:354      0 AMB  20-1:354    3.50    (#    354:20  Double Ambig)
 &rst
  ixpk= 354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  85,  86,  85,  86,  85,  86,
 igr2=  82,  83,  82,  83,  82,  83,
 &end
#
#   45 ILE  HA           45 ILE  HG1+        4.50    (#    357:20  Unique         2.63, 3.30 A)
 &rst
  ixpk= 357, nxpk= 20, iat= 693,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 701, 702,
 &end
#
#    0 AMB  20-2:358      0 AMB  20-1:358    4.50    (#    358:20  Double Ambig)
 &rst
  ixpk= 358, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 253, 254, 253, 254,
 igr2= 250, 251, 250, 251,
 &end
#
#    0 AMB  20-2:359      0 AMB  20-1:359    6.00    (#    359:20  Double Ambig)
 &rst
  ixpk= 359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 580, 581, 580, 581,
 igr2= 577, 578, 577, 578,
 &end
#
#    0 AMB  20-2:360      0 AMB  20-1:360    3.50    (#    360:20  Double Ambig)
 &rst
  ixpk= 360, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=  49,  50,  49,  50,
 igr2=  52,  53,  52,  53,
 &end
#
#    4 PRO  HD-           0 AMB  20-1:361    3.50    (#    361:20  Single Ambig)
 &rst
  ixpk= 361, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  49,  50,
 igr2=  52,  53,  52,  53,
 &end
#
#    0 AMB  20-2:363      0 AMB  20-1:363    4.50    (#    363:20  Double Ambig)
 &rst
  ixpk= 363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.69, r4=10.19,
 igr1= 253, 254, 253, 254, 455, 456, 455, 456, 477, 478,
      
 igr2= 247, 248, 247, 248, 449, 450, 449, 450, 449, 450,
      
 &end
#
#    0 AMB  20-2:364      0 AMB  20-1:364    6.00    (#    364:20  Double Ambig)
 &rst
  ixpk= 364, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.24, r4=12.74,
 igr1=  85,  86,  85,  86,  85,  86,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    0 AMB  20-2:365      0 AMB  20-1:365    4.50    (#    365:20  Double Ambig)
 &rst
  ixpk= 365, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 444, 399,
 igr2= 449, 450, 449, 450,
 &end
#
#   30 LYS  HA           30 LYS  HG-         4.50    (#    366:20  Unique         2.63, 3.19 A)
 &rst
  ixpk= 366, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 449, 450,
 &end
#
#    9 TYR  HB+          28 VAL  MGY         6.00    (#    367:20  Unique         2.40, 4.83 A)
 &rst
  ixpk= 367, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 130, 131,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   28 VAL  HA           28 VAL  MGY         3.50    (#    368:20  Unique         2.41, 3.26 A)
 &rst
  ixpk= 368, nxpk= 20, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    8 SER  HB-          18 THR  MG2         4.50    (#    370:20  Unique         2.19, 3.86 A)
 &rst
  ixpk= 370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 119, 120,
 igr2= 268, 269, 270,
 &end
#
#   16 THR  HB           16 THR  MG2         2.80    (#    371:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 371, nxpk= 20, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 232, 233, 234,
 &end
#
#    0 AMB  20-2:373      0 AMB  20-1:373    3.50    (#    373:20  Double Ambig)
 &rst
  ixpk= 373, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 206, 207, 206, 207,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   25 THR  HB           25 THR  MG2         3.50    (#    374:20  Unique         2.44, 2.67 A)
 &rst
  ixpk= 374, nxpk= 20, iat= 373,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 375, 376, 377,
 &end
#
#   25 THR  HA           25 THR  MG2         3.50    (#    375:20  Unique         2.45, 3.11 A)
 &rst
  ixpk= 375, nxpk= 20, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 375, 376, 377,
 &end
#
#   28 VAL  HA           28 VAL  MGX         3.50    (#    377:20  Unique         2.41, 3.26 A)
 &rst
  ixpk= 377, nxpk= 20, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    9 TYR  HB-          28 VAL  MGX         4.50    (#    378:20  Unique         2.40, 4.83 A)
 &rst
  ixpk= 378, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 130, 131,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    9 TYR  HB+          28 VAL  MGX         4.50    (#    379:20  Unique         2.40, 4.83 A)
 &rst
  ixpk= 379, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 130, 131,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   30 LYS  HA           25 THR  MG2         4.50    (#    380:20  Unique         2.87, 3.86 A)
 &rst
  ixpk= 380, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 375, 376, 377,
 &end
#
#   29 ILE  HA           32 ALA  MB          4.50    (#    383:20  Unique         2.58, 3.60 A)
 &rst
  ixpk= 383, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 490, 491, 492,
 &end
#
#   27 ALA  HA           27 ALA  MB          2.80    (#    385:20  Unique         2.44, 2.66 A)
 &rst
  ixpk= 385, nxpk= 20, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 401, 402, 403,
 &end
#
#   30 LYS  HA           33 MET  ME          4.50    (#    389:20  Unique         2.41, 4.76 A)
 &rst
  ixpk= 389, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 507, 508, 509,
 &end
#
#   33 MET  HG-          29 ILE  MG2         6.00    (#    392:20  Unique         3.08, 4.57 A)
 &rst
  ixpk= 392, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 503, 504,
 igr2= 429, 430, 431,
 &end
#
#   29 ILE  HA           29 ILE  MG2         4.50    (#    393:20  Unique         2.54, 3.19 A)
 &rst
  ixpk= 393, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 429, 430, 431,
 &end
#
#   45 ILE  HA           45 ILE  MD1         6.00    (#    394:20  Unique         4.49, 4.92 A)
 &rst
  ixpk= 394, nxpk= 20, iat= 693,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 704, 705, 706,
 &end
#
#    0 AMB  20-2:396     29 ILE  MD1         4.50    (#    396:20  Single Ambig)
 &rst
  ixpk= 396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 656, 657,  98,  99, 280, 281,
 igr2= 436, 437, 438,
 &end
#
#    0 AMB  20-2:397     29 ILE  MD1         4.50    (#    397:20  Single Ambig)
 &rst
  ixpk= 397, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 130, 131,  98,  99,
 igr2= 436, 437, 438,
 &end
#
#    0 AMB  20-2:401     29 ILE  MG2         2.80    (#    401:20  Single Ambig)
 &rst
  ixpk= 401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 615, 616, 617, 619, 620, 621, 375, 376, 377,
 igr2= 429, 430, 431,
 &end
#
#   29 ILE  HB           29 ILE  MG2         3.50    (#    404:20  Unique         2.39, 2.67 A)
 &rst
  ixpk= 404, nxpk= 20, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 429, 430, 431,
 &end
#
#   17 LYS  HG+          17 LYS  HB+         4.50    (#    412:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 412, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 247, 248,
 igr2= 244, 245,
 &end
#
#   17 LYS  HG-          17 LYS  HB+         4.50    (#    413:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 247, 248,
 igr2= 244, 245,
 &end
#
#   45 ILE  HB           45 ILE  HG1+        4.50    (#    415:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 415, nxpk= 20, iat= 695,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 701, 702,
 &end
#
#    0 AMB  20-2:417     48 LEU  MDY         4.50    (#    417:20  Single Ambig)
 &rst
  ixpk= 417, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 629, 630, 629, 630,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:418     48 LEU  MDY         3.50    (#    418:20  Single Ambig)
 &rst
  ixpk= 418, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 679, 676, 677, 610, 611,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:419     48 LEU  MDY         2.80    (#    419:20  Single Ambig)
 &rst
  ixpk= 419, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 676, 677, 751, 752,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#   33 MET  ME           40 LEU  MDY         6.00    (#    421:20  Unique         2.30, 4.51 A)
 &rst
  ixpk= 421, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 507, 508, 509,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#    0 AMB  20-2:422      0 AMB  20-1:422    2.80    (#    422:20  Double Ambig)
 &rst
  ixpk= 422, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 679, 676, 677, 610, 611, 610, 611,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    0 AMB  20-2:423      0 AMB  20-1:423    3.50    (#    423:20  Double Ambig)
 &rst
  ixpk= 423, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 754, 676, 677, 676, 677, 751, 752, 751, 752,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    0 AMB  20-2:426     40 LEU  MDY         2.80    (#    426:20  Single Ambig)
 &rst
  ixpk= 426, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 613, 610, 611,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   33 MET  ME           40 LEU  MDX         6.00    (#    428:20  Unique         2.30, 4.51 A)
 &rst
  ixpk= 428, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 507, 508, 509,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#    0 AMB  20-2:429     40 LEU  MDX         2.80    (#    429:20  Single Ambig)
 &rst
  ixpk= 429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 613, 610, 611,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#    0 AMB  20-2:430     48 LEU  MDX         3.50    (#    430:20  Single Ambig)
 &rst
  ixpk= 430, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 676, 677, 754, 751, 752,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#   48 LEU  HB-          48 LEU  MDX         4.50    (#    431:20  Single Ambig)
 &rst
  ixpk= 431, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 751, 752,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#   10 VAL  HB            0 AMB  20-1:436    2.80    (#    436:20  Single Ambig)
 &rst
  ixpk= 436, nxpk= 20, iat= 151,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   28 VAL  HB           28 VAL  MGX         3.50    (#    437:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 437, nxpk= 20, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   33 MET  ME           25 THR  MG2         6.00    (#    438:20  Unique         2.67, 4.83 A)
 &rst
  ixpk= 438, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 507, 508, 509,
 igr2= 375, 376, 377,
 &end
#
#   45 ILE  HB           45 ILE  MG2         3.50    (#    440:20  Unique         2.42, 2.67 A)
 &rst
  ixpk= 440, nxpk= 20, iat= 695,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 697, 698, 699,
 &end
#
#   45 ILE  HG1-         45 ILE  MG2         4.50    (#    441:20  Unique         2.40, 3.54 A)
 &rst
  ixpk= 441, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 701, 702,
 igr2= 697, 698, 699,
 &end
#
#   33 MET  ME           29 ILE  MG2         4.50    (#    443:20  Unique         2.28, 4.60 A)
 &rst
  ixpk= 443, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 507, 508, 509,
 igr2= 429, 430, 431,
 &end
#
#   45 ILE  HB           45 ILE  MD1         3.50    (#    444:20  Unique         2.42, 3.12 A)
 &rst
  ixpk= 444, nxpk= 20, iat= 695,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 704, 705, 706,
 &end
#
#   45 ILE  HG1-         45 ILE  MD1         2.80    (#    445:20  Unique         2.32, 2.64 A)
 &rst
  ixpk= 445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 701, 702,
 igr2= 704, 705, 706,
 &end
#
#    5 ALA  MB           45 ILE  MD1         6.00    (#    446:20  Unique         2.89, 5.25 A)
 &rst
  ixpk= 446, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1=  66,  67,  68,
 igr2= 704, 705, 706,
 &end
#
#   18 THR  MG2          45 ILE  MD1         3.50    (#    447:20  Unique         2.94, 4.76 A)
 &rst
  ixpk= 447, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 268, 269, 270,
 igr2= 704, 705, 706,
 &end
#
#    5 ALA  MB           18 THR  HB          3.50    (#    461:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 461, nxpk= 20, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  66,  67,  68,
 &end
#
#   18 THR  MG2          18 THR  HB          2.80    (#    462:20  Unique         2.42, 2.65 A)
 &rst
  ixpk= 462, nxpk= 20, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 268, 269, 270,
 &end
#
#   20 THR  MG2          20 THR  HB          2.80    (#    463:20  Unique         2.41, 2.66 A)
 &rst
  ixpk= 463, nxpk= 20, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 306, 307, 308,
 &end
#
#   30 LYS  HB+          25 THR  HB          4.50    (#    464:20  Unique         2.44, 3.61 A)
 &rst
  ixpk= 464, nxpk= 20, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 446, 447,
 &end
#
#   25 THR  MG2          25 THR  HB          2.80    (#    465:20  Unique         2.44, 2.67 A)
 &rst
  ixpk= 465, nxpk= 20, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 375, 376, 377,
 &end
#
#    0 AMB  20-2:466     25 THR  HB          6.00    (#    466:20  Single Ambig)
 &rst
  ixpk= 466, nxpk= 20, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 446, 447, 352, 353, 349, 350,
 &end
#
#   16 THR  MG2          16 THR  HB          2.80    (#    467:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 467, nxpk= 20, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 232, 233, 234,
 &end
#
#   18 THR  MG2           8 SER  HB-         6.00    (#    468:20  Unique         2.19, 3.86 A)
 &rst
  ixpk= 468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 268, 269, 270,
 igr2= 119, 120,
 &end
#
#   45 ILE  HG1+          8 SER  HB-         4.50    (#    469:20  Unique         3.38, 4.81 A)
 &rst
  ixpk= 469, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 701, 702,
 igr2= 119, 120,
 &end
#
#   45 ILE  MD1           8 SER  HB-         4.50    (#    470:20  Unique         2.14, 3.73 A)
 &rst
  ixpk= 470, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 704, 705, 706,
 igr2= 119, 120,
 &end
#
#   18 THR  MG2           8 SER  HB+         4.50    (#    471:20  Unique         2.19, 3.86 A)
 &rst
  ixpk= 471, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 268, 269, 270,
 igr2= 119, 120,
 &end
#
#   45 ILE  HG1+          8 SER  HB+         4.50    (#    472:20  Unique         3.38, 4.81 A)
 &rst
  ixpk= 472, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 701, 702,
 igr2= 119, 120,
 &end
#
#   45 ILE  MD1           8 SER  HB+         4.50    (#    473:20  Unique         2.14, 3.73 A)
 &rst
  ixpk= 473, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 704, 705, 706,
 igr2= 119, 120,
 &end
#
#   28 VAL  HB           28 VAL  HA          3.50    (#    474:20  Unique         2.45, 2.86 A)
 &rst
  ixpk= 474, nxpk= 20, iat= 411, 409, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 VAL  MGY          28 VAL  HA          3.50    (#    475:20  Unique         2.41, 3.26 A)
 &rst
  ixpk= 475, nxpk= 20, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#   28 VAL  MGX          28 VAL  HA          3.50    (#    476:20  Unique         2.41, 3.26 A)
 &rst
  ixpk= 476, nxpk= 20, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#    0 AMB  20-2:477     28 VAL  HA          3.50    (#    477:20  Single Ambig)
 &rst
  ixpk= 477, nxpk= 20, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 468, 469, 468, 469,
 &end
#
#   32 ALA  MB           29 ILE  HA          4.50    (#    478:20  Unique         2.58, 3.60 A)
 &rst
  ixpk= 478, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 490, 491, 492,
 &end
#
#   29 ILE  MG2          29 ILE  HA          4.50    (#    479:20  Unique         2.54, 3.19 A)
 &rst
  ixpk= 479, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 429, 430, 431,
 &end
#
#   16 THR  MG2          16 THR  HA          4.50    (#    480:20  Unique         2.38, 3.29 A)
 &rst
  ixpk= 480, nxpk= 20, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 232, 233, 234,
 &end
#
#    0 AMB  20-2:481     16 THR  HA          6.00    (#    481:20  Single Ambig)
 &rst
  ixpk= 481, nxpk= 20, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#    0 AMB  20-2:482      4 PRO  HA          6.00    (#    482:20  Single Ambig)
 &rst
  ixpk= 482, nxpk= 20, iat=  -1,  58, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  52,  53,  52,  53,
 &end
#
#    4 PRO  HB-           4 PRO  HA          3.50    (#    483:20  Unique         2.28, 2.61 A)
 &rst
  ixpk= 483, nxpk= 20, iat=  -1,  58, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  55,  56,
 &end
#
#    4 PRO  HB+           4 PRO  HA          4.50    (#    484:20  Unique         2.28, 2.61 A)
 &rst
  ixpk= 484, nxpk= 20, iat=  -1,  58, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  55,  56,
 &end
#
#    0 AMB  20-2:486     45 ILE  HA          4.50    (#    486:20  Single Ambig)
 &rst
  ixpk= 486, nxpk= 20, iat=  -1, 693, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 695, 751, 752, 754,
 &end
#
#   45 ILE  HG1-         45 ILE  HA          4.50    (#    487:20  Unique         2.63, 3.30 A)
 &rst
  ixpk= 487, nxpk= 20, iat=  -1, 693, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 701, 702,
 &end
#
#   45 ILE  HG1+         45 ILE  HA          4.50    (#    488:20  Unique         2.63, 3.30 A)
 &rst
  ixpk= 488, nxpk= 20, iat=  -1, 693, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 701, 702,
 &end
#
#    0 AMB  20-2:489     45 ILE  HA          3.50    (#    489:20  Single Ambig)
 &rst
  ixpk= 489, nxpk= 20, iat=  -1, 693, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 697, 698, 699, 756, 757, 758, 760, 761, 762,
 &end
#
#   26 PRO  HB-          26 PRO  HA          3.50    (#    490:20  Unique         2.29, 2.68 A)
 &rst
  ixpk= 490, nxpk= 20, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 390, 391,
 &end
#
#   10 VAL  HB           10 VAL  HA          4.50    (#    491:20  Unique         2.33, 2.85 A)
 &rst
  ixpk= 491, nxpk= 20, iat= 151, 149, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:492     10 VAL  HA          2.80    (#    492:20  Single Ambig)
 &rst
  ixpk= 492, nxpk= 20, iat=  -1, 149, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   26 PRO  HD+          25 THR  HA          3.50    (#    493:20  Unique         2.12, 2.35 A)
 &rst
  ixpk= 493, nxpk= 20, iat=  -1, 371, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 384, 385,
 &end
#
#   26 PRO  HD-          25 THR  HA          4.50    (#    494:20  Unique         2.12, 2.35 A)
 &rst
  ixpk= 494, nxpk= 20, iat=  -1, 371, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 384, 385,
 &end
#
#    0 AMB  20-2:495     25 THR  HA          3.50    (#    495:20  Single Ambig)
 &rst
  ixpk= 495, nxpk= 20, iat=  -1, 371, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 375, 376, 377, 615, 616, 617, 619, 620, 621,
 &end
#
#   41 GLU  HG-          41 GLU  HA          3.50    (#    496:20  Unique         2.43, 3.16 A)
 &rst
  ixpk= 496, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 632, 633,
 &end
#
#    0 AMB  20-2:497     41 GLU  HA          2.80    (#    497:20  Single Ambig)
 &rst
  ixpk= 497, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 629, 630, 629, 630,
 &end
#
#    0 AMB  20-2:498     41 GLU  HA          2.80    (#    498:20  Single Ambig)
 &rst
  ixpk= 498, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 676, 677, 679,
 &end
#
#    0 AMB  20-2:499     41 GLU  HA          6.00    (#    499:20  Single Ambig)
 &rst
  ixpk= 499, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 676, 677, 754,
 &end
#
#   48 LEU  MDY          41 GLU  HA          3.50    (#    500:20  Unique         2.41, 4.47 A)
 &rst
  ixpk= 500, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:501     30 LYS  HA          4.50    (#    501:20  Single Ambig)
 &rst
  ixpk= 501, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 500, 501, 500, 501,
 &end
#
#   30 LYS  HB-          30 LYS  HA          4.50    (#    502:20  Unique         2.32, 2.70 A)
 &rst
  ixpk= 502, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 446, 447,
 &end
#
#    0 AMB  20-2:503     30 LYS  HA          3.50    (#    503:20  Single Ambig)
 &rst
  ixpk= 503, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 446, 447, 449, 450,
 &end
#
#    0 AMB  20-2:504     31 LYS  HA          3.50    (#    504:20  Single Ambig)
 &rst
  ixpk= 504, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 468, 469, 468, 469,
 &end
#
#    0 AMB  20-2:505     31 LYS  HA          6.00    (#    505:20  Single Ambig)
 &rst
  ixpk= 505, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 474, 475, 474, 475,
 &end
#
#    0 AMB  20-2:506     31 LYS  HA          4.50    (#    506:20  Single Ambig)
 &rst
  ixpk= 506, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 471, 472, 471, 472,
 &end
#
#   30 LYS  HG+          31 LYS  HA          6.00    (#    507:20  Unique         3.20, 3.94 A)
 &rst
  ixpk= 507, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 449, 450,
 &end
#
#   33 MET  HG+          33 MET  HA          3.50    (#    508:20  Unique         2.35, 2.76 A)
 &rst
  ixpk= 508, nxpk= 20, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 503, 504,
 &end
#
#    0 AMB  20-2:509     33 MET  HA          3.50    (#    509:20  Single Ambig)
 &rst
  ixpk= 509, nxpk= 20, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 500, 501, 500, 501,
 &end
#
#   38 LYS  HB+          33 MET  HA          4.50    (#    510:20  Unique         2.30, 3.84 A)
 &rst
  ixpk= 510, nxpk= 20, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 571, 572,
 &end
#
#   40 LEU  MDX          40 LEU  HA          2.80    (#    511:20  Unique         2.17, 3.66 A)
 &rst
  ixpk= 511, nxpk= 20, iat=  -1, 608, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 615, 616, 617, 619, 620, 621,
 &end
#
#    0 AMB  20-2:512     12 GLU  HA          2.80    (#    512:20  Single Ambig)
 &rst
  ixpk= 512, nxpk= 20, iat=  -1, 177, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 182, 183, 182, 183,
 &end
#
#   12 GLU  HB-          12 GLU  HA          2.80    (#    513:20  Unique         2.49, 2.79 A)
 &rst
  ixpk= 513, nxpk= 20, iat=  -1, 177, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 179, 180,
 &end
#
#   12 GLU  HB+          12 GLU  HA          2.80    (#    514:20  Unique         2.49, 2.79 A)
 &rst
  ixpk= 514, nxpk= 20, iat=  -1, 177, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 179, 180,
 &end
#
#   34 GLU  HG-          34 GLU  HA          4.50    (#    515:20  Unique         2.36, 3.16 A)
 &rst
  ixpk= 515, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 520, 521,
 &end
#
#   35 GLU  HG-          35 GLU  HA          3.50    (#    516:20  Unique         2.35, 3.01 A)
 &rst
  ixpk= 516, nxpk= 20, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 535, 536,
 &end
#
#    0 AMB  20-2:517     35 GLU  HA          2.80    (#    517:20  Single Ambig)
 &rst
  ixpk= 517, nxpk= 20, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 532, 533, 532, 533,
 &end
#
#    0 AMB  20-2:518      0 AMB  20-1:518    2.80    (#    518:20  Double Ambig)
 &rst
  ixpk= 518, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 535, 536, 644, 645,
 igr2= 530, 642,
 &end
#
#   47 GLU  HG+          47 GLU  HA          4.50    (#    519:20  Unique         2.36, 2.97 A)
 &rst
  ixpk= 519, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 739, 740,
 &end
#
#    0 AMB  20-2:520     49 GLU  HA          3.50    (#    520:20  Single Ambig)
 &rst
  ixpk= 520, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 770, 771, 770, 771,
 &end
#
#    0 AMB  20-2:521      0 AMB  20-1:521    2.80    (#    521:20  Double Ambig)
 &rst
  ixpk= 521, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 717, 718, 717, 718,  76,  77,  76,  77, 717, 718,
      
 igr2= 712,  74,
 &end
#
#    6 LYS  HG+           6 LYS  HA          4.50    (#    522:20  Unique         2.46, 3.17 A)
 &rst
  ixpk= 522, nxpk= 20, iat=  -1,  74, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  79,  80,
 &end
#
#   47 GLU  HB+          47 GLU  HA          4.50    (#    524:20  Unique         2.37, 2.76 A)
 &rst
  ixpk= 524, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 736, 737,
 &end
#
#    0 AMB  20-2:525      0 AMB  20-1:525    2.80    (#    525:20  Double Ambig)
 &rst
  ixpk= 525, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 676, 677, 714, 715, 679,
 igr2= 674, 712,
 &end
#
#   48 LEU  MDY          44 LEU  HA          4.50    (#    526:20  Unique         4.29, 6.29 A)
 &rst
  ixpk= 526, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:528     44 LEU  HA          4.50    (#    528:20  Single Ambig)
 &rst
  ixpk= 528, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    0 AMB  20-2:529     24 ARG  HA          2.80    (#    529:20  Single Ambig)
 &rst
  ixpk= 529, nxpk= 20, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 349, 350, 349, 350, 352, 353,
 &end
#
#   30 LYS  HB-          27 ALA  HA          4.50    (#    530:20  Unique         2.32, 3.11 A)
 &rst
  ixpk= 530, nxpk= 20, iat=  -1, 399, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 446, 447,
 &end
#
#   27 ALA  MB           27 ALA  HA          2.80    (#    531:20  Unique         2.44, 2.66 A)
 &rst
  ixpk= 531, nxpk= 20, iat=  -1, 399, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 401, 402, 403,
 &end
#
#    0 AMB  20-2:532     15 GLU  HA          2.80    (#    532:20  Single Ambig)
 &rst
  ixpk= 532, nxpk= 20, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 215, 216, 215, 216,
 &end
#
#   15 GLU  HG+          15 GLU  HA          8.00    (#    533:20  Unique         2.42, 3.49 A)
 &rst
  ixpk= 533, nxpk= 20, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 218, 219,
 &end
#
#   38 LYS  HB-          38 LYS  HA          3.50    (#    534:20  Unique         2.44, 2.79 A)
 &rst
  ixpk= 534, nxpk= 20, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 571, 572,
 &end
#
#    0 AMB  20-2:535     38 LYS  HA          4.50    (#    535:20  Single Ambig)
 &rst
  ixpk= 535, nxpk= 20, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 577, 578, 577, 578,
 &end
#
#    0 AMB  20-2:536     38 LYS  HA          3.50    (#    536:20  Single Ambig)
 &rst
  ixpk= 536, nxpk= 20, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 574, 575, 571, 572,
 &end
#
#   48 LEU  MDX          48 LEU  HA          3.50    (#    537:20  Single Ambig)
 &rst
  ixpk= 537, nxpk= 20, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:538     32 ALA  HA          4.50    (#    538:20  Single Ambig)
 &rst
  ixpk= 538, nxpk= 20, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 547, 548, 535, 536, 550, 551,
 &end
#
#    0 AMB  20-2:539     32 ALA  HA          3.50    (#    539:20  Single Ambig)
 &rst
  ixpk= 539, nxpk= 20, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 547, 548, 550, 551,
 &end
#
#    0 AMB  20-2:540     32 ALA  HA          6.00    (#    540:20  Single Ambig)
 &rst
  ixpk= 540, nxpk= 20, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 532, 533, 532, 533,
 &end
#
#   32 ALA  MB           32 ALA  HA          2.80    (#    541:20  Unique         2.43, 2.66 A)
 &rst
  ixpk= 541, nxpk= 20, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 490, 491, 492,
 &end
#
#    0 AMB  20-2:542     22 GLN  HA          4.50    (#    542:20  Single Ambig)
 &rst
  ixpk= 542, nxpk= 20, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 328, 329, 328, 329,
 &end
#
#   22 GLN  HB-          22 GLN  HA          4.50    (#    543:20  Unique         2.37, 2.75 A)
 &rst
  ixpk= 543, nxpk= 20, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 325, 326,
 &end
#
#   22 GLN  HB+          22 GLN  HA          4.50    (#    544:20  Unique         2.37, 2.75 A)
 &rst
  ixpk= 544, nxpk= 20, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 325, 326,
 &end
#
#    5 ALA  MB            5 ALA  HA          2.80    (#    545:20  Unique         2.45, 2.67 A)
 &rst
  ixpk= 545, nxpk= 20, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  66,  67,  68,
 &end
#
#    1 ALA  MB            1 ALA  HA          4.50    (#    546:20  Unique         2.46, 2.67 A)
 &rst
  ixpk= 546, nxpk= 20, iat=  -1,   6, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=   8,   9,  10,
 &end
#
#    2 ALA  MB            2 ALA  HA          4.50    (#    547:20  Unique         2.41, 2.67 A)
 &rst
  ixpk= 547, nxpk= 20, iat=  -1,  16, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  18,  19,  20,
 &end
#
#    0 AMB  20-2:548      0 AMB  20-1:548    6.00    (#    548:20  Double Ambig)
 &rst
  ixpk= 548, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1=  28,  29,  55,  56,
 igr2=  49,  50,  49,  50,
 &end
#
#    0 AMB  20-2:549      4 PRO  HD-         4.50    (#    549:20  Single Ambig)
 &rst
  ixpk= 549, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  28,  29,  55,  56,
 igr2=  49,  50,
 &end
#
#    0 AMB  20-2:550      0 AMB  20-1:550    3.50    (#    550:20  Double Ambig)
 &rst
  ixpk= 550, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=  52,  53,  52,  53,
 igr2=  49,  50,  49,  50,
 &end
#
#    0 AMB  20-2:551      4 PRO  HD-         3.50    (#    551:20  Single Ambig)
 &rst
  ixpk= 551, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  52,  53,  52,  53,
 igr2=  49,  50,
 &end
#
#    0 AMB  20-2:552      4 PRO  HD-         4.50    (#    552:20  Single Ambig)
 &rst
  ixpk= 552, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  28,  29,  31,  32,  31,  32,
 igr2=  49,  50,
 &end
#
#    0 AMB  20-2:553     14 GLY  HA-         4.50    (#    553:20  Single Ambig)
 &rst
  ixpk= 553, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 igr2= 206, 207,
 &end
#
#    0 AMB  20-2:554      0 AMB  20-1:554    3.50    (#    554:20  Double Ambig)
 &rst
  ixpk= 554, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 igr2= 206, 207, 206, 207,
 &end
#
#    0 AMB  20-2:557      0 AMB  20-1:557    4.50    (#    557:20  Double Ambig)
 &rst
  ixpk= 557, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 250, 251, 250, 251,
 igr2= 253, 254, 253, 254,
 &end
#
#   17 LYS  HG-           0 AMB  20-1:558    4.50    (#    558:20  Single Ambig)
 &rst
  ixpk= 558, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 247, 248,
 igr2= 253, 254, 253, 254,
 &end
#
#    0 AMB  20-2:559      0 AMB  20-1:559    4.50    (#    559:20  Double Ambig)
 &rst
  ixpk= 559, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 720, 721, 720, 721, 720, 721,
 igr2= 723, 724, 723, 724, 723, 724,
 &end
#
#    0 AMB  20-2:560      0 AMB  20-1:560    2.80    (#    560:20  Double Ambig)
 &rst
  ixpk= 560, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 474, 475, 474, 475, 474, 475, 474, 475, 474, 475,
      
 igr2= 477, 478, 477, 478, 477, 478, 455, 456, 455, 456,
      
 &end
#
#    0 AMB  20-2:561      0 AMB  20-1:561    4.50    (#    561:20  Double Ambig)
 &rst
  ixpk= 561, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.00, r4= 9.50,
 igr1= 471, 472, 471, 472, 471, 472, 471, 472,
 igr2= 477, 478, 477, 478, 477, 478, 455, 456,
 &end
#
#    0 AMB  20-2:562      0 AMB  20-1:562    3.50    (#    562:20  Double Ambig)
 &rst
  ixpk= 562, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 449, 450, 449, 450, 449, 450, 449, 450,
 igr2= 455, 456, 455, 456, 477, 478, 477, 478,
 &end
#
#    0 AMB  20-2:563      0 AMB  20-1:563    3.50    (#    563:20  Double Ambig)
 &rst
  ixpk= 563, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 574, 575, 452, 453, 452, 453, 452, 453,
 igr2= 580, 581, 455, 456, 455, 456, 455, 456,
 &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= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 574, 575,  82,  83,  82,  83,  82,  83,
 igr2= 580, 581,  85,  86,  85,  86,  85,  86,
 &end
#
#    0 AMB  20-2:565      0 AMB  20-1:565    4.50    (#    565:20  Double Ambig)
 &rst
  ixpk= 565, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=  76,  77, 574, 575,
 igr2=  85,  86,  85,  86, 580, 581,
 &end
#
#    0 AMB  20-2:566      0 AMB  20-1:566    4.50    (#    566:20  Double Ambig)
 &rst
  ixpk= 566, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  79,  80,  79,  80,
 igr2=  85,  86,  85,  86,
 &end
#
#    6 LYS  HG-           0 AMB  20-1:567    4.50    (#    567:20  Single Ambig)
 &rst
  ixpk= 567, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  79,  80,
 igr2=  85,  86,  85,  86,
 &end
#
#    0 AMB  20-2:568      0 AMB  20-1:568    6.00    (#    568:20  Double Ambig)
 &rst
  ixpk= 568, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.24, r4=12.74,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 igr2=  85,  86,  85,  86,  85,  86,
 &end
#
#   28 VAL  MGY          11 ASP  HB+         8.00    (#    569:20  Unique         2.41, 5.89 A)
 &rst
  ixpk= 569, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 167, 168,
 &end
#
#   38 LYS  HB-          42 ASP  HB-         6.00    (#    570:20  Unique         2.35, 4.02 A)
 &rst
  ixpk= 570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 571, 572,
 igr2= 644, 645,
 &end
#
#    0 AMB  20-2:571     33 MET  HG-         2.80    (#    571:20  Single Ambig)
 &rst
  ixpk= 571, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 500, 501, 500, 501,
 igr2= 503, 504,
 &end
#
#   29 ILE  MG2          33 MET  HG-         4.50    (#    572:20  Unique         3.08, 4.57 A)
 &rst
  ixpk= 572, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 429, 430, 431,
 igr2= 503, 504,
 &end
#
#   48 LEU  MDY          44 LEU  HB-         3.50    (#    573:20  Unique         2.26, 4.63 A)
 &rst
  ixpk= 573, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 676, 677,
 &end
#
#    0 AMB  20-2:574     44 LEU  HB-         4.50    (#    574:20  Single Ambig)
 &rst
  ixpk= 574, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 igr2= 676, 677,
 &end
#
#   48 LEU  MDY          44 LEU  HB+         3.50    (#    575:20  Unique         2.26, 4.63 A)
 &rst
  ixpk= 575, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 676, 677,
 &end
#
#    0 AMB  20-2:576      0 AMB  20-1:576    3.50    (#    576:20  Double Ambig)
 &rst
  ixpk= 576, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 igr2= 676, 677, 676, 677,
 &end
#
#   48 LEU  MDY          48 LEU  HB+         3.50    (#    577:20  Unique         2.37, 3.34 A)
 &rst
  ixpk= 577, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 751, 752,
 &end
#
#   48 LEU  MDY          48 LEU  HB-         4.50    (#    578:20  Unique         2.37, 3.34 A)
 &rst
  ixpk= 578, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 751, 752,
 &end
#
#    0 AMB  20-2:579      0 AMB  20-1:579    2.80    (#    579:20  Double Ambig)
 &rst
  ixpk= 579, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 615, 616, 617, 619, 620, 621, 615, 616, 617, 619,
       620, 621,
 igr2= 610, 611, 610, 611,
 &end
#
#    0 AMB  20-2:580     40 LEU  HB-         3.50    (#    580:20  Single Ambig)
 &rst
  ixpk= 580, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 615, 616, 617, 619, 620, 621, 615, 616, 617, 619,
       620, 621,
 igr2= 610, 611,
 &end
#
#   45 ILE  MG2          45 ILE  HB          3.50    (#    581:20  Unique         2.42, 2.67 A)
 &rst
  ixpk= 581, nxpk= 20, iat=  -1, 695, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 697, 698, 699,
 &end
#
#   45 ILE  MD1          45 ILE  HB          4.50    (#    582:20  Unique         2.42, 3.12 A)
 &rst
  ixpk= 582, nxpk= 20, iat=  -1, 695, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 704, 705, 706,
 &end
#
#    6 LYS  HG-           6 LYS  HB+         6.00    (#    583:20  Unique         2.20, 2.76 A)
 &rst
  ixpk= 583, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  79,  80,
 igr2=  76,  77,
 &end
#
#   25 THR  MG2          30 LYS  HB+         8.00    (#    584:20  Unique         2.80, 4.19 A)
 &rst
  ixpk= 584, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 375, 376, 377,
 igr2= 446, 447,
 &end
#
#    0 AMB  20-2:585     10 VAL  HB          2.80    (#    585:20  Single Ambig)
 &rst
  ixpk= 585, nxpk= 20, iat=  -1, 151, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   28 VAL  MGX          28 VAL  HB          3.50    (#    586:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 586, nxpk= 20, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#    0 AMB  20-2:587     26 PRO  HB-         4.50    (#    587:20  Single Ambig)
 &rst
  ixpk= 587, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 387, 388, 427,
 igr2= 390, 391,
 &end
#
#   48 LEU  MDY           0 AMB  20-1:588    4.50    (#    588:20  Single Ambig)
 &rst
  ixpk= 588, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2=  82,  83,  82,  83,
 &end
#
#   48 LEU  MDY           0 AMB  20-1:589    4.50    (#    589:20  Single Ambig)
 &rst
  ixpk= 589, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 629, 630, 629, 630,
 &end
#
#   45 ILE  MG2          45 ILE  HG1-        4.50    (#    590:20  Unique         2.40, 3.54 A)
 &rst
  ixpk= 590, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 697, 698, 699,
 igr2= 701, 702,
 &end
#
#   45 ILE  MD1          45 ILE  HG1-        3.50    (#    591:20  Unique         2.32, 2.64 A)
 &rst
  ixpk= 591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 704, 705, 706,
 igr2= 701, 702,
 &end
#
#   48 LEU  MDY          44 LEU  HG          6.00    (#    594:20  Unique         2.08, 4.91 A)
 &rst
  ixpk= 594, nxpk= 20, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 756, 757, 758, 760, 761, 762,
 &end
#
#   40 LEU  MDX          40 LEU  HG          4.50    (#    595:20  Unique         2.38, 2.65 A)
 &rst
  ixpk= 595, nxpk= 20, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 615, 616, 617, 619, 620, 621,
 &end
#
#    6 LYS  HG-          48 LEU  HG          6.00    (#    596:20  Unique         5.34, 6.39 A)
 &rst
  ixpk= 596, nxpk= 20, iat=  -1, 754, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  79,  80,
 &end
#
#   17 LYS  HB+          17 LYS  HG+         3.50    (#    601:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 244, 245,
 igr2= 247, 248,
 &end
#
#   45 ILE  MD1           5 ALA  MB          4.50    (#    609:20  Unique         2.89, 5.25 A)
 &rst
  ixpk= 609, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 704, 705, 706,
 igr2=  66,  67,  68,
 &end
#
#   28 VAL  MGX          32 ALA  MB          6.00    (#    610:20  Unique         3.46, 6.44 A)
 &rst
  ixpk= 610, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 490, 491, 492,
 &end
#
#   40 LEU  MDX          33 MET  ME          3.50    (#    613:20  Unique         2.30, 4.51 A)
 &rst
  ixpk= 613, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 615, 616, 617, 619, 620, 621,
 igr2= 507, 508, 509,
 &end
#
#   29 ILE  MG2          33 MET  ME          4.50    (#    614:20  Unique         2.28, 4.60 A)
 &rst
  ixpk= 614, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 429, 430, 431,
 igr2= 507, 508, 509,
 &end
#
#   32 ALA  HA           36 GLN  HB+         6.00    (#    615:20  Unique         2.27, 3.62 A)
 &rst
  ixpk= 615, nxpk= 20, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 547, 548,
 &end
#
#    0 AMB  20-2:616      4 PRO  HB-         2.80    (#    616:20  Single Ambig)
 &rst
  ixpk= 616, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=  52,  53,  52,  53,
 igr2=  55,  56,
 &end
#
#    0 AMB  20-2:617      0 AMB  20-1:617    2.80    (#    617:20  Double Ambig)
 &rst
  ixpk= 617, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  52,  53,  52,  53,
 igr2=  55,  56,  55,  56,
 &end
#
#    4 PRO  HB-           0 AMB  20-1:618    2.80    (#    618:20  Single Ambig)
 &rst
  ixpk= 618, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=  55,  56,
 igr2=  52,  53,  52,  53,
 &end
#
#    0 AMB  20-2:619      0 AMB  20-1:619    2.80    (#    619:20  Double Ambig)
 &rst
  ixpk= 619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  55,  56,  55,  56,
 igr2=  52,  53,  52,  53,
 &end
#
#    6 LYS  HG-           6 LYS  HA          4.50    (#    620:20  Unique         2.46, 3.17 A)
 &rst
  ixpk= 620, nxpk= 20, iat=  -1,  74, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  79,  80,
 &end
#
#    6 LYS  HG+           6 LYS  HB+         3.50    (#    621:20  Unique         2.20, 2.76 A)
 &rst
  ixpk= 621, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  79,  80,
 igr2=  76,  77,
 &end
#
#    6 LYS  HG+           6 LYS  HB-         3.50    (#    622:20  Unique         2.20, 2.76 A)
 &rst
  ixpk= 622, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  79,  80,
 igr2=  76,  77,
 &end
#
#    6 LYS  HG-           6 LYS  HB-         6.00    (#    623:20  Unique         2.20, 2.76 A)
 &rst
  ixpk= 623, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  79,  80,
 igr2=  76,  77,
 &end
#
#    7 TYR  HN            7 TYR  HA          6.00    (#    624:20  Unique         2.96, 2.97 A)
 &rst
  ixpk= 624, nxpk= 20, iat=  94,  96, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:625      7 TYR  HA          4.50    (#    625:20  Single Ambig)
 &rst
  ixpk= 625, nxpk= 20, iat=  -1,  96, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  98,  99, 656, 657,
 &end
#
#    7 TYR  HB+           7 TYR  HA          6.00    (#    626:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 626, nxpk= 20, iat=  -1,  96, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  98,  99,
 &end
#
#    7 TYR  HD            7 TYR  HA          6.00    (#    627:20  Unique         2.60, 3.62 A)
 &rst
  ixpk= 627, nxpk= 20, iat=  -1,  96, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 102, 111,
 &end
#
#    7 TYR  HA            7 TYR  HB+         6.00    (#    628:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 628, nxpk= 20, iat=  96,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  98,  99,
 &end
#
#    8 SER  HN            8 SER  HB-         6.00    (#    629:20  Unique         2.75, 3.34 A)
 &rst
  ixpk= 629, nxpk= 20, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 119, 120,
 &end
#
#    8 SER  HB-           8 SER  HA          4.50    (#    632:20  Unique         2.38, 2.64 A)
 &rst
  ixpk= 632, nxpk= 20, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 119, 120,
 &end
#
#    9 TYR  HB+           9 TYR  HA          3.50    (#    633:20  Unique         2.34, 2.41 A)
 &rst
  ixpk= 633, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 130, 131,
 &end
#
#    9 TYR  HB-           9 TYR  HA          3.50    (#    634:20  Unique         2.34, 2.41 A)
 &rst
  ixpk= 634, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 130, 131,
 &end
#
#   11 ASP  HN           11 ASP  HB-         6.00    (#    635:20  Unique         2.46, 3.03 A)
 &rst
  ixpk= 635, nxpk= 20, iat= 163,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 167, 168,
 &end
#
#    0 AMB  20-2:636      0 AMB  20-1:636    2.80    (#    636:20  Double Ambig)
 &rst
  ixpk= 636, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 182, 183, 182, 183,
 igr2= 179, 180, 179, 180,
 &end
#
#    0 AMB  20-2:637     12 GLU  HB-         2.80    (#    637:20  Single Ambig)
 &rst
  ixpk= 637, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 182, 183, 182, 183,
 igr2= 179, 180,
 &end
#
#    0 AMB  20-2:638      0 AMB  20-1:638    2.80    (#    638:20  Double Ambig)
 &rst
  ixpk= 638, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 179, 180, 179, 180,
 igr2= 182, 183, 182, 183,
 &end
#
#   12 GLU  HB-           0 AMB  20-1:639    2.80    (#    639:20  Single Ambig)
 &rst
  ixpk= 639, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 179, 180,
 igr2= 182, 183, 182, 183,
 &end
#
#    0 AMB  20-2:640     13 ASN  HA          6.00    (#    640:20  Single Ambig)
 &rst
  ixpk= 640, nxpk= 20, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 194, 195, 194, 195,
 &end
#
#   13 ASN  HA           14 GLY  HA-         6.00    (#    641:20  Unique         4.56, 4.87 A)
 &rst
  ixpk= 641, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 206, 207,
 &end
#
#   17 LYS  HN           17 LYS  HA          8.00    (#    668:20  Unique         2.81, 2.96 A)
 &rst
  ixpk= 668, nxpk= 20, iat= 240, 242, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   17 LYS  HB-          17 LYS  HA          6.00    (#    674:20  Unique         2.41, 2.81 A)
 &rst
  ixpk= 674, nxpk= 20, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 244, 245,
 &end
#
#   17 LYS  HD+          17 LYS  HA          8.00    (#    675:20  Unique         2.19, 3.62 A)
 &rst
  ixpk= 675, nxpk= 20, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 250, 251,
 &end
#
#    0 AMB  20-2:676     17 LYS  HA          6.00    (#    676:20  Single Ambig)
 &rst
  ixpk= 676, nxpk= 20, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 247, 248, 268, 269, 270,
 &end
#
#   17 LYS  HB+          17 LYS  HA          8.00    (#    679:20  Unique         2.41, 2.81 A)
 &rst
  ixpk= 679, nxpk= 20, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 244, 245,
 &end
#
#    4 PRO  HD-           3 ARG  HB-         6.00    (#    682:20  Unique         2.22, 3.83 A)
 &rst
  ixpk= 682, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  49,  50,
 igr2=  28,  29,
 &end
#
#    4 PRO  HD-           3 ARG  HB+         8.00    (#    683:20  Unique         2.22, 3.83 A)
 &rst
  ixpk= 683, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1=  49,  50,
 igr2=  28,  29,
 &end
#
#    3 ARG  HA            3 ARG  HB+         6.00    (#    684:20  Unique         2.43, 2.77 A)
 &rst
  ixpk= 684, nxpk= 20, iat=  26,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  28,  29,
 &end
#
#    7 TYR  HD           40 LEU  HG          8.00    (#    688:20  Unique         3.05, 6.10 A)
 &rst
  ixpk= 688, nxpk= 20, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 102, 111,
 &end
#
#   41 GLU  HN           40 LEU  HG          6.00    (#    689:20  Unique         4.11, 4.95 A)
 &rst
  ixpk= 689, nxpk= 20, iat= 625, 613, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   40 LEU  HN           40 LEU  HG          6.00    (#    690:20  Unique         2.08, 3.48 A)
 &rst
  ixpk= 690, nxpk= 20, iat= 606, 613, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   24 ARG  HA            0 AMB  20-1:691    6.00    (#    691:20  Single Ambig)
 &rst
  ixpk= 691, nxpk= 20, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 355, 356, 355, 356,
 &end
#
#    4 PRO  HD-           4 PRO  HA          6.00    (#    700:20  Unique         3.50, 3.79 A)
 &rst
  ixpk= 700, nxpk= 20, iat=  -1,  58, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  49,  50,
 &end
#
#    4 PRO  HD+           4 PRO  HA          6.00    (#    701:20  Unique         3.50, 3.79 A)
 &rst
  ixpk= 701, nxpk= 20, iat=  -1,  58, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  49,  50,
 &end
#
#    4 PRO  HD+           4 PRO  HB-         6.00    (#    703:20  Unique         2.77, 3.67 A)
 &rst
  ixpk= 703, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  49,  50,
 igr2=  55,  56,
 &end
#
#    4 PRO  HD-           4 PRO  HB-         6.00    (#    704:20  Unique         2.77, 3.67 A)
 &rst
  ixpk= 704, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  49,  50,
 igr2=  55,  56,
 &end
#
#    4 PRO  HD-           4 PRO  HB+         6.00    (#    705:20  Unique         2.77, 3.67 A)
 &rst
  ixpk= 705, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  49,  50,
 igr2=  55,  56,
 &end
#
#    5 ALA  HN            4 PRO  HB-         6.00    (#    706:20  Unique         2.52, 3.21 A)
 &rst
  ixpk= 706, nxpk= 20, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  55,  56,
 &end
#
#    5 ALA  HN            4 PRO  HB+         6.00    (#    707:20  Unique         2.52, 3.21 A)
 &rst
  ixpk= 707, nxpk= 20, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  55,  56,
 &end
#
#    3 ARG  HA            0 AMB  20-1:709    6.00    (#    709:20  Single Ambig)
 &rst
  ixpk= 709, nxpk= 20, iat=  26,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2=  52,  53,  52,  53,
 &end
#
#    4 PRO  HA            4 PRO  HD+         6.00    (#    714:20  Unique         3.50, 3.79 A)
 &rst
  ixpk= 714, nxpk= 20, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  49,  50,
 &end
#
#    4 PRO  HA            4 PRO  HD-         6.00    (#    715:20  Unique         3.50, 3.79 A)
 &rst
  ixpk= 715, nxpk= 20, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  49,  50,
 &end
#
#    5 ALA  HA            4 PRO  HD+         6.00    (#    719:20  Unique         5.98, 6.55 A)
 &rst
  ixpk= 719, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  49,  50,
 &end
#
#    5 ALA  HA            4 PRO  HD-         6.00    (#    720:20  Unique         5.98, 6.55 A)
 &rst
  ixpk= 720, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  49,  50,
 &end
#
#    4 PRO  HB-           4 PRO  HD+         6.00    (#    724:20  Unique         2.77, 3.67 A)
 &rst
  ixpk= 724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  55,  56,
 igr2=  49,  50,
 &end
#
#    4 PRO  HB-           4 PRO  HD-         6.00    (#    725:20  Unique         2.77, 3.67 A)
 &rst
  ixpk= 725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  55,  56,
 igr2=  49,  50,
 &end
#
#    3 ARG  HB+           4 PRO  HD+         6.00    (#    726:20  Unique         2.22, 3.83 A)
 &rst
  ixpk= 726, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  28,  29,
 igr2=  49,  50,
 &end
#
#    5 ALA  MB            4 PRO  HD-         8.00    (#    727:20  Unique         6.40, 7.68 A)
 &rst
  ixpk= 727, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1=  66,  67,  68,
 igr2=  49,  50,
 &end
#
#    7 TYR  HN            5 ALA  HA          6.00    (#    735:20  Unique         3.72, 3.83 A)
 &rst
  ixpk= 735, nxpk= 20, iat=  94,  64, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:736      5 ALA  HA          8.00    (#    736:20  Single Ambig)
 &rst
  ixpk= 736, nxpk= 20, iat=  -1,  64, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1=  55,  56,  28,  29,
 &end
#
#    6 LYS  HG+           5 ALA  HA          8.00    (#    737:20  Unique         3.76, 6.02 A)
 &rst
  ixpk= 737, nxpk= 20, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1=  79,  80,
 &end
#
#    7 TYR  HN            5 ALA  MB          6.00    (#    749:20  Unique         2.43, 3.73 A)
 &rst
  ixpk= 749, nxpk= 20, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=  66,  67,  68,
 &end
#
#   19 TRP  HN            5 ALA  MB          6.00    (#    750:20  Unique         2.58, 3.69 A)
 &rst
  ixpk= 750, nxpk= 20, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=  66,  67,  68,
 &end
#
#    7 TYR  HE           44 LEU  HA          6.00    (#    753:20  Unique         3.38, 4.87 A)
 &rst
  ixpk= 753, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 104, 109,
 &end
#
#   47 GLU  HB-          46 LYS  HA          8.00    (#    757:20  Unique         3.95, 5.43 A)
 &rst
  ixpk= 757, nxpk= 20, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 736, 737,
 &end
#
#    0 AMB  20-2:758      0 AMB  20-1:758    6.00    (#    758:20  Double Ambig)
 &rst
  ixpk= 758, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 701, 702, 701, 702,
 igr2= 674, 712,
 &end
#
#    6 LYS  HN            6 LYS  HB+         4.50    (#    760:20  Unique         2.67, 3.22 A)
 &rst
  ixpk= 760, nxpk= 20, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  76,  77,
 &end
#
#    6 LYS  HN            6 LYS  HB-         4.50    (#    761:20  Unique         2.67, 3.22 A)
 &rst
  ixpk= 761, nxpk= 20, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  76,  77,
 &end
#
#    7 TYR  HN            6 LYS  HB+         6.00    (#    762:20  Unique         3.31, 4.12 A)
 &rst
  ixpk= 762, nxpk= 20, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  76,  77,
 &end
#
#    7 TYR  HN            6 LYS  HB-         6.00    (#    763:20  Unique         3.31, 4.12 A)
 &rst
  ixpk= 763, nxpk= 20, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  76,  77,
 &end
#
#    7 TYR  HD            6 LYS  HB+         6.00    (#    764:20  Unique         2.57, 5.34 A)
 &rst
  ixpk= 764, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 102, 111,
 igr2=  76,  77,
 &end
#
#    7 TYR  HD            6 LYS  HB-         6.00    (#    765:20  Unique         2.57, 5.34 A)
 &rst
  ixpk= 765, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 102, 111,
 igr2=  76,  77,
 &end
#
#   45 ILE  MD1           6 LYS  HB+         6.00    (#    773:20  Unique         5.12, 7.05 A)
 &rst
  ixpk= 773, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 704, 705, 706,
 igr2=  76,  77,
 &end
#
#   45 ILE  MD1           6 LYS  HB-         6.00    (#    774:20  Unique         5.12, 7.05 A)
 &rst
  ixpk= 774, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 704, 705, 706,
 igr2=  76,  77,
 &end
#
#   45 ILE  HN           48 LEU  MDY         6.00    (#    776:20  Unique         4.39, 6.65 A)
 &rst
  ixpk= 776, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#    7 TYR  HE           48 LEU  MDY         6.00    (#    778:20  Unique         2.26, 7.10 A)
 &rst
  ixpk= 778, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 104, 109,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#   41 GLU  HG+          48 LEU  MDY         6.00    (#    781:20  Unique         2.31, 5.49 A)
 &rst
  ixpk= 781, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 632, 633,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:782     48 LEU  MDY         2.80    (#    782:20  Single Ambig)
 &rst
  ixpk= 782, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 igr2= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:787      0 AMB  20-1:787    2.80    (#    787:20  Double Ambig)
 &rst
  ixpk= 787, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=  76,  77, 717, 718, 717, 718,
 igr2=  79,  80,  79,  80,  79,  80,
 &end
#
#    0 AMB  20-2:790      0 AMB  20-1:790    6.00    (#    790:20  Double Ambig)
 &rst
  ixpk= 790, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 399, 444,
 igr2= 474, 475, 474, 475, 474, 475,
 &end
#
#    0 AMB  20-2:791      0 AMB  20-1:791    6.00    (#    791:20  Double Ambig)
 &rst
  ixpk= 791, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 444, 399,
 igr2= 452, 453, 452, 453, 452, 453,
 &end
#
#   31 LYS  HA            0 AMB  20-1:792    6.00    (#    792:20  Single Ambig)
 &rst
  ixpk= 792, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 474, 475, 474, 475,
 &end
#
#    7 TYR  HE            0 AMB  20-1:794    6.00    (#    794:20  Single Ambig)
 &rst
  ixpk= 794, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 104, 109,
 igr2=  82,  83,  82,  83,
 &end
#
#    0 AMB  20-2:800      0 AMB  20-1:800    2.80    (#    800:20  Double Ambig)
 &rst
  ixpk= 800, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 449, 450, 449, 450,
 igr2= 474, 475, 474, 475,
 &end
#
#    0 AMB  20-2:801      0 AMB  20-1:801    2.80    (#    801:20  Double Ambig)
 &rst
  ixpk= 801, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 446, 447, 446, 447, 449, 450, 449, 450,
 igr2= 452, 453, 452, 453, 452, 453,
 &end
#
#    0 AMB  20-2:802      0 AMB  20-1:802    6.00    (#    802:20  Double Ambig)
 &rst
  ixpk= 802, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 701, 702, 701, 702,
 igr2=  82,  83,  82,  83,
 &end
#
#    0 AMB  20-2:803      0 AMB  20-1:803    6.00    (#    803:20  Double Ambig)
 &rst
  ixpk= 803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.24, r4=12.74,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 igr2=  82,  83,  82,  83,  82,  83,
 &end
#
#    7 TYR  HE            0 AMB  20-1:805    6.00    (#    805:20  Single Ambig)
 &rst
  ixpk= 805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 104, 109,
 igr2=  85,  86,  85,  86,
 &end
#
#   28 VAL  HA            0 AMB  20-1:809    6.00    (#    809:20  Single Ambig)
 &rst
  ixpk= 809, nxpk= 20, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 477, 478, 477, 478,
 &end
#
#   45 ILE  HG1-          7 TYR  HA          6.00    (#    816:20  Unique         2.29, 3.19 A)
 &rst
  ixpk= 816, nxpk= 20, iat=  -1,  96, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 701, 702,
 &end
#
#    0 AMB  20-2:817      0 AMB  20-1:817    6.00    (#    817:20  Double Ambig)
 &rst
  ixpk= 817, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 199, 200, 295,
 igr2= 167, 168,  98,  99,
 &end
#
#   19 TRP  HE3           7 TYR  HB+         4.50    (#    818:20  Unique         2.49, 2.85 A)
 &rst
  ixpk= 818, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  98,  99,
 &end
#
#    7 TYR  HN            7 TYR  HB-         6.00    (#    819:20  Unique         2.73, 3.37 A)
 &rst
  ixpk= 819, nxpk= 20, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  98,  99,
 &end
#
#    8 SER  HN            7 TYR  HB-         6.00    (#    820:20  Unique         2.49, 3.22 A)
 &rst
  ixpk= 820, nxpk= 20, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  98,  99,
 &end
#
#    8 SER  HN            7 TYR  HB+         6.00    (#    821:20  Unique         2.49, 3.22 A)
 &rst
  ixpk= 821, nxpk= 20, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  98,  99,
 &end
#
#    0 AMB  20-2:823      0 AMB  20-1:823    6.00    (#    823:20  Double Ambig)
 &rst
  ixpk= 823, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 136, 141, 293,
 igr2= 167, 168,  98,  99,
 &end
#
#   44 LEU  HA            7 TYR  HB-         8.00    (#    825:20  Single Ambig)
 &rst
  ixpk= 825, nxpk= 20, iat= 674,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2=  98,  99,
 &end
#
#    0 AMB  20-2:826      0 AMB  20-1:826    8.00    (#    826:20  Double Ambig)
 &rst
  ixpk= 826, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.59, r4=14.09,
 igr1=  74, 674, 712,
 igr2= 723, 724, 723, 724,  98,  99, 723, 724,
 &end
#
#   43 PHE  HB-           7 TYR  HB-         6.00    (#    827:20  Unique         2.80, 4.14 A)
 &rst
  ixpk= 827, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 656, 657,
 igr2=  98,  99,
 &end
#
#   43 PHE  HB-           7 TYR  HB+         6.00    (#    828:20  Unique         2.80, 4.14 A)
 &rst
  ixpk= 828, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 656, 657,
 igr2=  98,  99,
 &end
#
#    7 TYR  HD            7 TYR  HE          3.50    (#    831:20  Unique         2.47, 3.73 A)
 &rst
  ixpk= 831, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 102, 111,
 igr2= 104, 109,
 &end
#
#    0 AMB  20-2:837      7 TYR  HE          6.00    (#    837:20  Single Ambig)
 &rst
  ixpk= 837, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 608, 627,
 igr2= 104, 109,
 &end
#
#   21 GLY  HA-           7 TYR  HE          6.00    (#    838:20  Unique         2.20, 4.39 A)
 &rst
  ixpk= 838, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 316, 317,
 igr2= 104, 109,
 &end
#
#    0 AMB  20-2:839      7 TYR  HE          4.50    (#    839:20  Single Ambig)
 &rst
  ixpk= 839, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 610, 611, 676, 677, 679,
 igr2= 104, 109,
 &end
#
#    0 AMB  20-2:840      7 TYR  HE          6.00    (#    840:20  Single Ambig)
 &rst
  ixpk= 840, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=  82,  83,  82,  83,
 igr2= 104, 109,
 &end
#
#   48 LEU  MDY           7 TYR  HE          6.00    (#    841:20  Unique         2.26, 7.10 A)
 &rst
  ixpk= 841, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 104, 109,
 &end
#
#    0 AMB  20-2:842      7 TYR  HE          6.00    (#    842:20  Single Ambig)
 &rst
  ixpk= 842, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1= 615, 616, 617, 619, 620, 621, 681, 682, 683, 685,
       686, 687, 681, 682, 683, 685, 686, 687,
 igr2= 104, 109,
 &end
#
#   19 TRP  HN            8 SER  HA          6.00    (#    843:20  Unique         3.07, 3.51 A)
 &rst
  ixpk= 843, nxpk= 20, iat= 276, 117, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    9 TYR  HD            8 SER  HA          6.00    (#    844:20  Unique         3.25, 5.13 A)
 &rst
  ixpk= 844, nxpk= 20, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 134, 143,
 &end
#
#   18 THR  HA            8 SER  HA          3.50    (#    845:20  Unique         2.01, 2.08 A)
 &rst
  ixpk= 845, nxpk= 20, iat= 264, 117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 THR  MG2           8 SER  HA          6.00    (#    846:20  Unique         2.53, 3.98 A)
 &rst
  ixpk= 846, nxpk= 20, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 268, 269, 270,
 &end
#
#   18 THR  HA            8 SER  HB-         6.00    (#    847:20  Unique         2.69, 3.82 A)
 &rst
  ixpk= 847, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 119, 120,
 &end
#
#   18 THR  HA            8 SER  HB+         6.00    (#    848:20  Unique         2.69, 3.82 A)
 &rst
  ixpk= 848, nxpk= 20, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 119, 120,
 &end
#
#    9 TYR  HN            8 SER  HB+         6.00    (#    849:20  Unique         2.25, 3.59 A)
 &rst
  ixpk= 849, nxpk= 20, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 119, 120,
 &end
#
#   45 ILE  HG1-          8 SER  HB-         6.00    (#    858:20  Unique         3.38, 4.81 A)
 &rst
  ixpk= 858, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 701, 702,
 igr2= 119, 120,
 &end
#
#   45 ILE  HG1-          8 SER  HB+         6.00    (#    859:20  Unique         3.38, 4.81 A)
 &rst
  ixpk= 859, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 701, 702,
 igr2= 119, 120,
 &end
#
#   45 ILE  MG2           8 SER  HB-         6.00    (#    860:20  Unique         2.38, 5.51 A)
 &rst
  ixpk= 860, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 697, 698, 699,
 igr2= 119, 120,
 &end
#
#   45 ILE  MG2           8 SER  HB+         6.00    (#    861:20  Unique         2.38, 5.51 A)
 &rst
  ixpk= 861, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 697, 698, 699,
 igr2= 119, 120,
 &end
#
#   43 PHE  HD            9 TYR  HA          6.00    (#    862:20  Unique         2.61, 5.09 A)
 &rst
  ixpk= 862, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 660, 668,
 &end
#
#    9 TYR  HD            9 TYR  HA          6.00    (#    863:20  Unique         4.11, 4.24 A)
 &rst
  ixpk= 863, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 134, 143,
 &end
#
#   16 THR  MG2           9 TYR  HA          6.00    (#    866:20  Unique         5.18, 7.28 A)
 &rst
  ixpk= 866, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 232, 233, 234,
 &end
#
#    0 AMB  20-2:867      9 TYR  HA          6.00    (#    867:20  Single Ambig)
 &rst
  ixpk= 867, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   29 ILE  MD1           9 TYR  HA          8.00    (#    868:20  Unique         3.18, 5.39 A)
 &rst
  ixpk= 868, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 436, 437, 438,
 &end
#
#    9 TYR  HN            9 TYR  HB+         6.00    (#    870:20  Unique         3.29, 3.69 A)
 &rst
  ixpk= 870, nxpk= 20, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 130, 131,
 &end
#
#   43 PHE  HD            9 TYR  HB-         4.50    (#    871:20  Unique         2.51, 5.18 A)
 &rst
  ixpk= 871, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 660, 668,
 igr2= 130, 131,
 &end
#
#   43 PHE  HD            9 TYR  HB+         6.00    (#    872:20  Unique         2.51, 5.18 A)
 &rst
  ixpk= 872, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 660, 668,
 igr2= 130, 131,
 &end
#
#   43 PHE  HE            9 TYR  HB-         6.00    (#    873:20  Unique         2.97, 5.55 A)
 &rst
  ixpk= 873, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 662, 666,
 igr2= 130, 131,
 &end
#
#    9 TYR  HE            9 TYR  HB-         6.00    (#    874:20  Unique         4.65, 5.07 A)
 &rst
  ixpk= 874, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 136, 141,
 igr2= 130, 131,
 &end
#
#    9 TYR  HE            9 TYR  HB+         8.00    (#    875:20  Unique         4.65, 5.07 A)
 &rst
  ixpk= 875, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 136, 141,
 igr2= 130, 131,
 &end
#
#   28 VAL  MGY           9 TYR  HB-         8.00    (#    879:20  Unique         2.40, 4.83 A)
 &rst
  ixpk= 879, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 130, 131,
 &end
#
#   28 VAL  MGY           9 TYR  HB+         8.00    (#    880:20  Unique         2.40, 4.83 A)
 &rst
  ixpk= 880, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 130, 131,
 &end
#
#   28 VAL  MGX           9 TYR  HB-         6.00    (#    881:20  Unique         2.40, 4.83 A)
 &rst
  ixpk= 881, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 130, 131,
 &end
#
#   28 VAL  MGX           9 TYR  HB+         4.50    (#    882:20  Unique         2.40, 4.83 A)
 &rst
  ixpk= 882, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 130, 131,
 &end
#
#   29 ILE  HG1-          9 TYR  HB-         8.00    (#    883:20  Unique         2.42, 3.53 A)
 &rst
  ixpk= 883, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 433, 434,
 igr2= 130, 131,
 &end
#
#   29 ILE  HG1-          9 TYR  HB+         8.00    (#    884:20  Unique         2.42, 3.53 A)
 &rst
  ixpk= 884, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 433, 434,
 igr2= 130, 131,
 &end
#
#   29 ILE  MD1           9 TYR  HB-         6.00    (#    885:20  Unique         2.26, 4.13 A)
 &rst
  ixpk= 885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 436, 437, 438,
 igr2= 130, 131,
 &end
#
#   29 ILE  MD1           9 TYR  HB+         6.00    (#    886:20  Unique         2.26, 4.13 A)
 &rst
  ixpk= 886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 436, 437, 438,
 igr2= 130, 131,
 &end
#
#    9 TYR  HA           10 VAL  HA          8.00    (#    887:20  Unique         4.39, 4.44 A)
 &rst
  ixpk= 887, nxpk= 20, iat= 128, 149, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   11 ASP  HB-          10 VAL  HA          8.00    (#    890:20  Unique         4.13, 4.46 A)
 &rst
  ixpk= 890, nxpk= 20, iat=  -1, 149, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 167, 168,
 &end
#
#   11 ASP  HB+          10 VAL  HA          8.00    (#    891:20  Unique         4.13, 4.46 A)
 &rst
  ixpk= 891, nxpk= 20, iat=  -1, 149, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 167, 168,
 &end
#
#   11 ASP  HN           10 VAL  HB          6.00    (#    894:20  Unique         2.28, 3.71 A)
 &rst
  ixpk= 894, nxpk= 20, iat= 163, 151, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   16 THR  HN            0 AMB  20-1:896    6.00    (#    896:20  Single Ambig)
 &rst
  ixpk= 896, nxpk= 20, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#    9 TYR  HA            0 AMB  20-1:898    6.00    (#    898:20  Single Ambig)
 &rst
  ixpk= 898, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#    0 AMB  20-2:910      0 AMB  20-1:910    8.00    (#    910:20  Double Ambig)
 &rst
  ixpk= 910, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 190, 204,
 igr2= 167, 168, 167, 168,
 &end
#
#    9 TYR  HE           11 ASP  HB+         4.50    (#    911:20  Unique         3.18, 6.78 A)
 &rst
  ixpk= 911, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 136, 141,
 igr2= 167, 168,
 &end
#
#   28 VAL  MGY          11 ASP  HB-         8.00    (#    913:20  Unique         2.41, 5.89 A)
 &rst
  ixpk= 913, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 167, 168,
 &end
#
#    0 AMB  20-2:924      0 AMB  20-1:924    6.00    (#    924:20  Double Ambig)
 &rst
  ixpk= 924, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1= 194, 195, 194, 195, 194, 195,
 igr2= 182, 183, 182, 183, 182, 183,
 &end
#
#   12 GLU  HB-           0 AMB  20-1:933    8.00    (#    933:20  Single Ambig)
 &rst
  ixpk= 933, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 179, 180,
 igr2= 194, 195, 194, 195,
 &end
#
#    0 AMB  20-2:934      0 AMB  20-1:934    6.00    (#    934:20  Double Ambig)
 &rst
  ixpk= 934, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 179, 180, 179, 180,
 igr2= 194, 195, 194, 195,
 &end
#
#   15 GLU  HG-          15 GLU  HA          4.50    (#    936:20  Unique         2.42, 3.49 A)
 &rst
  ixpk= 936, nxpk= 20, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 218, 219,
 &end
#
#   16 THR  HN            0 AMB  20-1:937    4.50    (#    937:20  Single Ambig)
 &rst
  ixpk= 937, nxpk= 20, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 215, 216, 215, 216,
 &end
#
#   15 GLU  HN           15 GLU  HG-         4.50    (#    938:20  Unique         1.99, 3.09 A)
 &rst
  ixpk= 938, nxpk= 20, iat= 211,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 218, 219,
 &end
#
#   16 THR  HN           15 GLU  HG-         6.00    (#    939:20  Unique         3.51, 4.82 A)
 &rst
  ixpk= 939, nxpk= 20, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 218, 219,
 &end
#
#   16 THR  HN           16 THR  HA          6.00    (#    943:20  Unique         2.81, 2.94 A)
 &rst
  ixpk= 943, nxpk= 20, iat= 226, 228, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   16 THR  HB           16 THR  HA          6.00    (#    944:20  Unique         2.44, 2.96 A)
 &rst
  ixpk= 944, nxpk= 20, iat= 230, 228, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   17 LYS  HN           16 THR  HB          6.00    (#    946:20  Unique         2.11, 2.58 A)
 &rst
  ixpk= 946, nxpk= 20, iat= 240, 230, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   16 THR  HA           16 THR  HB          4.50    (#    948:20  Unique         2.44, 2.96 A)
 &rst
  ixpk= 948, nxpk= 20, iat= 228, 230, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 GLU  HA           16 THR  HB          6.00    (#    950:20  Unique         4.22, 4.43 A)
 &rst
  ixpk= 950, nxpk= 20, iat= 213, 230, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   17 LYS  HN           17 LYS  HB-         4.50    (#    953:20  Unique         2.78, 3.40 A)
 &rst
  ixpk= 953, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 244, 245,
 &end
#
#   18 THR  HN           17 LYS  HB+         6.00    (#    954:20  Unique         1.99, 3.10 A)
 &rst
  ixpk= 954, nxpk= 20, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 244, 245,
 &end
#
#    9 TYR  HD           17 LYS  HB-         8.00    (#    955:20  Unique         3.66, 4.95 A)
 &rst
  ixpk= 955, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 134, 143,
 igr2= 244, 245,
 &end
#
#    9 TYR  HD           17 LYS  HB+         8.00    (#    956:20  Unique         3.66, 4.95 A)
 &rst
  ixpk= 956, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 134, 143,
 igr2= 244, 245,
 &end
#
#    9 TYR  HE           17 LYS  HB-         6.00    (#    957:20  Unique         2.64, 4.03 A)
 &rst
  ixpk= 957, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 136, 141,
 igr2= 244, 245,
 &end
#
#    9 TYR  HE           17 LYS  HB+         6.00    (#    958:20  Unique         2.64, 4.03 A)
 &rst
  ixpk= 958, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 136, 141,
 igr2= 244, 245,
 &end
#
#   17 LYS  HA           17 LYS  HB+         4.50    (#    959:20  Unique         2.41, 2.81 A)
 &rst
  ixpk= 959, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 244, 245,
 &end
#
#   17 LYS  HG+          17 LYS  HB-         3.50    (#    961:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 961, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 247, 248,
 igr2= 244, 245,
 &end
#
#   17 LYS  HG-          17 LYS  HB-         4.50    (#    962:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 962, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 247, 248,
 igr2= 244, 245,
 &end
#
#   17 LYS  HN           17 LYS  HG+         6.00    (#    963:20  Unique         3.18, 4.16 A)
 &rst
  ixpk= 963, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 247, 248,
 &end
#
#   17 LYS  HN           17 LYS  HG-         6.00    (#    964:20  Unique         3.18, 4.16 A)
 &rst
  ixpk= 964, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 247, 248,
 &end
#
#    0 AMB  20-2:965      0 AMB  20-1:965    6.00    (#    965:20  Double Ambig)
 &rst
  ixpk= 965, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 262, 464,
 igr2= 247, 248, 449, 450,
 &end
#
#   17 LYS  HA           17 LYS  HG+         6.00    (#    966:20  Unique         2.35, 3.15 A)
 &rst
  ixpk= 966, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 247, 248,
 &end
#
#   17 LYS  HA           17 LYS  HG-         4.50    (#    967:20  Unique         2.35, 3.15 A)
 &rst
  ixpk= 967, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 247, 248,
 &end
#
#    0 AMB  20-2:970     17 LYS  HG-         4.50    (#    970:20  Single Ambig)
 &rst
  ixpk= 970, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 253, 254, 253, 254,
 igr2= 247, 248,
 &end
#
#   11 ASP  HB+          17 LYS  HG+         8.00    (#    971:20  Unique         5.97, 7.39 A)
 &rst
  ixpk= 971, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 167, 168,
 igr2= 247, 248,
 &end
#
#    0 AMB  20-2:972      0 AMB  20-1:972    3.50    (#    972:20  Double Ambig)
 &rst
  ixpk= 972, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 250, 251, 468, 469,
 igr2= 247, 248, 449, 450,
 &end
#
#   17 LYS  HD+          17 LYS  HG-         6.00    (#    973:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 250, 251,
 igr2= 247, 248,
 &end
#
#   17 LYS  HB+          17 LYS  HG-         3.50    (#    974:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 974, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 244, 245,
 igr2= 247, 248,
 &end
#
#   17 LYS  HA           17 LYS  HD-         8.00    (#    975:20  Unique         2.19, 3.62 A)
 &rst
  ixpk= 975, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 250, 251,
 &end
#
#   17 LYS  HG+          17 LYS  HD+         4.50    (#    977:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 977, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 247, 248,
 igr2= 250, 251,
 &end
#
#   17 LYS  HG+          17 LYS  HD-         4.50    (#    978:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 978, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 247, 248,
 igr2= 250, 251,
 &end
#
#   17 LYS  HG-          17 LYS  HD+         4.50    (#    979:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 979, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 247, 248,
 igr2= 250, 251,
 &end
#
#   17 LYS  HG-          17 LYS  HD-         6.00    (#    980:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 247, 248,
 igr2= 250, 251,
 &end
#
#   17 LYS  HB+          17 LYS  HD+         6.00    (#    981:20  Unique         2.39, 3.16 A)
 &rst
  ixpk= 981, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 244, 245,
 igr2= 250, 251,
 &end
#
#    0 AMB  20-2:983      0 AMB  20-1:983    4.50    (#    983:20  Double Ambig)
 &rst
  ixpk= 983, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 247, 248, 247, 248,
 igr2= 253, 254, 253, 254,
 &end
#
#   17 LYS  HA            0 AMB  20-1:984    6.00    (#    984:20  Single Ambig)
 &rst
  ixpk= 984, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 253, 254, 253, 254,
 &end
#
#   18 THR  HN           18 THR  HA          6.00    (#    987:20  Unique         2.97, 2.98 A)
 &rst
  ixpk= 987, nxpk= 20, iat= 262, 264, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    9 TYR  HN           18 THR  HA          6.00    (#    988:20  Unique         3.49, 3.64 A)
 &rst
  ixpk= 988, nxpk= 20, iat= 126, 264, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    8 SER  HA           18 THR  HA          2.80    (#    989:20  Unique         2.01, 2.08 A)
 &rst
  ixpk= 989, nxpk= 20, iat= 117, 264, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   18 THR  HB           18 THR  HA          3.50    (#    990:20  Unique         2.45, 2.51 A)
 &rst
  ixpk= 990, nxpk= 20, iat= 266, 264, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 THR  MG2          18 THR  HA          3.50    (#    992:20  Unique         2.44, 3.07 A)
 &rst
  ixpk= 992, nxpk= 20, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 268, 269, 270,
 &end
#
#   18 THR  HN           18 THR  HB          6.00    (#    993:20  Unique         3.61, 3.76 A)
 &rst
  ixpk= 993, nxpk= 20, iat= 262, 266, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    8 SER  HA           18 THR  HB          6.00    (#    994:20  Unique         3.87, 4.15 A)
 &rst
  ixpk= 994, nxpk= 20, iat= 117, 266, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   18 THR  HA           18 THR  HB          3.50    (#    995:20  Unique         2.45, 2.51 A)
 &rst
  ixpk= 995, nxpk= 20, iat= 264, 266, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 ILE  MD1          18 THR  HB          6.00    (#   1001:20  Unique         3.76, 5.00 A)
 &rst
  ixpk= 1001, nxpk= 20, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 704, 705, 706,
 &end
#
#   19 TRP  HB+          19 TRP  HA          4.50    (#   1003:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 1003, nxpk= 20, iat=  -1, 278, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 280, 281,
 &end
#
#   19 TRP  HB-          19 TRP  HA          4.50    (#   1004:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 1004, nxpk= 20, iat=  -1, 278, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 280, 281,
 &end
#
#   19 TRP  HD1          19 TRP  HA          4.50    (#   1006:20  Unique         2.44, 2.61 A)
 &rst
  ixpk= 1006, nxpk= 20, iat= 284, 278, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   19 TRP  HN           19 TRP  HA          6.00    (#   1008:20  Unique         2.95, 2.97 A)
 &rst
  ixpk= 1008, nxpk= 20, iat= 276, 278, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   19 TRP  HN           19 TRP  HB-         6.00    (#   1009:20  Unique         2.69, 3.05 A)
 &rst
  ixpk= 1009, nxpk= 20, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 280, 281,
 &end
#
#   19 TRP  HN           19 TRP  HB+         4.50    (#   1010:20  Unique         2.69, 3.05 A)
 &rst
  ixpk= 1010, nxpk= 20, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 280, 281,
 &end
#
#    7 TYR  HN           19 TRP  HB+         8.00    (#   1011:20  Unique         4.16, 4.96 A)
 &rst
  ixpk= 1011, nxpk= 20, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 280, 281,
 &end
#
#    7 TYR  HN           19 TRP  HB-         8.00    (#   1012:20  Unique         4.16, 4.96 A)
 &rst
  ixpk= 1012, nxpk= 20, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 280, 281,
 &end
#
#   19 TRP  HD1          19 TRP  HB-         6.00    (#   1013:20  Unique         2.99, 3.47 A)
 &rst
  ixpk= 1013, nxpk= 20, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 280, 281,
 &end
#
#   19 TRP  HD1          19 TRP  HB+         8.00    (#   1014:20  Unique         2.99, 3.47 A)
 &rst
  ixpk= 1014, nxpk= 20, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 280, 281,
 &end
#
#    7 TYR  HD           19 TRP  HB-         6.00    (#   1015:20  Unique         2.84, 5.50 A)
 &rst
  ixpk= 1015, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 102, 111,
 igr2= 280, 281,
 &end
#
#    7 TYR  HD           19 TRP  HB+         6.00    (#   1016:20  Unique         2.84, 5.50 A)
 &rst
  ixpk= 1016, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 102, 111,
 igr2= 280, 281,
 &end
#
#    9 TYR  HD           19 TRP  HB+         6.00    (#   1017:20  Unique         3.12, 6.09 A)
 &rst
  ixpk= 1017, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 134, 143,
 igr2= 280, 281,
 &end
#
#    9 TYR  HD           19 TRP  HB-         6.00    (#   1018:20  Unique         3.12, 6.09 A)
 &rst
  ixpk= 1018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 134, 143,
 igr2= 280, 281,
 &end
#
#    9 TYR  HE           19 TRP  HB+         4.50    (#   1019:20  Unique         2.50, 6.01 A)
 &rst
  ixpk= 1019, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 136, 141,
 igr2= 280, 281,
 &end
#
#   19 TRP  HA           19 TRP  HB+         4.50    (#   1020:20  Unique         2.40, 2.74 A)
 &rst
  ixpk= 1020, nxpk= 20, iat= 278,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 280, 281,
 &end
#
#    7 TYR  HB+          19 TRP  HB-         4.50    (#   1021:20  Unique         2.21, 3.72 A)
 &rst
  ixpk= 1021, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  98,  99,
 igr2= 280, 281,
 &end
#
#    7 TYR  HB+          19 TRP  HB+         4.50    (#   1022:20  Unique         2.21, 3.72 A)
 &rst
  ixpk= 1022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  98,  99,
 igr2= 280, 281,
 &end
#
#   26 PRO  HG+          19 TRP  HB-         6.00    (#   1023:20  Unique         2.60, 3.59 A)
 &rst
  ixpk= 1023, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 387, 388,
 igr2= 280, 281,
 &end
#
#   26 PRO  HG+          19 TRP  HB+         8.00    (#   1024:20  Unique         2.60, 3.59 A)
 &rst
  ixpk= 1024, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 387, 388,
 igr2= 280, 281,
 &end
#
#   26 PRO  HG-          19 TRP  HB-         6.00    (#   1025:20  Unique         2.60, 3.59 A)
 &rst
  ixpk= 1025, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 387, 388,
 igr2= 280, 281,
 &end
#
#   26 PRO  HG-          19 TRP  HB+         6.00    (#   1026:20  Unique         2.60, 3.59 A)
 &rst
  ixpk= 1026, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 387, 388,
 igr2= 280, 281,
 &end
#
#   29 ILE  MD1          19 TRP  HB-         8.00    (#   1027:20  Unique         3.68, 5.21 A)
 &rst
  ixpk= 1027, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 436, 437, 438,
 igr2= 280, 281,
 &end
#
#   29 ILE  MD1          19 TRP  HB+         8.00    (#   1028:20  Unique         3.68, 5.21 A)
 &rst
  ixpk= 1028, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 436, 437, 438,
 igr2= 280, 281,
 &end
#
#   19 TRP  HE1          19 TRP  HD1         6.00    (#   1029:20  Unique         2.56, 2.57 A)
 &rst
  ixpk= 1029, nxpk= 20, iat= 286, 284, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   19 TRP  HA           19 TRP  HD1         8.00    (#   1030:20  Unique         2.44, 2.61 A)
 &rst
  ixpk= 1030, nxpk= 20, iat= 278, 284, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    7 TYR  HD           19 TRP  HE3         6.00    (#   1031:20  Unique         2.72, 3.95 A)
 &rst
  ixpk= 1031, nxpk= 20, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 102, 111,
 &end
#
#   19 TRP  HZ3          19 TRP  HE3         4.50    (#   1032:20  Unique         2.47, 2.48 A)
 &rst
  ixpk= 1032, nxpk= 20, iat= 293, 295, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1033    19 TRP  HE3         6.00    (#   1033:20  Single Ambig)
 &rst
  ixpk= 1033, nxpk= 20, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 280, 281,  98,  99,
 &end
#
#    7 TYR  HB+          19 TRP  HE3         6.00    (#   1034:20  Unique         2.49, 2.85 A)
 &rst
  ixpk= 1034, nxpk= 20, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  98,  99,
 &end
#
#    0 AMB  20-2:1036    19 TRP  HE3         6.00    (#   1036:20  Single Ambig)
 &rst
  ixpk= 1036, nxpk= 20, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 615, 616, 617, 619, 620, 621, 375, 376, 377,
 &end
#
#   29 ILE  MD1          19 TRP  HE3         6.00    (#   1037:20  Unique         2.59, 3.65 A)
 &rst
  ixpk= 1037, nxpk= 20, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 436, 437, 438,
 &end
#
#   20 THR  MG2           0 AMB  20-1:1040   3.50    (#   1040:20  Single Ambig)
 &rst
  ixpk= 1040, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 306, 307, 308,
 igr2= 302,  58,
 &end
#
#    6 LYS  HB+          20 THR  HA          6.00    (#   1041:20  Unique         2.51, 4.06 A)
 &rst
  ixpk= 1041, nxpk= 20, iat=  -1, 302, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  76,  77,
 &end
#
#    5 ALA  HA           20 THR  HA          4.50    (#   1043:20  Unique         2.19, 2.57 A)
 &rst
  ixpk= 1043, nxpk= 20, iat=  64, 302, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    6 LYS  HN           20 THR  HA          4.50    (#   1044:20  Unique         2.42, 2.60 A)
 &rst
  ixpk= 1044, nxpk= 20, iat=  72, 302, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1053    20 THR  HB          6.00    (#   1053:20  Single Ambig)
 &rst
  ixpk= 1053, nxpk= 20, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 328, 329, 328, 329,
 &end
#
#   22 GLN  HB-          20 THR  HB          8.00    (#   1054:20  Unique         3.20, 4.61 A)
 &rst
  ixpk= 1054, nxpk= 20, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 325, 326,
 &end
#
#    5 ALA  HA           20 THR  HB          6.00    (#   1055:20  Unique         4.00, 4.38 A)
 &rst
  ixpk= 1055, nxpk= 20, iat=  64, 304, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   22 GLN  HN           20 THR  HB          6.00    (#   1060:20  Unique         3.29, 3.55 A)
 &rst
  ixpk= 1060, nxpk= 20, iat= 321, 304, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    7 TYR  HD           21 GLY  HA-         6.00    (#   1063:20  Unique         3.20, 5.09 A)
 &rst
  ixpk= 1063, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 102, 111,
 igr2= 316, 317,
 &end
#
#   22 GLN  HN           21 GLY  HA-         6.00    (#   1065:20  Unique         3.09, 3.34 A)
 &rst
  ixpk= 1065, nxpk= 20, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 316, 317,
 &end
#
#   22 GLN  HN           22 GLN  HA          6.00    (#   1068:20  Unique         2.89, 2.96 A)
 &rst
  ixpk= 1068, nxpk= 20, iat= 321, 323, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   23 GLY  HA+          22 GLN  HA          6.00    (#   1070:20  Unique         4.49, 4.57 A)
 &rst
  ixpk= 1070, nxpk= 20, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 340, 341,
 &end
#
#   22 GLN  HN           22 GLN  HB-         6.00    (#   1071:20  Unique         2.38, 3.11 A)
 &rst
  ixpk= 1071, nxpk= 20, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 325, 326,
 &end
#
#    0 AMB  20-2:1073     0 AMB  20-1:1073   3.50    (#   1073:20  Double Ambig)
 &rst
  ixpk= 1073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 325, 326, 325, 326,
 igr2= 328, 329, 328, 329,
 &end
#
#   22 GLN  HA            0 AMB  20-1:1074   3.50    (#   1074:20  Single Ambig)
 &rst
  ixpk= 1074, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 328, 329, 328, 329,
 &end
#
#   37 GLY  HN            0 AMB  20-1:1075   8.00    (#   1075:20  Single Ambig)
 &rst
  ixpk= 1075, nxpk= 20, iat= 560,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr2= 500, 501, 500, 501,
 &end
#
#    0 AMB  20-2:1076     0 AMB  20-1:1076   6.00    (#   1076:20  Double Ambig)
 &rst
  ixpk= 1076, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 333, 334, 333, 334,
 igr2= 328, 329, 328, 329,
 &end
#
#   23 GLY  HN           23 GLY  HA-         6.00    (#   1078:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1078, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 340, 341,
 &end
#
#    0 AMB  20-2:1081    23 GLY  HA-         8.00    (#   1081:20  Single Ambig)
 &rst
  ixpk= 1081, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 355, 356, 355, 356,
 igr2= 340, 341,
 &end
#
#    0 AMB  20-2:1082     0 AMB  20-1:1082   6.00    (#   1082:20  Double Ambig)
 &rst
  ixpk= 1082, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 355, 356, 355, 356,
 igr2= 340, 341, 340, 341,
 &end
#
#    0 AMB  20-2:1083    23 GLY  HA-         6.00    (#   1083:20  Single Ambig)
 &rst
  ixpk= 1083, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 352, 353, 349, 350, 349, 350,
 igr2= 340, 341,
 &end
#
#    0 AMB  20-2:1084     0 AMB  20-1:1084   6.00    (#   1084:20  Double Ambig)
 &rst
  ixpk= 1084, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1= 352, 353, 349, 350, 349, 350,
 igr2= 340, 341, 340, 341, 340, 341,
 &end
#
#   49 GLU  HA            0 AMB  20-1:1090   6.00    (#   1090:20  Single Ambig)
 &rst
  ixpk= 1090, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 773, 774, 773, 774,
 &end
#
#   48 LEU  MDX          47 GLU  HG+         6.00    (#   1091:20  Double Ambig)
 &rst
  ixpk= 1091, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 739, 740,
 &end
#
#   25 THR  HN           25 THR  HA          4.50    (#   1092:20  Unique         2.74, 2.80 A)
 &rst
  ixpk= 1092, nxpk= 20, iat= 369, 371, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 THR  HB           25 THR  HA          3.50    (#   1094:20  Unique         3.03, 3.04 A)
 &rst
  ixpk= 1094, nxpk= 20, iat= 373, 371, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 PRO  HG+          25 THR  HA          6.00    (#   1095:20  Unique         4.34, 4.47 A)
 &rst
  ixpk= 1095, nxpk= 20, iat=  -1, 371, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 387, 388,
 &end
#
#   26 PRO  HG-          25 THR  HA          8.00    (#   1096:20  Unique         4.34, 4.47 A)
 &rst
  ixpk= 1096, nxpk= 20, iat=  -1, 371, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 387, 388,
 &end
#
#   29 ILE  MD1          25 THR  HA          8.00    (#   1097:20  Unique         4.53, 6.35 A)
 &rst
  ixpk= 1097, nxpk= 20, iat=  -1, 371, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 436, 437, 438,
 &end
#
#    0 AMB  20-2:1098    25 THR  HB          6.00    (#   1098:20  Single Ambig)
 &rst
  ixpk= 1098, nxpk= 20, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 452, 453, 452, 453, 384, 385,
 &end
#
#   25 THR  HA           25 THR  HB          3.50    (#   1099:20  Unique         3.03, 3.04 A)
 &rst
  ixpk= 1099, nxpk= 20, iat= 371, 373, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 LYS  HA           25 THR  HB          6.00    (#   1101:20  Unique         3.79, 4.25 A)
 &rst
  ixpk= 1101, nxpk= 20, iat= 444, 373, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   26 PRO  HB+          26 PRO  HA          6.00    (#   1104:20  Unique         2.29, 2.68 A)
 &rst
  ixpk= 1104, nxpk= 20, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 390, 391,
 &end
#
#   26 PRO  HG-          26 PRO  HA          6.00    (#   1105:20  Unique         2.81, 3.44 A)
 &rst
  ixpk= 1105, nxpk= 20, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 387, 388,
 &end
#
#   26 PRO  HG+          26 PRO  HA          4.50    (#   1106:20  Unique         2.81, 3.44 A)
 &rst
  ixpk= 1106, nxpk= 20, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 387, 388,
 &end
#
#   27 ALA  MB           26 PRO  HA          6.00    (#   1107:20  Unique         4.43, 5.01 A)
 &rst
  ixpk= 1107, nxpk= 20, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 401, 402, 403,
 &end
#
#   26 PRO  HD+          26 PRO  HA          8.00    (#   1110:20  Unique         3.46, 3.72 A)
 &rst
  ixpk= 1110, nxpk= 20, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 384, 385,
 &end
#
#   26 PRO  HA           26 PRO  HB+         6.00    (#   1112:20  Unique         2.29, 2.68 A)
 &rst
  ixpk= 1112, nxpk= 20, iat= 393,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 390, 391,
 &end
#
#    9 TYR  HE           26 PRO  HB-         6.00    (#   1113:20  Unique         2.42, 4.10 A)
 &rst
  ixpk= 1113, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 136, 141,
 igr2= 390, 391,
 &end
#
#   29 ILE  HN           26 PRO  HB-         8.00    (#   1114:20  Unique         2.52, 3.53 A)
 &rst
  ixpk= 1114, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 390, 391,
 &end
#
#   26 PRO  HG+          26 PRO  HB+         4.50    (#   1118:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 1118, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 387, 388,
 igr2= 390, 391,
 &end
#
#   26 PRO  HG+          26 PRO  HB-         4.50    (#   1119:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 1119, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 387, 388,
 igr2= 390, 391,
 &end
#
#    0 AMB  20-2:1120     0 AMB  20-1:1120   4.50    (#   1120:20  Double Ambig)
 &rst
  ixpk= 1120, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 387, 388, 427,
 igr2= 390, 391, 390, 391,
 &end
#
#   29 ILE  MD1          26 PRO  HB+         6.00    (#   1122:20  Unique         2.78, 4.85 A)
 &rst
  ixpk= 1122, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 436, 437, 438,
 igr2= 390, 391,
 &end
#
#   29 ILE  MD1          26 PRO  HG+         8.00    (#   1123:20  Unique         2.36, 4.69 A)
 &rst
  ixpk= 1123, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 436, 437, 438,
 igr2= 387, 388,
 &end
#
#   29 ILE  MD1          26 PRO  HG-         6.00    (#   1124:20  Unique         2.36, 4.69 A)
 &rst
  ixpk= 1124, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 436, 437, 438,
 igr2= 387, 388,
 &end
#
#   26 PRO  HB+          26 PRO  HG+         4.50    (#   1125:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 1125, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 390, 391,
 igr2= 387, 388,
 &end
#
#   26 PRO  HB+          26 PRO  HG-         4.50    (#   1126:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 1126, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 390, 391,
 igr2= 387, 388,
 &end
#
#   26 PRO  HD-          26 PRO  HG+         4.50    (#   1127:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1127, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 384, 385,
 igr2= 387, 388,
 &end
#
#   26 PRO  HD+          26 PRO  HG+         4.50    (#   1128:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1128, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 384, 385,
 igr2= 387, 388,
 &end
#
#   26 PRO  HB-          26 PRO  HG+         4.50    (#   1129:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 1129, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 390, 391,
 igr2= 387, 388,
 &end
#
#   26 PRO  HD+          26 PRO  HG-         6.00    (#   1130:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1130, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 384, 385,
 igr2= 387, 388,
 &end
#
#   26 PRO  HB-          26 PRO  HG-         4.50    (#   1131:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 1131, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 390, 391,
 igr2= 387, 388,
 &end
#
#   19 TRP  HB+          26 PRO  HG+         6.00    (#   1132:20  Unique         2.60, 3.59 A)
 &rst
  ixpk= 1132, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 280, 281,
 igr2= 387, 388,
 &end
#
#   19 TRP  HB-          26 PRO  HG+         6.00    (#   1133:20  Unique         2.60, 3.59 A)
 &rst
  ixpk= 1133, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 280, 281,
 igr2= 387, 388,
 &end
#
#   19 TRP  HB+          26 PRO  HG-         6.00    (#   1134:20  Unique         2.60, 3.59 A)
 &rst
  ixpk= 1134, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 280, 281,
 igr2= 387, 388,
 &end
#
#   19 TRP  HB-          26 PRO  HG-         6.00    (#   1135:20  Unique         2.60, 3.59 A)
 &rst
  ixpk= 1135, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 280, 281,
 igr2= 387, 388,
 &end
#
#   26 PRO  HA           26 PRO  HG+         6.00    (#   1136:20  Unique         2.81, 3.44 A)
 &rst
  ixpk= 1136, nxpk= 20, iat= 393,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 387, 388,
 &end
#
#   26 PRO  HA           26 PRO  HG-         6.00    (#   1137:20  Unique         2.81, 3.44 A)
 &rst
  ixpk= 1137, nxpk= 20, iat= 393,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 387, 388,
 &end
#
#    9 TYR  HE           26 PRO  HG-         6.00    (#   1138:20  Unique         2.59, 4.85 A)
 &rst
  ixpk= 1138, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 136, 141,
 igr2= 387, 388,
 &end
#
#   25 THR  HA           26 PRO  HD+         4.50    (#   1139:20  Unique         2.12, 2.35 A)
 &rst
  ixpk= 1139, nxpk= 20, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 384, 385,
 &end
#
#   25 THR  HA           26 PRO  HD-         4.50    (#   1140:20  Unique         2.12, 2.35 A)
 &rst
  ixpk= 1140, nxpk= 20, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 384, 385,
 &end
#
#   26 PRO  HG+          26 PRO  HD+         6.00    (#   1141:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1141, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 387, 388,
 igr2= 384, 385,
 &end
#
#   26 PRO  HG+          26 PRO  HD-         4.50    (#   1142:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1142, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 387, 388,
 igr2= 384, 385,
 &end
#
#   26 PRO  HG-          26 PRO  HD+         6.00    (#   1143:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1143, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 387, 388,
 igr2= 384, 385,
 &end
#
#    0 AMB  20-2:1144    26 PRO  HD-         6.00    (#   1144:20  Single Ambig)
 &rst
  ixpk= 1144, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 387, 388, 427,
 igr2= 384, 385,
 &end
#
#   25 THR  MG2          26 PRO  HD-         6.00    (#   1145:20  Unique         2.37, 3.81 A)
 &rst
  ixpk= 1145, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 375, 376, 377,
 igr2= 384, 385,
 &end
#
#   25 THR  MG2          26 PRO  HD+         6.00    (#   1146:20  Unique         2.37, 3.81 A)
 &rst
  ixpk= 1146, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 375, 376, 377,
 igr2= 384, 385,
 &end
#
#   26 PRO  HB+          26 PRO  HD-         8.00    (#   1147:20  Unique         2.85, 3.69 A)
 &rst
  ixpk= 1147, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 390, 391,
 igr2= 384, 385,
 &end
#
#   29 ILE  MD1          26 PRO  HD-         6.00    (#   1148:20  Unique         2.27, 4.79 A)
 &rst
  ixpk= 1148, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 436, 437, 438,
 igr2= 384, 385,
 &end
#
#   27 ALA  HN           27 ALA  HA          6.00    (#   1149:20  Unique         2.71, 2.76 A)
 &rst
  ixpk= 1149, nxpk= 20, iat= 397, 399, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   28 VAL  HN           27 ALA  HA          6.00    (#   1150:20  Unique         3.59, 3.61 A)
 &rst
  ixpk= 1150, nxpk= 20, iat= 407, 399, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   31 LYS  HN           27 ALA  HA          6.00    (#   1151:20  Unique         3.81, 3.92 A)
 &rst
  ixpk= 1151, nxpk= 20, iat= 464, 399, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   30 LYS  HN           27 ALA  HA          6.00    (#   1152:20  Unique         3.50, 3.64 A)
 &rst
  ixpk= 1152, nxpk= 20, iat= 442, 399, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:1154    27 ALA  HA          6.00    (#   1154:20  Single Ambig)
 &rst
  ixpk= 1154, nxpk= 20, iat=  -1, 399, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 452, 453, 452, 453,
 &end
#
#    0 AMB  20-2:1178    28 VAL  HA          6.00    (#   1178:20  Single Ambig)
 &rst
  ixpk= 1178, nxpk= 20, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 8.30, r4= 8.80,
 igr1= 471, 472, 471, 472, 401, 402, 403,
 &end
#
#   29 ILE  HN           28 VAL  HA          6.00    (#   1180:20  Unique         3.54, 3.57 A)
 &rst
  ixpk= 1180, nxpk= 20, iat= 423, 409, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   32 ALA  HN           28 VAL  HA          6.00    (#   1181:20  Unique         3.69, 3.88 A)
 &rst
  ixpk= 1181, nxpk= 20, iat= 486, 409, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   30 LYS  HN           28 VAL  HA          8.00    (#   1182:20  Unique         4.58, 4.64 A)
 &rst
  ixpk= 1182, nxpk= 20, iat= 442, 409, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   31 LYS  HN           28 VAL  HA          6.00    (#   1183:20  Unique         3.26, 3.44 A)
 &rst
  ixpk= 1183, nxpk= 20, iat= 464, 409, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    9 TYR  HE           28 VAL  HB          6.00    (#   1185:20  Unique         3.29, 5.04 A)
 &rst
  ixpk= 1185, nxpk= 20, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 136, 141,
 &end
#
#   29 ILE  HN           28 VAL  HB          6.00    (#   1186:20  Unique         2.65, 3.15 A)
 &rst
  ixpk= 1186, nxpk= 20, iat= 423, 411, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   28 VAL  MGY          28 VAL  HB          3.50    (#   1187:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 1187, nxpk= 20, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#   43 PHE  HE           28 VAL  MGX         6.00    (#   1190:20  Unique         2.85, 7.00 A)
 &rst
  ixpk= 1190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 662, 666,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    9 TYR  HE           28 VAL  MGX         6.00    (#   1191:20  Unique         2.52, 6.04 A)
 &rst
  ixpk= 1191, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 136, 141,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    9 TYR  HD           28 VAL  MGX         4.50    (#   1192:20  Unique         2.39, 5.28 A)
 &rst
  ixpk= 1192, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 134, 143,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   29 ILE  HN           28 VAL  MGX         6.00    (#   1193:20  Unique         2.70, 4.44 A)
 &rst
  ixpk= 1193, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   32 ALA  MB           28 VAL  MGX         4.50    (#   1198:20  Unique         3.46, 6.44 A)
 &rst
  ixpk= 1198, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 490, 491, 492,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   27 ALA  MB           28 VAL  MGX         6.00    (#   1199:20  Unique         3.39, 6.55 A)
 &rst
  ixpk= 1199, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 401, 402, 403,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   29 ILE  HG1-         28 VAL  MGX         6.00    (#   1205:20  Unique         2.70, 5.73 A)
 &rst
  ixpk= 1205, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 433, 434,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   27 ALA  HN           28 VAL  MGY         6.00    (#   1209:20  Single Ambig)
 &rst
  ixpk= 1209, nxpk= 20, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   31 LYS  HN           28 VAL  MGY         6.00    (#   1210:20  Unique         5.32, 6.20 A)
 &rst
  ixpk= 1210, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   29 ILE  HN           28 VAL  MGY         6.00    (#   1212:20  Unique         2.70, 4.44 A)
 &rst
  ixpk= 1212, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#    9 TYR  HB-          28 VAL  MGY         6.00    (#   1214:20  Unique         2.40, 4.83 A)
 &rst
  ixpk= 1214, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 130, 131,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   11 ASP  HB+          28 VAL  MGY         6.00    (#   1215:20  Unique         2.41, 5.89 A)
 &rst
  ixpk= 1215, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 167, 168,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   32 ALA  MB           28 VAL  MGY         6.00    (#   1217:20  Unique         3.46, 6.44 A)
 &rst
  ixpk= 1217, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 490, 491, 492,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   28 VAL  HB           28 VAL  MGY         2.80    (#   1218:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 1218, nxpk= 20, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   29 ILE  HG1-         28 VAL  MGY         6.00    (#   1225:20  Unique         2.70, 5.73 A)
 &rst
  ixpk= 1225, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 433, 434,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   32 ALA  HN           29 ILE  HA          6.00    (#   1227:20  Unique         3.26, 3.59 A)
 &rst
  ixpk= 1227, nxpk= 20, iat= 486, 425, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   43 PHE  HE           29 ILE  HA          8.00    (#   1228:20  Unique         2.87, 3.97 A)
 &rst
  ixpk= 1228, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 662, 666,
 &end
#
#   43 PHE  HZ           29 ILE  HA          6.00    (#   1229:20  Unique         2.89, 3.44 A)
 &rst
  ixpk= 1229, nxpk= 20, iat= 664, 425, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   29 ILE  HN           29 ILE  HA          6.00    (#   1230:20  Unique         2.87, 2.90 A)
 &rst
  ixpk= 1230, nxpk= 20, iat= 423, 425, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   29 ILE  HG1-         29 ILE  HA          6.00    (#   1232:20  Unique         2.39, 2.99 A)
 &rst
  ixpk= 1232, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 433, 434,
 &end
#
#   29 ILE  HG1+         29 ILE  HA          4.50    (#   1233:20  Unique         2.39, 2.99 A)
 &rst
  ixpk= 1233, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 433, 434,
 &end
#
#   29 ILE  HB           29 ILE  HA          6.00    (#   1234:20  Unique         3.04, 3.05 A)
 &rst
  ixpk= 1234, nxpk= 20, iat= 427, 425, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   30 LYS  HN           29 ILE  HB          4.50    (#   1235:20  Unique         2.43, 2.57 A)
 &rst
  ixpk= 1235, nxpk= 20, iat= 442, 427, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 ILE  HN           29 ILE  HB          4.50    (#   1236:20  Unique         2.45, 2.49 A)
 &rst
  ixpk= 1236, nxpk= 20, iat= 423, 427, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 ILE  HA           29 ILE  HB          6.00    (#   1237:20  Unique         3.04, 3.05 A)
 &rst
  ixpk= 1237, nxpk= 20, iat= 425, 427, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   25 THR  MG2          29 ILE  HB          4.50    (#   1238:20  Unique         2.32, 2.99 A)
 &rst
  ixpk= 1238, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 375, 376, 377,
 &end
#
#   26 PRO  HB+          29 ILE  HB          6.00    (#   1239:20  Unique         2.77, 3.81 A)
 &rst
  ixpk= 1239, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 390, 391,
 &end
#
#   29 ILE  HG1-         29 ILE  HB          6.00    (#   1240:20  Unique         2.35, 2.65 A)
 &rst
  ixpk= 1240, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 433, 434,
 &end
#
#   29 ILE  MG2          29 ILE  HB          3.50    (#   1241:20  Unique         2.39, 2.67 A)
 &rst
  ixpk= 1241, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 429, 430, 431,
 &end
#
#   29 ILE  HG1+         29 ILE  HB          8.00    (#   1242:20  Unique         2.35, 2.65 A)
 &rst
  ixpk= 1242, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 433, 434,
 &end
#
#   29 ILE  MD1          29 ILE  HG1-        3.50    (#   1243:20  Unique         2.38, 2.66 A)
 &rst
  ixpk= 1243, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 436, 437, 438,
 igr2= 433, 434,
 &end
#
#   29 ILE  MD1          29 ILE  HG1+        4.50    (#   1244:20  Unique         2.38, 2.66 A)
 &rst
  ixpk= 1244, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 436, 437, 438,
 igr2= 433, 434,
 &end
#
#   26 PRO  HB+          29 ILE  HG1-        6.00    (#   1245:20  Unique         2.28, 4.06 A)
 &rst
  ixpk= 1245, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 390, 391,
 igr2= 433, 434,
 &end
#
#   29 ILE  HB           29 ILE  HG1-        6.00    (#   1246:20  Unique         2.35, 2.65 A)
 &rst
  ixpk= 1246, nxpk= 20, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 433, 434,
 &end
#
#   29 ILE  HA           29 ILE  HG1-        6.00    (#   1247:20  Unique         2.39, 2.99 A)
 &rst
  ixpk= 1247, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 433, 434,
 &end
#
#   29 ILE  HA           29 ILE  HG1+        6.00    (#   1248:20  Unique         2.39, 2.99 A)
 &rst
  ixpk= 1248, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 433, 434,
 &end
#
#   29 ILE  HN           29 ILE  HG1-        6.00    (#   1249:20  Unique         2.17, 2.86 A)
 &rst
  ixpk= 1249, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 433, 434,
 &end
#
#    9 TYR  HD           29 ILE  HG1-        8.00    (#   1250:20  Unique         2.55, 4.65 A)
 &rst
  ixpk= 1250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 134, 143,
 igr2= 433, 434,
 &end
#
#   29 ILE  HG1+         29 ILE  MD1         3.50    (#   1251:20  Unique         2.38, 2.66 A)
 &rst
  ixpk= 1251, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 433, 434,
 igr2= 436, 437, 438,
 &end
#
#   29 ILE  HG1-         29 ILE  MD1         2.80    (#   1253:20  Unique         2.38, 2.66 A)
 &rst
  ixpk= 1253, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 433, 434,
 igr2= 436, 437, 438,
 &end
#
#   26 PRO  HB+          29 ILE  MD1         6.00    (#   1254:20  Unique         2.78, 4.85 A)
 &rst
  ixpk= 1254, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 390, 391,
 igr2= 436, 437, 438,
 &end
#
#    0 AMB  20-2:1255    29 ILE  MD1         4.50    (#   1255:20  Single Ambig)
 &rst
  ixpk= 1255, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1= 615, 616, 617, 619, 620, 621, 375, 376, 377,
 igr2= 436, 437, 438,
 &end
#
#    0 AMB  20-2:1256    29 ILE  MD1         3.50    (#   1256:20  Single Ambig)
 &rst
  ixpk= 1256, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 387, 388, 427,
 igr2= 436, 437, 438,
 &end
#
#   26 PRO  HG+          29 ILE  MD1         6.00    (#   1257:20  Unique         2.36, 4.69 A)
 &rst
  ixpk= 1257, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 387, 388,
 igr2= 436, 437, 438,
 &end
#
#   26 PRO  HD-          29 ILE  MD1         6.00    (#   1258:20  Unique         2.27, 4.79 A)
 &rst
  ixpk= 1258, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 384, 385,
 igr2= 436, 437, 438,
 &end
#
#   28 VAL  MGX          29 ILE  MD1         6.00    (#   1259:20  Unique         3.06, 7.21 A)
 &rst
  ixpk= 1259, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 436, 437, 438,
 &end
#
#   26 PRO  HB-          29 ILE  MD1         6.00    (#   1260:20  Unique         2.78, 4.85 A)
 &rst
  ixpk= 1260, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 390, 391,
 igr2= 436, 437, 438,
 &end
#
#   19 TRP  HB-          29 ILE  MD1         6.00    (#   1261:20  Unique         3.68, 5.21 A)
 &rst
  ixpk= 1261, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 280, 281,
 igr2= 436, 437, 438,
 &end
#
#   43 PHE  HB-          29 ILE  MD1         6.00    (#   1262:20  Unique         2.51, 3.68 A)
 &rst
  ixpk= 1262, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 656, 657,
 igr2= 436, 437, 438,
 &end
#
#    7 TYR  HD           29 ILE  MD1         6.00    (#   1263:20  Unique         3.24, 5.86 A)
 &rst
  ixpk= 1263, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 102, 111,
 igr2= 436, 437, 438,
 &end
#
#   29 ILE  HN           29 ILE  MD1         6.00    (#   1264:20  Unique         3.64, 4.49 A)
 &rst
  ixpk= 1264, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 436, 437, 438,
 &end
#
#   43 PHE  HD           29 ILE  MD1         6.00    (#   1265:20  Unique         3.06, 4.51 A)
 &rst
  ixpk= 1265, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 660, 668,
 igr2= 436, 437, 438,
 &end
#
#    0 AMB  20-2:1266    29 ILE  MG2         6.00    (#   1266:20  Single Ambig)
 &rst
  ixpk= 1266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 496, 407,
 igr2= 429, 430, 431,
 &end
#
#   43 PHE  HZ           29 ILE  MG2         6.00    (#   1267:20  Unique         3.66, 5.48 A)
 &rst
  ixpk= 1267, nxpk= 20, iat= 664,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 429, 430, 431,
 &end
#
#   19 TRP  HZ3          29 ILE  MG2         6.00    (#   1268:20  Unique         2.41, 3.91 A)
 &rst
  ixpk= 1268, nxpk= 20, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 429, 430, 431,
 &end
#
#   29 ILE  HN           29 ILE  MG2         6.00    (#   1269:20  Unique         4.43, 4.59 A)
 &rst
  ixpk= 1269, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 429, 430, 431,
 &end
#
#   40 LEU  HA           29 ILE  MG2         6.00    (#   1270:20  Unique         3.25, 4.22 A)
 &rst
  ixpk= 1270, nxpk= 20, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 429, 430, 431,
 &end
#
#   30 LYS  HA           29 ILE  MG2         6.00    (#   1271:20  Unique         3.67, 4.83 A)
 &rst
  ixpk= 1271, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 429, 430, 431,
 &end
#
#   33 MET  HG+          29 ILE  MG2         6.00    (#   1272:20  Unique         3.08, 4.57 A)
 &rst
  ixpk= 1272, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 503, 504,
 igr2= 429, 430, 431,
 &end
#
#    0 AMB  20-2:1273    29 ILE  MG2         4.50    (#   1273:20  Single Ambig)
 &rst
  ixpk= 1273, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 613, 490, 491, 492, 610, 611,
 igr2= 429, 430, 431,
 &end
#
#   30 LYS  HB+          29 ILE  MG2         8.00    (#   1275:20  Unique         4.67, 6.08 A)
 &rst
  ixpk= 1275, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 446, 447,
 igr2= 429, 430, 431,
 &end
#
#   26 PRO  HD-          29 ILE  MG2         8.00    (#   1276:20  Unique         3.26, 5.13 A)
 &rst
  ixpk= 1276, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 384, 385,
 igr2= 429, 430, 431,
 &end
#
#   29 ILE  HG1-         29 ILE  MG2         4.50    (#   1278:20  Unique         2.43, 3.58 A)
 &rst
  ixpk= 1278, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 433, 434,
 igr2= 429, 430, 431,
 &end
#
#   29 ILE  HG1+         29 ILE  MG2         4.50    (#   1279:20  Unique         2.43, 3.58 A)
 &rst
  ixpk= 1279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 433, 434,
 igr2= 429, 430, 431,
 &end
#
#   25 THR  MG2          30 LYS  HA          6.00    (#   1281:20  Unique         2.87, 3.86 A)
 &rst
  ixpk= 1281, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 375, 376, 377,
 &end
#
#    0 AMB  20-2:1282    30 LYS  HA          8.00    (#   1282:20  Single Ambig)
 &rst
  ixpk= 1282, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 452, 453, 452, 453,
 &end
#
#   33 MET  ME           30 LYS  HA          6.00    (#   1283:20  Unique         2.41, 4.76 A)
 &rst
  ixpk= 1283, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 507, 508, 509,
 &end
#
#   31 LYS  HN           30 LYS  HA          6.00    (#   1287:20  Unique         3.59, 3.61 A)
 &rst
  ixpk= 1287, nxpk= 20, iat= 464, 444, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   33 MET  HN           30 LYS  HA          6.00    (#   1288:20  Unique         3.47, 3.61 A)
 &rst
  ixpk= 1288, nxpk= 20, iat= 496, 444, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   31 LYS  HN           30 LYS  HB+         6.00    (#   1289:20  Unique         2.54, 3.32 A)
 &rst
  ixpk= 1289, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 446, 447,
 &end
#
#   25 THR  MG2          30 LYS  HB-         8.00    (#   1290:20  Unique         2.80, 4.19 A)
 &rst
  ixpk= 1290, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 375, 376, 377,
 igr2= 446, 447,
 &end
#
#   30 LYS  HN           30 LYS  HG+         6.00    (#   1291:20  Unique         4.21, 4.42 A)
 &rst
  ixpk= 1291, nxpk= 20, iat= 442,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 449, 450,
 &end
#
#   30 LYS  HN           30 LYS  HG-         6.00    (#   1292:20  Unique         4.21, 4.42 A)
 &rst
  ixpk= 1292, nxpk= 20, iat= 442,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 449, 450,
 &end
#
#   31 LYS  HA           30 LYS  HG+         6.00    (#   1294:20  Unique         3.20, 3.94 A)
 &rst
  ixpk= 1294, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 449, 450,
 &end
#
#   25 THR  HB           30 LYS  HG-         8.00    (#   1295:20  Unique         4.19, 5.34 A)
 &rst
  ixpk= 1295, nxpk= 20, iat= 373,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 449, 450,
 &end
#
#    0 AMB  20-2:1296     0 AMB  20-1:1296   8.00    (#   1296:20  Double Ambig)
 &rst
  ixpk= 1296, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.70, r4=13.20,
 igr1= 280, 281, 167, 168,
 igr2= 247, 248, 247, 248,
 &end
#
#    0 AMB  20-2:1298     0 AMB  20-1:1298   6.00    (#   1298:20  Double Ambig)
 &rst
  ixpk= 1298, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.10, r4=11.60,
 igr1= 302,  74, 304, 712,
 igr2=  82,  83,  82,  83,  82,  83,  82,  83,  82,  83,
      
 &end
#
#   35 GLU  HN           31 LYS  HA          6.00    (#   1300:20  Unique         3.18, 3.58 A)
 &rst
  ixpk= 1300, nxpk= 20, iat= 528, 466, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:1301    31 LYS  HA          6.00    (#   1301:20  Single Ambig)
 &rst
  ixpk= 1301, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 486, 543,
 &end
#
#   35 GLU  HG+          31 LYS  HA          6.00    (#   1302:20  Unique         2.69, 4.48 A)
 &rst
  ixpk= 1302, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 535, 536,
 &end
#
#    0 AMB  20-2:1306     0 AMB  20-1:1306   2.80    (#   1306:20  Double Ambig)
 &rst
  ixpk= 1306, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 250, 251, 474, 475, 474, 475,
 igr2= 247, 248, 449, 450, 449, 450,
 &end
#
#   28 VAL  HA            0 AMB  20-1:1307   6.00    (#   1307:20  Single Ambig)
 &rst
  ixpk= 1307, nxpk= 20, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 474, 475, 474, 475,
 &end
#
#   35 GLU  HN           32 ALA  HA          6.00    (#   1308:20  Unique         3.44, 3.77 A)
 &rst
  ixpk= 1308, nxpk= 20, iat= 528, 488, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   43 PHE  HD           32 ALA  MB          6.00    (#   1310:20  Unique         4.79, 6.21 A)
 &rst
  ixpk= 1310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 660, 668,
 igr2= 490, 491, 492,
 &end
#
#   38 LYS  HN           32 ALA  MB          6.00    (#   1311:20  Unique         3.89, 5.16 A)
 &rst
  ixpk= 1311, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 490, 491, 492,
 &end
#
#    0 AMB  20-2:1313    32 ALA  MB          6.00    (#   1313:20  Single Ambig)
 &rst
  ixpk= 1313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 498, 569,
 igr2= 490, 491, 492,
 &end
#
#    0 AMB  20-2:1315    32 ALA  MB          8.00    (#   1315:20  Single Ambig)
 &rst
  ixpk= 1315, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.54, r4=12.04,
 igr1= 466, 656, 657,
 igr2= 490, 491, 492,
 &end
#
#   42 ASP  HB-          32 ALA  MB          6.00    (#   1316:20  Unique         4.87, 6.66 A)
 &rst
  ixpk= 1316, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 644, 645,
 igr2= 490, 491, 492,
 &end
#
#   33 MET  HG-          32 ALA  MB          6.00    (#   1317:20  Unique         3.44, 5.27 A)
 &rst
  ixpk= 1317, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 503, 504,
 igr2= 490, 491, 492,
 &end
#
#    0 AMB  20-2:1318    32 ALA  MB          6.00    (#   1318:20  Single Ambig)
 &rst
  ixpk= 1318, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 547, 548, 550, 551,
 igr2= 490, 491, 492,
 &end
#
#    0 AMB  20-2:1319    32 ALA  MB          4.50    (#   1319:20  Single Ambig)
 &rst
  ixpk= 1319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 547, 548, 503, 504, 550, 551,
 igr2= 490, 491, 492,
 &end
#
#    0 AMB  20-2:1320    32 ALA  MB          6.00    (#   1320:20  Single Ambig)
 &rst
  ixpk= 1320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 500, 501, 500, 501,
 igr2= 490, 491, 492,
 &end
#
#   38 LYS  HB-          32 ALA  MB          8.00    (#   1321:20  Unique         2.31, 4.19 A)
 &rst
  ixpk= 1321, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 571, 572,
 igr2= 490, 491, 492,
 &end
#
#   38 LYS  HB-          32 ALA  MB          8.00    (#   1322:20  Unique         2.31, 4.19 A)
 &rst
  ixpk= 1322, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 571, 572,
 igr2= 490, 491, 492,
 &end
#
#   28 VAL  MGY          32 ALA  MB          6.00    (#   1329:20  Unique         3.46, 6.44 A)
 &rst
  ixpk= 1329, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
 igr1= 413, 414, 415, 417, 418, 419,
 igr2= 490, 491, 492,
 &end
#
#   29 ILE  HB           32 ALA  MB          8.00    (#   1330:20  Unique         5.39, 6.51 A)
 &rst
  ixpk= 1330, nxpk= 20, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr2= 490, 491, 492,
 &end
#
#   29 ILE  MG2          32 ALA  MB          6.00    (#   1332:20  Unique         3.79, 6.02 A)
 &rst
  ixpk= 1332, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 429, 430, 431,
 igr2= 490, 491, 492,
 &end
#
#    0 AMB  20-2:1333    33 MET  HA          8.00    (#   1333:20  Single Ambig)
 &rst
  ixpk= 1333, nxpk= 20, iat=  -1, 498, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 547, 548, 596, 597, 596, 597, 535, 536, 550, 551,
       644, 645,
 &end
#
#   33 MET  HG-          33 MET  HA          4.50    (#   1334:20  Unique         2.35, 2.76 A)
 &rst
  ixpk= 1334, nxpk= 20, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 503, 504,
 &end
#
#   33 MET  HA            0 AMB  20-1:1337   3.50    (#   1337:20  Single Ambig)
 &rst
  ixpk= 1337, nxpk= 20, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 500, 501, 500, 501,
 &end
#
#    0 AMB  20-2:1339     0 AMB  20-1:1339   6.00    (#   1339:20  Double Ambig)
 &rst
  ixpk= 1339, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 515, 608,
 igr2= 500, 501, 500, 501,
 &end
#
#    0 AMB  20-2:1340     0 AMB  20-1:1340   6.00    (#   1340:20  Double Ambig)
 &rst
  ixpk= 1340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 606, 589,
 igr2= 503, 504, 503, 504,
 &end
#
#   43 PHE  HE           33 MET  HG-         6.00    (#   1342:20  Unique         2.33, 5.92 A)
 &rst
  ixpk= 1342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 662, 666,
 igr2= 503, 504,
 &end
#
#   39 GLN  HA           33 MET  HG-         6.00    (#   1344:20  Unique         2.49, 3.62 A)
 &rst
  ixpk= 1344, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 503, 504,
 &end
#
#   39 GLN  HA           33 MET  HG+         4.50    (#   1345:20  Unique         2.49, 3.62 A)
 &rst
  ixpk= 1345, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 503, 504,
 &end
#
#   30 LYS  HA           33 MET  HG-         6.00    (#   1346:20  Unique         3.68, 4.50 A)
 &rst
  ixpk= 1346, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 503, 504,
 &end
#
#   30 LYS  HA           33 MET  HG+         6.00    (#   1347:20  Unique         3.68, 4.50 A)
 &rst
  ixpk= 1347, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 503, 504,
 &end
#
#    0 AMB  20-2:1348     0 AMB  20-1:1348   2.80    (#   1348:20  Double Ambig)
 &rst
  ixpk= 1348, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 500, 501, 500, 501,
 igr2= 503, 504, 503, 504,
 &end
#
#    0 AMB  20-2:1349    33 MET  HG-         6.00    (#   1349:20  Single Ambig)
 &rst
  ixpk= 1349, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 490, 491, 492, 610, 611, 613,
 igr2= 503, 504,
 &end
#
#    0 AMB  20-2:1350     0 AMB  20-1:1350   8.00    (#   1350:20  Double Ambig)
 &rst
  ixpk= 1350, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.70, r4=13.20,
 igr1= 490, 491, 492, 613,
 igr2= 503, 504, 503, 504,
 &end
#
#   38 LYS  HB+          33 MET  HG-         8.00    (#   1351:20  Unique         2.43, 4.36 A)
 &rst
  ixpk= 1351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 571, 572,
 igr2= 503, 504,
 &end
#
#   29 ILE  MG2          33 MET  HG+         6.00    (#   1352:20  Unique         3.08, 4.57 A)
 &rst
  ixpk= 1352, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 429, 430, 431,
 igr2= 503, 504,
 &end
#
#   35 GLU  HN           34 GLU  HA          6.00    (#   1353:20  Unique         3.53, 3.58 A)
 &rst
  ixpk= 1353, nxpk= 20, iat= 528, 515, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   34 GLU  HG-          34 GLU  HB+         3.50    (#   1354:20  Unique         2.38, 2.71 A)
 &rst
  ixpk= 1354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 520, 521,
 igr2= 517, 518,
 &end
#
#   34 GLU  HG-          34 GLU  HB-         3.50    (#   1355:20  Unique         2.38, 2.71 A)
 &rst
  ixpk= 1355, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 520, 521,
 igr2= 517, 518,
 &end
#
#   34 GLU  HA           34 GLU  HG-         4.50    (#   1358:20  Unique         2.36, 3.16 A)
 &rst
  ixpk= 1358, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 520, 521,
 &end
#
#   36 GLN  HN           35 GLU  HA          6.00    (#   1360:20  Unique         3.37, 3.44 A)
 &rst
  ixpk= 1360, nxpk= 20, iat= 543, 530, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:1363     0 AMB  20-1:1363   6.00    (#   1363:20  Double Ambig)
 &rst
  ixpk= 1363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.58, r4=11.08,
 igr1= 555, 556, 555, 556, 560,
 igr2= 532, 533, 532, 533, 532, 533,
 &end
#
#   32 ALA  HA            0 AMB  20-1:1365   6.00    (#   1365:20  Single Ambig)
 &rst
  ixpk= 1365, nxpk= 20, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 532, 533, 532, 533,
 &end
#
#    0 AMB  20-2:1368     0 AMB  20-1:1368   2.80    (#   1368:20  Double Ambig)
 &rst
  ixpk= 1368, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 535, 536, 535, 536, 550, 551, 550, 551,
 igr2= 532, 533, 532, 533, 532, 533,
 &end
#
#   35 GLU  HG-           0 AMB  20-1:1369   2.80    (#   1369:20  Single Ambig)
 &rst
  ixpk= 1369, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 535, 536,
 igr2= 532, 533, 532, 533,
 &end
#
#    0 AMB  20-2:1371     0 AMB  20-1:1371   6.00    (#   1371:20  Double Ambig)
 &rst
  ixpk= 1371, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1= 471, 472, 471, 472, 471, 472,
 igr2= 532, 533, 532, 533, 532, 533,
 &end
#
#   30 LYS  HG+          34 GLU  HG+         8.00    (#   1382:20  Unique         2.65, 4.17 A)
 &rst
  ixpk= 1382, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 449, 450,
 igr2= 520, 521,
 &end
#
#   36 GLN  HN           36 GLN  HB+         4.50    (#   1383:20  Unique         2.62, 3.27 A)
 &rst
  ixpk= 1383, nxpk= 20, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 547, 548,
 &end
#
#   38 LYS  HN           36 GLN  HB+         8.00    (#   1384:20  Unique         2.99, 3.70 A)
 &rst
  ixpk= 1384, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 547, 548,
 &end
#
#   38 LYS  HN           36 GLN  HB-         8.00    (#   1385:20  Unique         2.99, 3.70 A)
 &rst
  ixpk= 1385, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 547, 548,
 &end
#
#   37 GLY  HN           36 GLN  HB+         8.00    (#   1388:20  Unique         3.64, 4.06 A)
 &rst
  ixpk= 1388, nxpk= 20, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 547, 548,
 &end
#
#    0 AMB  20-2:1391     0 AMB  20-1:1391   6.00    (#   1391:20  Double Ambig)
 &rst
  ixpk= 1391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 532, 533, 532, 533,
 igr2= 547, 548, 547, 548,
 &end
#
#   38 LYS  HG-          36 GLN  HB+         6.00    (#   1392:20  Unique         2.32, 3.58 A)
 &rst
  ixpk= 1392, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 574, 575,
 igr2= 547, 548,
 &end
#
#   38 LYS  HG-          36 GLN  HB-         4.50    (#   1393:20  Unique         2.32, 3.58 A)
 &rst
  ixpk= 1393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 574, 575,
 igr2= 547, 548,
 &end
#
#    0 AMB  20-2:1394    36 GLN  HB-         6.00    (#   1394:20  Single Ambig)
 &rst
  ixpk= 1394, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 574, 575, 577, 578, 577, 578,
 igr2= 547, 548,
 &end
#
#    0 AMB  20-2:1395     0 AMB  20-1:1395   6.00    (#   1395:20  Double Ambig)
 &rst
  ixpk= 1395, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1= 574, 575, 577, 578, 577, 578,
 igr2= 547, 548, 547, 548, 547, 548,
 &end
#
#   32 ALA  MB           36 GLN  HB+         6.00    (#   1396:20  Unique         3.07, 5.02 A)
 &rst
  ixpk= 1396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 490, 491, 492,
 igr2= 547, 548,
 &end
#
#   32 ALA  MB           36 GLN  HB-         6.00    (#   1397:20  Unique         3.07, 5.02 A)
 &rst
  ixpk= 1397, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 490, 491, 492,
 igr2= 547, 548,
 &end
#
#   36 GLN  HN           36 GLN  HG-         4.50    (#   1398:20  Unique         2.73, 3.53 A)
 &rst
  ixpk= 1398, nxpk= 20, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 550, 551,
 &end
#
#   32 ALA  HA           36 GLN  HG+         6.00    (#   1403:20  Unique         2.75, 3.64 A)
 &rst
  ixpk= 1403, nxpk= 20, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 550, 551,
 &end
#
#   32 ALA  HA           36 GLN  HG-         6.00    (#   1404:20  Unique         2.75, 3.64 A)
 &rst
  ixpk= 1404, nxpk= 20, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 550, 551,
 &end
#
#    0 AMB  20-2:1408    36 GLN  HG-         3.50    (#   1408:20  Single Ambig)
 &rst
  ixpk= 1408, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 532, 533, 532, 533,
 igr2= 550, 551,
 &end
#
#   36 GLN  HN            0 AMB  20-1:1416   6.00    (#   1416:20  Single Ambig)
 &rst
  ixpk= 1416, nxpk= 20, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:1417     0 AMB  20-1:1417   6.00    (#   1417:20  Double Ambig)
 &rst
  ixpk= 1417, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 545, 591,
 igr2= 562, 563, 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:1418     0 AMB  20-1:1418   4.50    (#   1418:20  Double Ambig)
 &rst
  ixpk= 1418, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 498, 569,
 igr2= 562, 563, 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:1425     0 AMB  20-1:1425   8.00    (#   1425:20  Double Ambig)
 &rst
  ixpk= 1425, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=15.25, r4=15.75,
 igr1= 547, 548, 547, 548, 550, 551, 550, 551,
 igr2= 562, 563, 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:1426     0 AMB  20-1:1426   8.00    (#   1426:20  Double Ambig)
 &rst
  ixpk= 1426, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=14.54, r4=15.04,
 igr1= 547, 548, 503, 504, 503, 504,
 igr2= 562, 563, 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:1427     0 AMB  20-1:1427   8.00    (#   1427:20  Double Ambig)
 &rst
  ixpk= 1427, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=16.00, r4=16.50,
 igr1= 517, 518, 532, 533, 532, 533, 532, 533,
 igr2= 562, 563, 562, 563, 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:1428     0 AMB  20-1:1428   6.00    (#   1428:20  Double Ambig)
 &rst
  ixpk= 1428, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 571, 572, 571, 572,
 igr2= 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:1429     0 AMB  20-1:1429   8.00    (#   1429:20  Double Ambig)
 &rst
  ixpk= 1429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=16.61, r4=17.11,
 igr1= 577, 578, 577, 578, 577, 578, 574, 575, 574, 575,
      
 igr2= 562, 563, 562, 563, 562, 563, 562, 563,
 &end
#
#    0 AMB  20-2:1433     3 ARG  HA          6.00    (#   1433:20  Single Ambig)
 &rst
  ixpk= 1433, nxpk= 20, iat=  -1,  26, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1=  31,  32,  31,  32,  28,  29,
 &end
#
#   41 GLU  HN           39 GLN  HB+         6.00    (#   1434:20  Unique         2.99, 3.34 A)
 &rst
  ixpk= 1434, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 593, 594,
 &end
#
#    0 AMB  20-2:1436    39 GLN  HB-         4.50    (#   1436:20  Single Ambig)
 &rst
  ixpk= 1436, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 629, 630, 629, 630,
 igr2= 593, 594,
 &end
#
#   40 LEU  HB-          39 GLN  HB-         6.00    (#   1437:20  Unique         3.79, 5.39 A)
 &rst
  ixpk= 1437, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 610, 611,
 igr2= 593, 594,
 &end
#
#   41 GLU  HN            0 AMB  20-1:1439   6.00    (#   1439:20  Single Ambig)
 &rst
  ixpk= 1439, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 596, 597, 596, 597,
 &end
#
#    0 AMB  20-2:1447     0 AMB  20-1:1447   2.80    (#   1447:20  Double Ambig)
 &rst
  ixpk= 1447, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 593, 594, 593, 594,
 igr2= 596, 597, 596, 597,
 &end
#
#    0 AMB  20-2:1449    38 LYS  HA          6.00    (#   1449:20  Single Ambig)
 &rst
  ixpk= 1449, nxpk= 20, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 596, 597, 596, 597, 644, 645, 593, 594,
 &end
#
#   38 LYS  HN           38 LYS  HB-         4.50    (#   1451:20  Unique         2.26, 3.03 A)
 &rst
  ixpk= 1451, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 571, 572,
 &end
#
#   43 PHE  HE           38 LYS  HB-         4.50    (#   1452:20  Unique         2.38, 4.61 A)
 &rst
  ixpk= 1452, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 662, 666,
 igr2= 571, 572,
 &end
#
#   43 PHE  HE           38 LYS  HB+         4.50    (#   1454:20  Unique         2.38, 4.61 A)
 &rst
  ixpk= 1454, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 662, 666,
 igr2= 571, 572,
 &end
#
#   39 GLN  HN           38 LYS  HB+         4.50    (#   1455:20  Unique         2.17, 2.93 A)
 &rst
  ixpk= 1455, nxpk= 20, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 571, 572,
 &end
#
#   42 ASP  HB-          38 LYS  HB-         4.50    (#   1457:20  Unique         2.35, 4.02 A)
 &rst
  ixpk= 1457, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 644, 645,
 igr2= 571, 572,
 &end
#
#   42 ASP  HB-          38 LYS  HB+         8.00    (#   1458:20  Unique         2.35, 4.02 A)
 &rst
  ixpk= 1458, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 644, 645,
 igr2= 571, 572,
 &end
#
#    0 AMB  20-2:1459     0 AMB  20-1:1459   6.00    (#   1459:20  Double Ambig)
 &rst
  ixpk= 1459, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 503, 504, 547, 548,
 igr2= 571, 572, 571, 572,
 &end
#
#   38 LYS  HG+          38 LYS  HB-         3.50    (#   1460:20  Unique         2.28, 2.67 A)
 &rst
  ixpk= 1460, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 574, 575,
 igr2= 571, 572,
 &end
#
#   38 LYS  HG+          38 LYS  HB+         3.50    (#   1461:20  Unique         2.28, 2.67 A)
 &rst
  ixpk= 1461, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 574, 575,
 igr2= 571, 572,
 &end
#
#   32 ALA  MB           38 LYS  HB-         8.00    (#   1462:20  Unique         2.31, 4.19 A)
 &rst
  ixpk= 1462, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 490, 491, 492,
 igr2= 571, 572,
 &end
#
#   32 ALA  MB           38 LYS  HB+         6.00    (#   1463:20  Unique         2.31, 4.19 A)
 &rst
  ixpk= 1463, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 490, 491, 492,
 igr2= 571, 572,
 &end
#
#   38 LYS  HN           38 LYS  HG+         6.00    (#   1464:20  Unique         2.21, 3.13 A)
 &rst
  ixpk= 1464, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 574, 575,
 &end
#
#   38 LYS  HN           38 LYS  HG-         4.50    (#   1465:20  Unique         2.21, 3.13 A)
 &rst
  ixpk= 1465, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 574, 575,
 &end
#
#    0 AMB  20-2:1466     0 AMB  20-1:1466   4.50    (#   1466:20  Double Ambig)
 &rst
  ixpk= 1466, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 569, 498,
 igr2= 574, 575, 574, 575,
 &end
#
#   38 LYS  HE-          38 LYS  HG-         6.00    (#   1467:20  Unique         2.33, 3.20 A)
 &rst
  ixpk= 1467, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 580, 581,
 igr2= 574, 575,
 &end
#
#    0 AMB  20-2:1468    38 LYS  HG-         6.00    (#   1468:20  Single Ambig)
 &rst
  ixpk= 1468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 547, 548, 644, 645,
 igr2= 574, 575,
 &end
#
#   36 GLN  HB-          38 LYS  HG-         4.50    (#   1469:20  Unique         2.32, 3.58 A)
 &rst
  ixpk= 1469, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 547, 548,
 igr2= 574, 575,
 &end
#
#   36 GLN  HB-          38 LYS  HG+         6.00    (#   1470:20  Unique         2.32, 3.58 A)
 &rst
  ixpk= 1470, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 547, 548,
 igr2= 574, 575,
 &end
#
#    0 AMB  20-2:1471     0 AMB  20-1:1471   6.00    (#   1471:20  Double Ambig)
 &rst
  ixpk= 1471, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 547, 548, 644, 645,
 igr2= 574, 575, 574, 575,
 &end
#
#   38 LYS  HB-          38 LYS  HG+         4.50    (#   1472:20  Unique         2.28, 2.67 A)
 &rst
  ixpk= 1472, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 571, 572,
 igr2= 574, 575,
 &end
#
#   38 LYS  HB-          38 LYS  HG-         4.50    (#   1473:20  Unique         2.28, 2.67 A)
 &rst
  ixpk= 1473, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 571, 572,
 igr2= 574, 575,
 &end
#
#   39 GLN  HN            0 AMB  20-1:1475   6.00    (#   1475:20  Single Ambig)
 &rst
  ixpk= 1475, nxpk= 20, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 577, 578, 577, 578,
 &end
#
#   38 LYS  HN            0 AMB  20-1:1476   8.00    (#   1476:20  Single Ambig)
 &rst
  ixpk= 1476, nxpk= 20, iat= 567,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr2= 577, 578, 577, 578,
 &end
#
#   43 PHE  HE            0 AMB  20-1:1477   8.00    (#   1477:20  Single Ambig)
 &rst
  ixpk= 1477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 662, 666,
 igr2= 577, 578, 577, 578,
 &end
#
#   43 PHE  HZ            0 AMB  20-1:1478   8.00    (#   1478:20  Single Ambig)
 &rst
  ixpk= 1478, nxpk= 20, iat= 664,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr2= 577, 578, 577, 578,
 &end
#
#    0 AMB  20-2:1481     0 AMB  20-1:1481   4.50    (#   1481:20  Double Ambig)
 &rst
  ixpk= 1481, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 644, 645, 644, 645, 547, 548, 547, 548,
 igr2= 577, 578, 577, 578, 577, 578,
 &end
#
#   38 LYS  HB-           0 AMB  20-1:1482   4.50    (#   1482:20  Single Ambig)
 &rst
  ixpk= 1482, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 571, 572,
 igr2= 577, 578, 577, 578,
 &end
#
#   38 LYS  HG-           0 AMB  20-1:1483   2.80    (#   1483:20  Single Ambig)
 &rst
  ixpk= 1483, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 574, 575,
 igr2= 577, 578, 577, 578,
 &end
#
#   43 PHE  HN           40 LEU  HA          6.00    (#   1485:20  Unique         3.49, 3.65 A)
 &rst
  ixpk= 1485, nxpk= 20, iat= 652, 608, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   42 ASP  HN           40 LEU  HA          6.00    (#   1486:20  Unique         3.60, 3.89 A)
 &rst
  ixpk= 1486, nxpk= 20, iat= 640, 608, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   43 PHE  HE           40 LEU  HA          6.00    (#   1487:20  Unique         3.67, 5.82 A)
 &rst
  ixpk= 1487, nxpk= 20, iat=  -1, 608, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 662, 666,
 &end
#
#    0 AMB  20-2:1489    40 LEU  HA          6.00    (#   1489:20  Single Ambig)
 &rst
  ixpk= 1489, nxpk= 20, iat=  -1, 608, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 656, 657,  98,  99,
 &end
#
#   40 LEU  HB-          40 LEU  HA          2.80    (#   1490:20  Unique         2.34, 2.80 A)
 &rst
  ixpk= 1490, nxpk= 20, iat=  -1, 608, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 610, 611,
 &end
#
#   29 ILE  MG2          40 LEU  HA          6.00    (#   1491:20  Unique         3.25, 4.22 A)
 &rst
  ixpk= 1491, nxpk= 20, iat=  -1, 608, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 429, 430, 431,
 &end
#
#    7 TYR  HE           40 LEU  HB+         6.00    (#   1492:20  Unique         2.09, 4.56 A)
 &rst
  ixpk= 1492, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 104, 109,
 igr2= 610, 611,
 &end
#
#    7 TYR  HE           40 LEU  HB-         6.00    (#   1493:20  Unique         2.09, 4.56 A)
 &rst
  ixpk= 1493, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 104, 109,
 igr2= 610, 611,
 &end
#
#    0 AMB  20-2:1494     0 AMB  20-1:1494   8.00    (#   1494:20  Double Ambig)
 &rst
  ixpk= 1494, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=14.54, r4=15.04,
 igr1= 632, 633, 593, 594, 596, 597,
 igr2= 610, 611, 610, 611, 610, 611,
 &end
#
#    0 AMB  20-2:1495    40 LEU  HB-         8.00    (#   1495:20  Single Ambig)
 &rst
  ixpk= 1495, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 632, 633, 593, 594, 596, 597,
 igr2= 610, 611,
 &end
#
#   33 MET  ME           40 LEU  HB+         6.00    (#   1496:20  Unique         3.36, 6.09 A)
 &rst
  ixpk= 1496, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 507, 508, 509,
 igr2= 610, 611,
 &end
#
#   33 MET  ME           40 LEU  HB-         6.00    (#   1497:20  Unique         3.36, 6.09 A)
 &rst
  ixpk= 1497, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 507, 508, 509,
 igr2= 610, 611,
 &end
#
#   43 PHE  HB-          40 LEU  MDX         6.00    (#   1508:20  Unique         2.55, 6.65 A)
 &rst
  ixpk= 1508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 656, 657,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#    0 AMB  20-2:1509    40 LEU  MDX         6.00    (#   1509:20  Single Ambig)
 &rst
  ixpk= 1509, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.19, r4=10.69,
 igr1= 656, 657,  98,  99,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   29 ILE  MG2          40 LEU  MDX         3.50    (#   1515:20  Unique         2.41, 4.85 A)
 &rst
  ixpk= 1515, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 429, 430, 431,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   43 PHE  HN           41 GLU  HA          6.00    (#   1517:20  Unique         3.44, 3.65 A)
 &rst
  ixpk= 1517, nxpk= 20, iat= 652, 627, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    7 TYR  HD           41 GLU  HA          6.00    (#   1518:20  Unique         4.41, 6.74 A)
 &rst
  ixpk= 1518, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 102, 111,
 &end
#
#   39 GLN  HB+          41 GLU  HA          6.00    (#   1525:20  Unique         5.69, 5.94 A)
 &rst
  ixpk= 1525, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 593, 594,
 &end
#
#   42 ASP  HN            0 AMB  20-1:1528   6.00    (#   1528:20  Single Ambig)
 &rst
  ixpk= 1528, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 629, 630, 629, 630,
 &end
#
#    0 AMB  20-2:1531     0 AMB  20-1:1531   2.80    (#   1531:20  Double Ambig)
 &rst
  ixpk= 1531, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 632, 633, 632, 633, 593, 594,
 igr2= 629, 630, 629, 630,
 &end
#
#    0 AMB  20-2:1532     0 AMB  20-1:1532   6.00    (#   1532:20  Double Ambig)
 &rst
  ixpk= 1532, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.24, r4=12.74,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 igr2= 629, 630, 629, 630, 629, 630,
 &end
#
#   41 GLU  HN           41 GLU  HG-         4.50    (#   1533:20  Unique         2.16, 3.37 A)
 &rst
  ixpk= 1533, nxpk= 20, iat= 625,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 632, 633,
 &end
#
#    0 AMB  20-2:1534     0 AMB  20-1:1534   2.80    (#   1534:20  Double Ambig)
 &rst
  ixpk= 1534, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 629, 630, 629, 630, 532, 533, 532, 533, 517, 518,
      
 igr2= 632, 633, 632, 633, 535, 536, 535, 536, 535, 536,
      
 &end
#
#    0 AMB  20-2:1535    41 GLU  HG-         2.80    (#   1535:20  Single Ambig)
 &rst
  ixpk= 1535, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 629, 630, 629, 630,
 igr2= 632, 633,
 &end
#
#   48 LEU  MDY          41 GLU  HG+         6.00    (#   1540:20  Unique         2.31, 5.49 A)
 &rst
  ixpk= 1540, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 632, 633,
 &end
#
#   48 LEU  MDY          41 GLU  HG-         6.00    (#   1541:20  Unique         2.31, 5.49 A)
 &rst
  ixpk= 1541, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 632, 633,
 &end
#
#   43 PHE  HN           42 ASP  HA          6.00    (#   1542:20  Unique         3.38, 3.43 A)
 &rst
  ixpk= 1542, nxpk= 20, iat= 652, 642, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   42 ASP  HB-          42 ASP  HA          4.50    (#   1545:20  Unique         2.49, 2.78 A)
 &rst
  ixpk= 1545, nxpk= 20, iat=  -1, 642, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 644, 645,
 &end
#
#   39 GLN  HN           42 ASP  HB-         4.50    (#   1546:20  Unique         2.88, 3.59 A)
 &rst
  ixpk= 1546, nxpk= 20, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 644, 645,
 &end
#
#   39 GLN  HN           42 ASP  HB+         6.00    (#   1547:20  Unique         2.88, 3.59 A)
 &rst
  ixpk= 1547, nxpk= 20, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 644, 645,
 &end
#
#   43 PHE  HN           42 ASP  HB-         6.00    (#   1548:20  Unique         2.79, 3.67 A)
 &rst
  ixpk= 1548, nxpk= 20, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 644, 645,
 &end
#
#   43 PHE  HD           42 ASP  HB-         6.00    (#   1549:20  Unique         2.75, 4.90 A)
 &rst
  ixpk= 1549, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 660, 668,
 igr2= 644, 645,
 &end
#
#   43 PHE  HE           42 ASP  HB-         6.00    (#   1550:20  Unique         2.83, 4.94 A)
 &rst
  ixpk= 1550, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 662, 666,
 igr2= 644, 645,
 &end
#
#   38 LYS  HB-          42 ASP  HB+         6.00    (#   1551:20  Unique         2.35, 4.02 A)
 &rst
  ixpk= 1551, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 571, 572,
 igr2= 644, 645,
 &end
#
#    0 AMB  20-2:1552    42 ASP  HB-         6.00    (#   1552:20  Single Ambig)
 &rst
  ixpk= 1552, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 577, 578, 577, 578, 574, 575,
 igr2= 644, 645,
 &end
#
#   38 LYS  HB+          42 ASP  HB-         6.00    (#   1553:20  Unique         2.35, 4.02 A)
 &rst
  ixpk= 1553, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 571, 572,
 igr2= 644, 645,
 &end
#
#    0 AMB  20-2:1554     0 AMB  20-1:1554   6.00    (#   1554:20  Double Ambig)
 &rst
  ixpk= 1554, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 577, 578, 577, 578,
 igr2= 644, 645, 644, 645,
 &end
#
#    8 SER  HN           43 PHE  HB-         6.00    (#   1556:20  Unique         2.53, 3.51 A)
 &rst
  ixpk= 1556, nxpk= 20, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 656, 657,
 &end
#
#   43 PHE  HN           43 PHE  HB-         6.00    (#   1557:20  Unique         2.46, 3.12 A)
 &rst
  ixpk= 1557, nxpk= 20, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 656, 657,
 &end
#
#    7 TYR  HD           43 PHE  HB-         6.00    (#   1558:20  Unique         2.19, 4.87 A)
 &rst
  ixpk= 1558, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 102, 111,
 igr2= 656, 657,
 &end
#
#   43 PHE  HA           43 PHE  HB-         4.50    (#   1559:20  Unique         2.39, 2.75 A)
 &rst
  ixpk= 1559, nxpk= 20, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 656, 657,
 &end
#
#   43 PHE  HA           43 PHE  HB+         4.50    (#   1560:20  Unique         2.39, 2.75 A)
 &rst
  ixpk= 1560, nxpk= 20, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 656, 657,
 &end
#
#   29 ILE  MD1          43 PHE  HB-         6.00    (#   1561:20  Unique         2.51, 3.68 A)
 &rst
  ixpk= 1561, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 436, 437, 438,
 igr2= 656, 657,
 &end
#
#   29 ILE  MD1          43 PHE  HB+         6.00    (#   1562:20  Unique         2.51, 3.68 A)
 &rst
  ixpk= 1562, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 436, 437, 438,
 igr2= 656, 657,
 &end
#
#    0 AMB  20-2:1564    44 LEU  HA          6.00    (#   1564:20  Single Ambig)
 &rst
  ixpk= 1564, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  98,  99, 656, 657,
 &end
#
#   45 ILE  HN           44 LEU  HB-         6.00    (#   1567:20  Unique         2.46, 3.70 A)
 &rst
  ixpk= 1567, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 676, 677,
 &end
#
#   45 ILE  HN           44 LEU  HB+         6.00    (#   1568:20  Unique         2.46, 3.70 A)
 &rst
  ixpk= 1568, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 676, 677,
 &end
#
#    7 TYR  HE           44 LEU  HB-         6.00    (#   1570:20  Unique         2.29, 4.75 A)
 &rst
  ixpk= 1570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 104, 109,
 igr2= 676, 677,
 &end
#
#   41 GLU  HA           44 LEU  HB+         6.00    (#   1571:20  Unique         2.17, 2.79 A)
 &rst
  ixpk= 1571, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 676, 677,
 &end
#
#   45 ILE  HG1-         44 LEU  HB+         6.00    (#   1576:20  Double Ambig)
 &rst
  ixpk= 1576, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 701, 702,
 igr2= 676, 677,
 &end
#
#   45 ILE  HG1-         44 LEU  HB-         6.00    (#   1577:20  Single Ambig)
 &rst
  ixpk= 1577, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 701, 702,
 igr2= 676, 677,
 &end
#
#   44 LEU  HN            0 AMB  20-1:1582   6.00    (#   1582:20  Single Ambig)
 &rst
  ixpk= 1582, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    7 TYR  HA            0 AMB  20-1:1584   6.00    (#   1584:20  Single Ambig)
 &rst
  ixpk= 1584, nxpk= 20, iat=  96,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#   45 ILE  HA            0 AMB  20-1:1585   6.00    (#   1585:20  Single Ambig)
 &rst
  ixpk= 1585, nxpk= 20, iat= 693,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#   48 LEU  MDY           0 AMB  20-1:1588   2.80    (#   1588:20  Single Ambig)
 &rst
  ixpk= 1588, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 756, 757, 758, 760, 761, 762,
 igr2= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    0 AMB  20-2:1604    45 ILE  HA          6.00    (#   1604:20  Single Ambig)
 &rst
  ixpk= 1604, nxpk= 20, iat=  -1, 693, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 676, 677, 679, 714, 715,
 &end
#
#   45 ILE  MD1          45 ILE  HA          6.00    (#   1605:20  Unique         4.49, 4.92 A)
 &rst
  ixpk= 1605, nxpk= 20, iat=  -1, 693, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 704, 705, 706,
 &end
#
#   46 LYS  HN           45 ILE  HB          6.00    (#   1606:20  Unique         2.33, 3.04 A)
 &rst
  ixpk= 1606, nxpk= 20, iat= 710, 695, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    7 TYR  HA           45 ILE  HB          8.00    (#   1607:20  Unique         4.06, 4.66 A)
 &rst
  ixpk= 1607, nxpk= 20, iat=  96, 695, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    0 AMB  20-2:1608    45 ILE  HB          6.00    (#   1608:20  Single Ambig)
 &rst
  ixpk= 1608, nxpk= 20, iat=  -1, 695, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  74, 712,
 &end
#
#   45 ILE  HA           45 ILE  HB          4.50    (#   1609:20  Unique         2.49, 2.84 A)
 &rst
  ixpk= 1609, nxpk= 20, iat= 693, 695, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 ILE  HG1-         45 ILE  HB          3.50    (#   1610:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 1610, nxpk= 20, iat=  -1, 695, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 701, 702,
 &end
#
#   18 THR  MG2          45 ILE  HB          8.00    (#   1611:20  Unique         5.76, 7.03 A)
 &rst
  ixpk= 1611, nxpk= 20, iat=  -1, 695, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 268, 269, 270,
 &end
#
#   45 ILE  HG1+         45 ILE  HB          4.50    (#   1612:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 1612, nxpk= 20, iat=  -1, 695, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 701, 702,
 &end
#
#   45 ILE  HN           45 ILE  HG1+        6.00    (#   1614:20  Unique         1.88, 2.76 A)
 &rst
  ixpk= 1614, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 701, 702,
 &end
#
#    7 TYR  HA           45 ILE  HG1-        6.00    (#   1615:20  Unique         2.29, 3.19 A)
 &rst
  ixpk= 1615, nxpk= 20, iat=  96,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 701, 702,
 &end
#
#    0 AMB  20-2:1616    45 ILE  HG1-        6.00    (#   1616:20  Single Ambig)
 &rst
  ixpk= 1616, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 674, 712,
 igr2= 701, 702,
 &end
#
#    0 AMB  20-2:1617     0 AMB  20-1:1617   8.00    (#   1617:20  Double Ambig)
 &rst
  ixpk= 1617, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 674, 712,
 igr2= 701, 702, 701, 702,
 &end
#
#   45 ILE  HA           45 ILE  HG1-        4.50    (#   1618:20  Unique         2.63, 3.30 A)
 &rst
  ixpk= 1618, nxpk= 20, iat= 693,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 701, 702,
 &end
#
#    8 SER  HB+          45 ILE  HG1+        4.50    (#   1620:20  Unique         3.38, 4.81 A)
 &rst
  ixpk= 1620, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 119, 120,
 igr2= 701, 702,
 &end
#
#   45 ILE  MG2          45 ILE  HG1+        4.50    (#   1623:20  Unique         2.40, 3.54 A)
 &rst
  ixpk= 1623, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 697, 698, 699,
 igr2= 701, 702,
 &end
#
#   45 ILE  MD1          45 ILE  HG1+        3.50    (#   1624:20  Unique         2.32, 2.64 A)
 &rst
  ixpk= 1624, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 704, 705, 706,
 igr2= 701, 702,
 &end
#
#   45 ILE  HN           45 ILE  MD1         6.00    (#   1625:20  Unique         4.15, 4.62 A)
 &rst
  ixpk= 1625, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 704, 705, 706,
 &end
#
#    7 TYR  HN           45 ILE  MD1         6.00    (#   1626:20  Unique         2.85, 4.36 A)
 &rst
  ixpk= 1626, nxpk= 20, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 704, 705, 706,
 &end
#
#    6 LYS  HN           45 ILE  MD1         6.00    (#   1627:20  Unique         3.49, 5.61 A)
 &rst
  ixpk= 1627, nxpk= 20, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 704, 705, 706,
 &end
#
#   45 ILE  HG1+         45 ILE  MD1         2.80    (#   1633:20  Unique         2.32, 2.64 A)
 &rst
  ixpk= 1633, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 701, 702,
 igr2= 704, 705, 706,
 &end
#
#   45 ILE  MG2          45 ILE  MD1         3.50    (#   1635:20  Unique         2.20, 3.77 A)
 &rst
  ixpk= 1635, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 697, 698, 699,
 igr2= 704, 705, 706,
 &end
#
#    0 AMB  20-2:1644    45 ILE  MG2         6.00    (#   1644:20  Single Ambig)
 &rst
  ixpk= 1644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1=  94, 732,
 igr2= 697, 698, 699,
 &end
#
#    8 SER  HB+          45 ILE  MG2         6.00    (#   1648:20  Unique         2.38, 5.51 A)
 &rst
  ixpk= 1648, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 119, 120,
 igr2= 697, 698, 699,
 &end
#
#   46 LYS  HB+          45 ILE  MG2         8.00    (#   1650:20  Unique         3.36, 6.30 A)
 &rst
  ixpk= 1650, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 714, 715,
 igr2= 697, 698, 699,
 &end
#
#    0 AMB  20-2:1651    45 ILE  MG2         6.00    (#   1651:20  Single Ambig)
 &rst
  ixpk= 1651, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 714, 715, 676, 677,
 igr2= 697, 698, 699,
 &end
#
#   45 ILE  HG1+         45 ILE  MG2         4.50    (#   1652:20  Unique         2.40, 3.54 A)
 &rst
  ixpk= 1652, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 701, 702,
 igr2= 697, 698, 699,
 &end
#
#   47 GLU  HN           47 GLU  HB-         4.50    (#   1666:20  Unique         2.19, 3.15 A)
 &rst
  ixpk= 1666, nxpk= 20, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 736, 737,
 &end
#
#   47 GLU  HG+          47 GLU  HB-         2.80    (#   1669:20  Unique         2.33, 2.73 A)
 &rst
  ixpk= 1669, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 739, 740,
 igr2= 736, 737,
 &end
#
#    0 AMB  20-2:1670     0 AMB  20-1:1670   2.80    (#   1670:20  Double Ambig)
 &rst
  ixpk= 1670, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 739, 740, 739, 740, 739, 740, 739, 740,
 igr2= 736, 737, 736, 737, 770, 771, 770, 771, 770, 771,
      
 &end
#
#   47 GLU  HN           47 GLU  HG+         4.50    (#   1674:20  Unique         2.40, 4.16 A)
 &rst
  ixpk= 1674, nxpk= 20, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 739, 740,
 &end
#
#    0 AMB  20-2:1678     0 AMB  20-1:1678   2.80    (#   1678:20  Double Ambig)
 &rst
  ixpk= 1678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 770, 771, 770, 771, 770, 771,
 igr2= 773, 774, 773, 774, 773, 774,
 &end
#
#   47 GLU  HN           46 LYS  HB+         6.00    (#   1684:20  Unique         2.01, 3.39 A)
 &rst
  ixpk= 1684, nxpk= 20, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 714, 715,
 &end
#
#   47 GLU  HN           46 LYS  HB-         6.00    (#   1685:20  Unique         2.01, 3.39 A)
 &rst
  ixpk= 1685, nxpk= 20, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 714, 715,
 &end
#
#    0 AMB  20-2:1686     0 AMB  20-1:1686   4.50    (#   1686:20  Double Ambig)
 &rst
  ixpk= 1686, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  76,  77, 701, 702,
 igr2= 714, 715, 714, 715,
 &end
#
#    0 AMB  20-2:1687    46 LYS  HB-         3.50    (#   1687:20  Single Ambig)
 &rst
  ixpk= 1687, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  76,  77, 701, 702,
 igr2= 714, 715,
 &end
#
#   46 LYS  HN            0 AMB  20-1:1688   6.00    (#   1688:20  Single Ambig)
 &rst
  ixpk= 1688, nxpk= 20, iat= 710,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 717, 718, 717, 718,
 &end
#
#    0 AMB  20-2:1689     0 AMB  20-1:1689   4.50    (#   1689:20  Double Ambig)
 &rst
  ixpk= 1689, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 712,  74,
 igr2= 717, 718, 717, 718, 717, 718,
 &end
#
#    0 AMB  20-2:1690     0 AMB  20-1:1690   2.80    (#   1690:20  Double Ambig)
 &rst
  ixpk= 1690, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 474, 475, 474, 475, 474, 475,
 igr2= 471, 472, 471, 472, 471, 472,
 &end
#
#    0 AMB  20-2:1697     0 AMB  20-1:1697   2.80    (#   1697:20  Double Ambig)
 &rst
  ixpk= 1697, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=  76,  77,  76,  77, 701, 702,
 igr2= 720, 721, 720, 721, 720, 721,
 &end
#
#    0 AMB  20-2:1703    48 LEU  HA          3.50    (#   1703:20  Single Ambig)
 &rst
  ixpk= 1703, nxpk= 20, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 751, 752, 754,
 &end
#
#    0 AMB  20-2:1704    48 LEU  HA          3.50    (#   1704:20  Single Ambig)
 &rst
  ixpk= 1704, nxpk= 20, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  82,  83,  82,  83, 751, 752,
 &end
#
#   45 ILE  HN           48 LEU  HB+         8.00    (#   1705:20  Unique         4.84, 7.04 A)
 &rst
  ixpk= 1705, nxpk= 20, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 751, 752,
 &end
#
#   34 GLU  HN           33 MET  HA          6.00    (#   1726:20  Unique         3.59, 3.60 A)
 &rst
  ixpk= 1726, nxpk= 20, iat= 513, 498, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    8 SER  HN            8 SER  HA          6.00    (#   1727:20  Unique         2.92, 2.95 A)
 &rst
  ixpk= 1727, nxpk= 20, iat= 115, 117, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    3 ARG  HN            0 AMB  20-1:1730   6.00    (#   1730:20  Single Ambig)
 &rst
  ixpk= 1730, nxpk= 20, iat=  24,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2=  18,  19,  20,   8,   9,  10,
 &end
#
#    4 PRO  HD+           3 ARG  HA          4.50    (#   1731:20  Unique         2.10, 2.50 A)
 &rst
  ixpk= 1731, nxpk= 20, iat=  -1,  26, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  49,  50,
 &end
#
#    4 PRO  HD-           3 ARG  HA          4.50    (#   1732:20  Unique         2.10, 2.50 A)
 &rst
  ixpk= 1732, nxpk= 20, iat=  -1,  26, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  49,  50,
 &end
#
#    3 ARG  HB-           3 ARG  HA          6.00    (#   1733:20  Unique         2.43, 2.77 A)
 &rst
  ixpk= 1733, nxpk= 20, iat=  -1,  26, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  28,  29,
 &end
#
#    6 LYS  HG+          20 THR  HA          6.00    (#   1734:20  Unique         2.74, 5.28 A)
 &rst
  ixpk= 1734, nxpk= 20, iat=  -1, 302, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  79,  80,
 &end
#
#    0 AMB  20-2:1740     0 AMB  20-1:1740   3.50    (#   1740:20  Double Ambig)
 &rst
  ixpk= 1740, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=  79,  80,  79,  80,
 igr2=  82,  83,  82,  83,
 &end
#
#    9 TYR  HN            9 TYR  HB-         8.00    (#   1747:20  Unique         3.29, 3.69 A)
 &rst
  ixpk= 1747, nxpk= 20, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 130, 131,
 &end
#
#   43 PHE  HE            9 TYR  HB+         6.00    (#   1748:20  Unique         2.97, 5.55 A)
 &rst
  ixpk= 1748, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 662, 666,
 igr2= 130, 131,
 &end
#
#    9 TYR  HD           10 VAL  HA          8.00    (#   1749:20  Unique         3.92, 5.54 A)
 &rst
  ixpk= 1749, nxpk= 20, iat=  -1, 149, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 134, 143,
 &end
#
#    9 TYR  HA           10 VAL  HB          8.00    (#   1751:20  Unique         3.76, 4.34 A)
 &rst
  ixpk= 1751, nxpk= 20, iat= 128, 151, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   11 ASP  HB-          12 GLU  HA          8.00    (#   1754:20  Unique         4.57, 5.49 A)
 &rst
  ixpk= 1754, nxpk= 20, iat=  -1, 177, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 167, 168,
 &end
#
#   13 ASN  HN           12 GLU  HB-         6.00    (#   1757:20  Unique         2.35, 3.35 A)
 &rst
  ixpk= 1757, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 179, 180,
 &end
#
#   13 ASN  HN           12 GLU  HB+         6.00    (#   1758:20  Unique         2.35, 3.35 A)
 &rst
  ixpk= 1758, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 179, 180,
 &end
#
#    0 AMB  20-2:1759     0 AMB  20-1:1759   8.00    (#   1759:20  Double Ambig)
 &rst
  ixpk= 1759, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 192, 654,
 igr2= 179, 180, 629, 630,
 &end
#
#   13 ASN  HN            0 AMB  20-1:1760   4.50    (#   1760:20  Single Ambig)
 &rst
  ixpk= 1760, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 182, 183, 182, 183,
 &end
#
#   13 ASN  HN           13 ASN  HA          8.00    (#   1764:20  Unique         2.85, 2.92 A)
 &rst
  ixpk= 1764, nxpk= 20, iat= 190, 192, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    0 AMB  20-2:1767    15 GLU  HA          6.00    (#   1767:20  Single Ambig)
 &rst
  ixpk= 1767, nxpk= 20, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#    9 TYR  HN           16 THR  MG2         6.00    (#   1771:20  Unique         4.60, 6.31 A)
 &rst
  ixpk= 1771, nxpk= 20, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 232, 233, 234,
 &end
#
#   34 GLU  HB-          30 LYS  HG+         6.00    (#   1774:20  Unique         3.66, 5.22 A)
 &rst
  ixpk= 1774, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 517, 518,
 igr2= 449, 450,
 &end
#
#   17 LYS  HA           18 THR  MG2         6.00    (#   1781:20  Unique         3.47, 4.84 A)
 &rst
  ixpk= 1781, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 268, 269, 270,
 &end
#
#   18 THR  HA           19 TRP  HA          8.00    (#   1785:20  Unique         4.52, 4.54 A)
 &rst
  ixpk= 1785, nxpk= 20, iat= 264, 278, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    6 LYS  HN           20 THR  MG2         6.00    (#   1790:20  Unique         3.76, 5.04 A)
 &rst
  ixpk= 1790, nxpk= 20, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 306, 307, 308,
 &end
#
#   22 GLN  HN           20 THR  MG2         8.00    (#   1791:20  Unique         4.65, 5.11 A)
 &rst
  ixpk= 1791, nxpk= 20, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr2= 306, 307, 308,
 &end
#
#   19 TRP  HA           20 THR  MG2         6.00    (#   1792:20  Unique         3.39, 4.54 A)
 &rst
  ixpk= 1792, nxpk= 20, iat= 278,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 306, 307, 308,
 &end
#
#   23 GLY  HN            0 AMB  20-1:1793   6.00    (#   1793:20  Single Ambig)
 &rst
  ixpk= 1793, nxpk= 20, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 328, 329, 328, 329,
 &end
#
#   24 ARG  HA           23 GLY  HA+         6.00    (#   1794:20  Unique         4.40, 4.58 A)
 &rst
  ixpk= 1794, nxpk= 20, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 340, 341,
 &end
#
#   22 GLN  HB-          23 GLY  HA+         8.00    (#   1795:20  Unique         4.20, 4.83 A)
 &rst
  ixpk= 1795, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 325, 326,
 igr2= 340, 341,
 &end
#
#    0 AMB  20-2:1797    24 ARG  HA          6.00    (#   1797:20  Single Ambig)
 &rst
  ixpk= 1797, nxpk= 20, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 355, 356, 355, 356,
 &end
#
#   25 THR  HN            0 AMB  20-1:1798   6.00    (#   1798:20  Single Ambig)
 &rst
  ixpk= 1798, nxpk= 20, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 349, 350, 349, 350,
 &end
#
#    0 AMB  20-2:1801     0 AMB  20-1:1801   8.00    (#   1801:20  Double Ambig)
 &rst
  ixpk= 1801, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.95, r4=13.45,
 igr1=  16, 340, 341,
 igr2=  28,  29, 349, 350, 349, 350,
 &end
#
#    0 AMB  20-2:1803     0 AMB  20-1:1803   4.50    (#   1803:20  Double Ambig)
 &rst
  ixpk= 1803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 347, 768,
 igr2= 352, 353, 754,
 &end
#
#    0 AMB  20-2:1804     0 AMB  20-1:1804   4.50    (#   1804:20  Double Ambig)
 &rst
  ixpk= 1804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 749, 734, 340, 341,
 igr2= 754, 352, 353,
 &end
#
#    0 AMB  20-2:1811    25 THR  MG2         6.00    (#   1811:20  Single Ambig)
 &rst
  ixpk= 1811, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 369, 407,
 igr2= 375, 376, 377,
 &end
#
#   19 TRP  HZ3          25 THR  MG2         6.00    (#   1812:20  Unique         2.86, 4.19 A)
 &rst
  ixpk= 1812, nxpk= 20, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 375, 376, 377,
 &end
#
#   29 ILE  HN           25 THR  MG2         6.00    (#   1813:20  Unique         4.09, 5.08 A)
 &rst
  ixpk= 1813, nxpk= 20, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 375, 376, 377,
 &end
#
#   29 ILE  HA           25 THR  MG2         8.00    (#   1818:20  Unique         4.78, 5.29 A)
 &rst
  ixpk= 1818, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr2= 375, 376, 377,
 &end
#
#   30 LYS  HB-          25 THR  MG2         6.00    (#   1819:20  Unique         2.80, 4.19 A)
 &rst
  ixpk= 1819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 446, 447,
 igr2= 375, 376, 377,
 &end
#
#    0 AMB  20-2:1820    25 THR  MG2         4.50    (#   1820:20  Single Ambig)
 &rst
  ixpk= 1820, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 384, 385, 452, 453,
 igr2= 375, 376, 377,
 &end
#
#   30 LYS  HB+          25 THR  MG2         4.50    (#   1821:20  Unique         2.80, 4.19 A)
 &rst
  ixpk= 1821, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 446, 447,
 igr2= 375, 376, 377,
 &end
#
#   29 ILE  MG2          25 THR  MG2         3.50    (#   1822:20  Unique         2.53, 3.52 A)
 &rst
  ixpk= 1822, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 429, 430, 431,
 igr2= 375, 376, 377,
 &end
#
#    9 TYR  HE           26 PRO  HG+         6.00    (#   1825:20  Unique         2.59, 4.85 A)
 &rst
  ixpk= 1825, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 136, 141,
 igr2= 387, 388,
 &end
#
#    9 TYR  HA           28 VAL  MGX         6.00    (#   1829:20  Unique         4.21, 6.24 A)
 &rst
  ixpk= 1829, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 413, 414, 415, 417, 418, 419,
 &end
#
#   28 VAL  MGX          29 ILE  HA          8.00    (#   1830:20  Unique         3.68, 5.51 A)
 &rst
  ixpk= 1830, nxpk= 20, iat=  -1, 425, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#   32 ALA  HN           30 LYS  HA          6.00    (#   1832:20  Unique         4.57, 4.65 A)
 &rst
  ixpk= 1832, nxpk= 20, iat= 486, 444, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:1834    30 LYS  HA          8.00    (#   1834:20  Single Ambig)
 &rst
  ixpk= 1834, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 455, 456, 455, 456,
 &end
#
#   33 MET  HG-          30 LYS  HA          6.00    (#   1835:20  Unique         3.68, 4.50 A)
 &rst
  ixpk= 1835, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 503, 504,
 &end
#
#    0 AMB  20-2:1836    30 LYS  HA          8.00    (#   1836:20  Single Ambig)
 &rst
  ixpk= 1836, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 503, 504, 520, 521,
 &end
#
#   29 ILE  MG2          30 LYS  HA          6.00    (#   1837:20  Unique         3.67, 4.83 A)
 &rst
  ixpk= 1837, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 429, 430, 431,
 &end
#
#   31 LYS  HN           30 LYS  HB-         3.50    (#   1838:20  Unique         2.54, 3.32 A)
 &rst
  ixpk= 1838, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 446, 447,
 &end
#
#   28 VAL  HA           30 LYS  HB-         6.00    (#   1839:20  Unique         5.06, 5.91 A)
 &rst
  ixpk= 1839, nxpk= 20, iat= 409,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 446, 447,
 &end
#
#   25 THR  HB           30 LYS  HB+         6.00    (#   1840:20  Unique         2.44, 3.61 A)
 &rst
  ixpk= 1840, nxpk= 20, iat= 373,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 446, 447,
 &end
#
#   31 LYS  HN           30 LYS  HG-         6.00    (#   1841:20  Unique         2.79, 3.61 A)
 &rst
  ixpk= 1841, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 449, 450,
 &end
#
#   34 GLU  HG-          30 LYS  HG-         8.00    (#   1842:20  Unique         2.65, 4.17 A)
 &rst
  ixpk= 1842, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 520, 521,
 igr2= 449, 450,
 &end
#
#   38 LYS  HA           38 LYS  HE-         8.00    (#   1844:20  Unique         1.91, 4.17 A)
 &rst
  ixpk= 1844, nxpk= 20, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 580, 581,
 &end
#
#   31 LYS  HA            0 AMB  20-1:1845   6.00    (#   1845:20  Single Ambig)
 &rst
  ixpk= 1845, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 477, 478, 477, 478,
 &end
#
#   31 LYS  HN           32 ALA  MB          8.00    (#   1847:20  Unique         4.90, 5.51 A)
 &rst
  ixpk= 1847, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr2= 490, 491, 492,
 &end
#
#   32 ALA  HN           33 MET  HG-         8.00    (#   1852:20  Unique         4.71, 5.55 A)
 &rst
  ixpk= 1852, nxpk= 20, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 503, 504,
 &end
#
#   30 LYS  HG+          34 GLU  HG-         6.00    (#   1853:20  Unique         2.65, 4.17 A)
 &rst
  ixpk= 1853, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 449, 450,
 igr2= 520, 521,
 &end
#
#   37 GLY  HN           36 GLN  HB-         6.00    (#   1854:20  Unique         3.64, 4.06 A)
 &rst
  ixpk= 1854, nxpk= 20, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 547, 548,
 &end
#
#   42 ASP  HN           39 GLN  HB-         8.00    (#   1859:20  Unique         3.66, 4.33 A)
 &rst
  ixpk= 1859, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 593, 594,
 &end
#
#   42 ASP  HN           39 GLN  HB+         6.00    (#   1860:20  Unique         3.66, 4.33 A)
 &rst
  ixpk= 1860, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 593, 594,
 &end
#
#   40 LEU  MDX          43 PHE  HB+         8.00    (#   1869:20  Unique         2.55, 6.65 A)
 &rst
  ixpk= 1869, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 615, 616, 617, 619, 620, 621,
 igr2= 656, 657,
 &end
#
#   47 GLU  HB-          47 GLU  HA          3.50    (#   1871:20  Unique         2.37, 2.76 A)
 &rst
  ixpk= 1871, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 736, 737,
 &end
#
#    0 AMB  20-2:1873    47 GLU  HA          6.00    (#   1873:20  Single Ambig)
 &rst
  ixpk= 1873, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=  79,  80, 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:1874    47 GLU  HA          6.00    (#   1874:20  Single Ambig)
 &rst
  ixpk= 1874, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    0 AMB  20-2:1876    49 GLU  HA          6.00    (#   1876:20  Single Ambig)
 &rst
  ixpk= 1876, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 773, 774, 773, 774,
 &end
#
#    0 AMB  20-2:1877     0 AMB  20-1:1877   6.00    (#   1877:20  Double Ambig)
 &rst
  ixpk= 1877, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1= 477, 478, 477, 478, 477, 478,
 igr2= 468, 469, 468, 469, 468, 469,
 &end
#
#   31 LYS  HN            0 AMB  20-1:1878   6.00    (#   1878:20  Single Ambig)
 &rst
  ixpk= 1878, nxpk= 20, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 471, 472, 471, 472,
 &end
#
#    0 AMB  20-2:1885     0 AMB  20-1:1885   6.00    (#   1885:20  Double Ambig)
 &rst
  ixpk= 1885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1= 717, 718, 717, 718, 717, 718,
 igr2= 723, 724, 723, 724, 723, 724,
 &end
#
#   40 LEU  MDX           7 TYR  HB+         6.00    (#   1886:20  Unique         3.87, 7.23 A)
 &rst
  ixpk= 1886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 615, 616, 617, 619, 620, 621,
 igr2=  98,  99,
 &end
#
#    0 AMB  20-2:1887    46 LYS  HB-         8.00    (#   1887:20  Single Ambig)
 &rst
  ixpk= 1887, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 747,  62,
 igr2= 714, 715,
 &end
#
#   40 LEU  HA           38 LYS  HB-         8.00    (#   1888:20  Unique         5.35, 6.15 A)
 &rst
  ixpk= 1888, nxpk= 20, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 571, 572,
 &end
#
#   39 GLN  HN           38 LYS  HG+         8.00    (#   1889:20  Unique         3.38, 4.42 A)
 &rst
  ixpk= 1889, nxpk= 20, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 574, 575,
 &end
#
#   39 GLN  HN           38 LYS  HG-         8.00    (#   1890:20  Unique         3.38, 4.42 A)
 &rst
  ixpk= 1890, nxpk= 20, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 574, 575,
 &end
#
#   36 GLN  HN           38 LYS  HG-         8.00    (#   1891:20  Unique         4.05, 5.46 A)
 &rst
  ixpk= 1891, nxpk= 20, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 574, 575,
 &end
#
#   36 GLN  HN           38 LYS  HG+         8.00    (#   1892:20  Unique         4.05, 5.46 A)
 &rst
  ixpk= 1892, nxpk= 20, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 574, 575,
 &end
#
#   38 LYS  HE+          38 LYS  HG+         4.50    (#   1894:20  Unique         2.33, 3.20 A)
 &rst
  ixpk= 1894, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 580, 581,
 igr2= 574, 575,
 &end
#
#    6 LYS  HA            0 AMB  20-1:1895   6.00    (#   1895:20  Double Ambig)
 &rst
  ixpk= 1895, nxpk= 20, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2=  85,  86,  85,  86,
 &end
#
#    7 TYR  HD           40 LEU  HB-         8.00    (#   1897:20  Unique         2.55, 5.86 A)
 &rst
  ixpk= 1897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 102, 111,
 igr2= 610, 611,
 &end
#
#   39 GLN  HA           40 LEU  HB-         6.00    (#   1898:20  Unique         4.35, 5.30 A)
 &rst
  ixpk= 1898, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 610, 611,
 &end
#
#   40 LEU  HN           40 LEU  MDY         6.00    (#   1900:20  Unique         2.00, 3.95 A)
 &rst
  ixpk= 1900, nxpk= 20, iat= 606,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   43 PHE  HD           40 LEU  MDY         8.00    (#   1902:20  Unique         3.05, 7.32 A)
 &rst
  ixpk= 1902, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.10, r4=12.60,
 igr1= 660, 668,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   19 TRP  HH2          40 LEU  MDY         6.00    (#   1903:20  Unique         2.49, 4.65 A)
 &rst
  ixpk= 1903, nxpk= 20, iat= 291,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   29 ILE  MG2          40 LEU  MDY         4.50    (#   1906:20  Unique         2.41, 4.85 A)
 &rst
  ixpk= 1906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 429, 430, 431,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#   33 MET  HN           33 MET  ME          6.00    (#   1924:20  Unique         3.97, 5.46 A)
 &rst
  ixpk= 1924, nxpk= 20, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 507, 508, 509,
 &end
#
#    0 AMB  20-2:1949    25 THR  HA          6.00    (#   1949:20  Single Ambig)
 &rst
  ixpk= 1949, nxpk= 20, iat=  -1, 371, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 355, 356, 355, 356,
 &end
#
#   17 LYS  HG+          18 THR  HA          8.00    (#   1951:20  Single Ambig)
 &rst
  ixpk= 1951, nxpk= 20, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 247, 248,
 &end
#
#    0 AMB  20-2:1952    30 LYS  HA          8.00    (#   1952:20  Single Ambig)
 &rst
  ixpk= 1952, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 513, 369,
 &end
#
#   34 GLU  HN           31 LYS  HA          4.50    (#   1955:20  Unique         2.96, 3.24 A)
 &rst
  ixpk= 1955, nxpk= 20, iat= 513, 466, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1956    31 LYS  HA          6.00    (#   1956:20  Single Ambig)
 &rst
  ixpk= 1956, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 520, 521, 535, 536,
 &end
#
#   34 GLU  HB-          31 LYS  HA          6.00    (#   1957:20  Unique         2.30, 3.61 A)
 &rst
  ixpk= 1957, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 517, 518,
 &end
#
#   34 GLU  HB+          31 LYS  HA          6.00    (#   1958:20  Unique         2.30, 3.61 A)
 &rst
  ixpk= 1958, nxpk= 20, iat=  -1, 466, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 517, 518,
 &end
#
#   38 LYS  HG+          33 MET  HA          8.00    (#   1959:20  Unique         3.80, 5.13 A)
 &rst
  ixpk= 1959, nxpk= 20, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 574, 575,
 &end
#
#    0 AMB  20-2:1960     0 AMB  20-1:1960   3.50    (#   1960:20  Double Ambig)
 &rst
  ixpk= 1960, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 369, 766,
 igr2= 347, 768,
 &end
#
#    0 AMB  20-2:1961     6 LYS  HA          6.00    (#   1961:20  Single Ambig)
 &rst
  ixpk= 1961, nxpk= 20, iat=  -1,  74, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1=  66,  67,  68, 306, 307, 308,
 &end
#
#    0 AMB  20-2:1962    47 GLU  HA          6.00    (#   1962:20  Single Ambig)
 &rst
  ixpk= 1962, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 714, 715, 679, 676, 677,
 &end
#
#    0 AMB  20-2:1963    47 GLU  HA          6.00    (#   1963:20  Single Ambig)
 &rst
  ixpk= 1963, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 754, 751, 752, 676, 677,
 &end
#
#    9 TYR  HB+          29 ILE  MD1         6.00    (#   1974:20  Unique         2.26, 4.13 A)
 &rst
  ixpk= 1974, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 130, 131,
 igr2= 436, 437, 438,
 &end
#
#   34 GLU  HN           33 MET  ME          8.00    (#   1978:20  Unique         4.81, 6.56 A)
 &rst
  ixpk= 1978, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr2= 507, 508, 509,
 &end
#
#    0 AMB  20-2:1980     0 AMB  20-1:1980   4.50    (#   1980:20  Double Ambig)
 &rst
  ixpk= 1980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 766, 211, 747,
 igr2= 739, 740, 218, 219, 739, 740,
 &end
#
#    0 AMB  20-2:1981    24 ARG  HG-         3.50    (#   1981:20  Single Ambig)
 &rst
  ixpk= 1981, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 355, 356, 355, 356,
 igr2= 352, 353,
 &end
#
#    0 AMB  20-2:1982     0 AMB  20-1:1982   4.50    (#   1982:20  Double Ambig)
 &rst
  ixpk= 1982, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.69, r4=10.19,
 igr1=  34,  35,  34,  35,  34,  35, 355, 356, 355, 356,
      
 igr2=  31,  32,  31,  32,  31,  32, 352, 353, 352, 353,
      
 &end
#
#    0 AMB  20-2:1983    44 LEU  HG          3.50    (#   1983:20  Single Ambig)
 &rst
  ixpk= 1983, nxpk= 20, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#   44 LEU  HA           44 LEU  HG          6.00    (#   1987:20  Unique         2.54, 3.48 A)
 &rst
  ixpk= 1987, nxpk= 20, iat= 674, 679, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:1989     0 AMB  20-1:1989   3.50    (#   1989:20  Double Ambig)
 &rst
  ixpk= 1989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.63, r4= 9.13,
 igr1=  31,  32,  31,  32,  31,  32, 352, 353, 352, 353,
       349, 350, 349, 350, 349, 350,
 igr2=  34,  35,  34,  35,  34,  35, 355, 356, 355, 356,
       355, 356, 355, 356,
 &end
#
#   24 ARG  HG-           0 AMB  20-1:1990   4.50    (#   1990:20  Single Ambig)
 &rst
  ixpk= 1990, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 352, 353,
 igr2= 355, 356, 355, 356,
 &end
#
#    0 AMB  20-2:1991     0 AMB  20-1:1991   6.00    (#   1991:20  Double Ambig)
 &rst
  ixpk= 1991, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1=  28,  29,  28,  29,
 igr2=  34,  35,  34,  35,
 &end
#
#    2 ALA  HN            2 ALA  HA          8.00    (#   1994:20  Unique         2.25, 2.91 A)
 &rst
  ixpk= 1994, nxpk= 20, iat=  14,  16, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    2 ALA  HA            2 ALA  MB          4.50    (#   1995:20  Unique         2.41, 2.67 A)
 &rst
  ixpk= 1995, nxpk= 20, iat=  16,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  18,  19,  20,
 &end
#
#    1 ALA  HA            0 AMB  20-1:1996   4.50    (#   1996:20  Single Ambig)
 &rst
  ixpk= 1996, nxpk= 20, iat=   6,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=   8,   9,  10,  18,  19,  20,
 &end
#
#    0 AMB  20-2:1997     5 ALA  MB          4.50    (#   1997:20  Single Ambig)
 &rst
  ixpk= 1997, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 302,  58, 304,
 igr2=  66,  67,  68,
 &end
#
#    7 TYR  HE           40 LEU  HG          4.50    (#   1999:20  Unique         2.13, 4.92 A)
 &rst
  ixpk= 1999, nxpk= 20, iat=  -1, 613, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 104, 109,
 &end
#
#    3 ARG  HB-           0 AMB  20-1:2000   2.80    (#   2000:20  Single Ambig)
 &rst
  ixpk= 2000, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=  28,  29,
 igr2=  31,  32,  31,  32,
 &end
#
#    4 PRO  HD+           4 PRO  HB+         6.00    (#   2001:20  Unique         2.77, 3.67 A)
 &rst
  ixpk= 2001, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  49,  50,
 igr2=  55,  56,
 &end
#
#   15 GLU  HA           15 GLU  HB+         4.50    (#   2003:20  Unique         2.30, 2.54 A)
 &rst
  ixpk= 2003, nxpk= 20, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 215, 216,
 &end
#
#   15 GLU  HN           15 GLU  HB+         3.50    (#   2004:20  Unique         2.43, 3.04 A)
 &rst
  ixpk= 2004, nxpk= 20, iat= 211,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 215, 216,
 &end
#
#   16 THR  HN            0 AMB  20-1:2005   6.00    (#   2005:20  Single Ambig)
 &rst
  ixpk= 2005, nxpk= 20, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 215, 216, 215, 216,
 &end
#
#    8 SER  HB+          45 ILE  MD1         6.00    (#   2008:20  Unique         2.14, 3.73 A)
 &rst
  ixpk= 2008, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 119, 120,
 igr2= 704, 705, 706,
 &end
#
#    8 SER  HB-          45 ILE  MD1         6.00    (#   2009:20  Unique         2.14, 3.73 A)
 &rst
  ixpk= 2009, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 119, 120,
 igr2= 704, 705, 706,
 &end
#
#   24 ARG  HG-          24 ARG  HA          6.00    (#   2010:20  Unique         2.48, 3.18 A)
 &rst
  ixpk= 2010, nxpk= 20, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 352, 353,
 &end
#
#   16 THR  HN           15 GLU  HG+         6.00    (#   2015:20  Unique         3.51, 4.82 A)
 &rst
  ixpk= 2015, nxpk= 20, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 218, 219,
 &end
#
#    8 SER  HB+          18 THR  MG2         6.00    (#   2017:20  Unique         2.19, 3.86 A)
 &rst
  ixpk= 2017, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 119, 120,
 igr2= 268, 269, 270,
 &end
#
#   38 LYS  HE-           0 AMB  20-1:2019   6.00    (#   2019:20  Single Ambig)
 &rst
  ixpk= 2019, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 580, 581,
 igr2= 577, 578, 577, 578,
 &end
#
#    0 AMB  20-2:2020     0 AMB  20-1:2020   4.50    (#   2020:20  Double Ambig)
 &rst
  ixpk= 2020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 723, 724, 723, 724, 723, 724,
 igr2= 720, 721, 720, 721, 720, 721,
 &end
#
#    0 AMB  20-2:2021    17 LYS  HD-         4.50    (#   2021:20  Single Ambig)
 &rst
  ixpk= 2021, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 253, 254, 253, 254,
 igr2= 250, 251,
 &end
#
#   40 LEU  HB+          40 LEU  MDY         4.50    (#   2022:20  Unique         2.41, 3.44 A)
 &rst
  ixpk= 2022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 610, 611,
 igr2= 615, 616, 617, 619, 620, 621,
 &end
#
#    0 AMB  20-2:2023    14 GLY  HA-         6.00    (#   2023:20  Single Ambig)
 &rst
  ixpk= 2023, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.19, r4=10.69,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 igr2= 206, 207,
 &end
#
#    0 AMB  20-2:2024     0 AMB  20-1:2024   4.50    (#   2024:20  Double Ambig)
 &rst
  ixpk= 2024, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 igr2= 206, 207, 206, 207,
 &end
#
#   33 MET  HN           32 ALA  HA          6.00    (#   2025:20  Unique         3.60, 3.61 A)
 &rst
  ixpk= 2025, nxpk= 20, iat= 496, 488, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:2026     0 AMB  20-1:2026   6.00    (#   2026:20  Double Ambig)
 &rst
  ixpk= 2026, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 747, 766, 369,
 igr2= 754, 352, 353,
 &end
#
#    0 AMB  20-2:2027     0 AMB  20-1:2027   4.50    (#   2027:20  Double Ambig)
 &rst
  ixpk= 2027, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.69, r4=10.19,
 igr1=  34,  35,  34,  35,  34,  35, 355, 356, 355, 356,
      
 igr2=  31,  32,  31,  32,  31,  32, 352, 353, 352, 353,
      
 &end
#
#    0 AMB  20-2:2032    47 GLU  HG-         4.50    (#   2032:20  Single Ambig)
 &rst
  ixpk= 2032, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 736, 737, 770, 771, 770, 771,
 igr2= 739, 740,
 &end
#
#    0 AMB  20-2:2034    46 LYS  HA          6.00    (#   2034:20  Single Ambig)
 &rst
  ixpk= 2034, nxpk= 20, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 723, 724, 723, 724,
 &end
#
#   46 LYS  HB+          46 LYS  HA          4.50    (#   2035:20  Unique         2.43, 2.77 A)
 &rst
  ixpk= 2035, nxpk= 20, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 714, 715,
 &end
#
#   45 ILE  HG1-          0 AMB  20-1:2036   4.50    (#   2036:20  Single Ambig)
 &rst
  ixpk= 2036, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 701, 702,
 igr2=  74, 712,
 &end
#
#   31 LYS  HA            0 AMB  20-1:2038   6.00    (#   2038:20  Single Ambig)
 &rst
  ixpk= 2038, nxpk= 20, iat= 466,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 471, 472, 471, 472,
 &end
#
#    0 AMB  20-2:2039     0 AMB  20-1:2039   6.00    (#   2039:20  Double Ambig)
 &rst
  ixpk= 2039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 712,  74,
 igr2= 720, 721, 720, 721, 720, 721,
 &end
#
#    7 TYR  HD            7 TYR  HB+         6.00    (#   2040:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 2040, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 102, 111,
 igr2=  98,  99,
 &end
#
#    0 AMB  20-2:2041     0 AMB  20-1:2041   6.00    (#   2041:20  Double Ambig)
 &rst
  ixpk= 2041, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.00, r4=12.50,
 igr1=  76,  77, 701, 702,  76,  77,  76,  77,
 igr2=  98,  99,  98,  99, 723, 724, 723, 724,
 &end
#
#    8 SER  HB-          45 ILE  HG1-        6.00    (#   2042:20  Unique         3.38, 4.81 A)
 &rst
  ixpk= 2042, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 119, 120,
 igr2= 701, 702,
 &end
#
#    8 SER  HB-          45 ILE  HG1+        6.00    (#   2043:20  Unique         3.38, 4.81 A)
 &rst
  ixpk= 2043, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 119, 120,
 igr2= 701, 702,
 &end
#
#    0 AMB  20-2:2045    44 LEU  HA          6.00    (#   2045:20  Single Ambig)
 &rst
  ixpk= 2045, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=  98,  99, 656, 657,
 &end
#
#   17 LYS  HG+          17 LYS  HA          8.00    (#   2046:20  Unique         2.35, 3.15 A)
 &rst
  ixpk= 2046, nxpk= 20, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 247, 248,
 &end
#
#   17 LYS  HD+          17 LYS  HB-         6.00    (#   2047:20  Unique         2.39, 3.16 A)
 &rst
  ixpk= 2047, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 250, 251,
 igr2= 244, 245,
 &end
#
#   17 LYS  HD+          17 LYS  HB+         6.00    (#   2048:20  Unique         2.39, 3.16 A)
 &rst
  ixpk= 2048, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 250, 251,
 igr2= 244, 245,
 &end
#
#   19 TRP  HZ3           7 TYR  HB-         6.00    (#   2050:20  Unique         4.16, 4.69 A)
 &rst
  ixpk= 2050, nxpk= 20, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  98,  99,
 &end
#
#    6 LYS  HA            6 LYS  HG-         6.00    (#   2051:20  Single Ambig)
 &rst
  ixpk= 2051, nxpk= 20, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=  79,  80,
 &end
#
#    0 AMB  20-2:2052     0 AMB  20-1:2052   6.00    (#   2052:20  Double Ambig)
 &rst
  ixpk= 2052, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1=  85,  86,  85,  86,
 igr2=  79,  80,  79,  80,
 &end
#
#   21 GLY  HA-          22 GLN  HA          8.00    (#   2053:20  Unique         4.52, 4.66 A)
 &rst
  ixpk= 2053, nxpk= 20, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 316, 317,
 &end
#
#   24 ARG  HN           24 ARG  HG-         6.00    (#   2054:20  Unique         2.21, 3.62 A)
 &rst
  ixpk= 2054, nxpk= 20, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 352, 353,
 &end
#
#   48 LEU  MDX          48 LEU  HG          6.00    (#   2055:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 2055, nxpk= 20, iat=  -1, 754, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  20-2:2057     6 LYS  HG-         6.00    (#   2057:20  Single Ambig)
 &rst
  ixpk= 2057, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=  85,  86,  85,  86,
 igr2=  79,  80,
 &end
#
#   17 LYS  HN           10 VAL  HA          6.00    (#   2058:20  Unique         3.91, 4.14 A)
 &rst
  ixpk= 2058, nxpk= 20, iat= 240, 149, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  20-2:2059     0 AMB  20-1:2059   6.00    (#   2059:20  Double Ambig)
 &rst
  ixpk= 2059, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1=  24, 369,
 igr2=  28,  29, 349, 350, 349, 350,
 &end
#
#   24 ARG  HN            0 AMB  20-1:2060   6.00    (#   2060:20  Single Ambig)
 &rst
  ixpk= 2060, nxpk= 20, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr2= 349, 350, 349, 350,
 &end
#
#    0 AMB  20-2:2061     0 AMB  20-1:2061   6.00    (#   2061:20  Double Ambig)
 &rst
  ixpk= 2061, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1=  34,  35,  34,  35,
 igr2=  28,  29,  28,  29,
 &end
#
#    3 ARG  HB-           0 AMB  20-1:2062   6.00    (#   2062:20  Single Ambig)
 &rst
  ixpk= 2062, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=  28,  29,
 igr2=  34,  35,  34,  35,
 &end
#
#   45 ILE  HN            7 TYR  HA          4.50    (#   2066:20  Unique         2.81, 3.20 A)
 &rst
  ixpk= 2066, nxpk= 20, iat= 691,  96, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 LYS  HN            8 SER  HA          8.00    (#   2067:20  Unique         4.64, 4.76 A)
 &rst
  ixpk= 2067, nxpk= 20, iat= 240, 117, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    8 SER  HB+           8 SER  HA          4.50    (#   2068:20  Unique         2.38, 2.64 A)
 &rst
  ixpk= 2068, nxpk= 20, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 119, 120,
 &end
#
#    0 AMB  20-2:2069    12 GLU  HA          4.50    (#   2069:20  Single Ambig)
 &rst
  ixpk= 2069, nxpk= 20, iat=  -1, 177, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 190, 204,
 &end
#
#   17 LYS  HB-          17 LYS  HG-         4.50    (#   2077:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 2077, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 244, 245,
 igr2= 247, 248,
 &end
#
#   30 LYS  HG+          28 VAL  HA          6.00    (#   2078:20  Unique         5.92, 6.83 A)
 &rst
  ixpk= 2078, nxpk= 20, iat=  -1, 409, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 449, 450,
 &end
#
#   41 GLU  HG+          41 GLU  HA          4.50    (#   2082:20  Unique         2.43, 3.16 A)
 &rst
  ixpk= 2082, nxpk= 20, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 632, 633,
 &end
#
#   43 PHE  HZ           43 PHE  HE          3.50    (#   2086:20  Unique         2.47, 2.49 A)
 &rst
  ixpk= 2086, nxpk= 20, iat= 664,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 662, 666,
 &end
#
#   43 PHE  HD           43 PHE  HE          4.50    (#   2087:20  Unique         2.47, 3.73 A)
 &rst
  ixpk= 2087, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 660, 668,
 igr2= 662, 666,
 &end
#
#   17 LYS  HN            8 SER  HB+         8.00    (#   2088:20  Unique         3.96, 5.66 A)
 &rst
  ixpk= 2088, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 119, 120,
 &end
#
#    0 AMB  20-2:2089    16 THR  HA          8.00    (#   2089:20  Single Ambig)
 &rst
  ixpk= 2089, nxpk= 20, iat=  -1, 228, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 215, 216, 215, 216,
 &end
#
#   30 LYS  HG+          27 ALA  HA          6.00    (#   2093:20  Unique         3.57, 4.58 A)
 &rst
  ixpk= 2093, nxpk= 20, iat=  -1, 399, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 449, 450,
 &end
#
#   17 LYS  HG+          11 ASP  HB+         6.00    (#   2104:20  Unique         5.97, 7.39 A)
 &rst
  ixpk= 2104, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 247, 248,
 igr2= 167, 168,
 &end
#
#    0 AMB  20-2:2108     0 AMB  20-1:2108   4.50    (#   2108:20  Double Ambig)
 &rst
  ixpk= 2108, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 532, 533, 532, 533,
 igr2= 550, 551, 550, 551,
 &end
#
#   35 GLU  HN           34 GLU  HB-         4.50    (#   2111:20  Unique         2.52, 3.35 A)
 &rst
  ixpk= 2111, nxpk= 20, iat= 528,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 517, 518,
 &end
#
#    0 AMB  20-2:2122     5 ALA  HA          3.50    (#   2122:20  Single Ambig)
 &rst
  ixpk= 2122, nxpk= 20, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 302, 304,
 &end
#
#    0 AMB  20-2:2126     0 AMB  20-1:2126   6.00    (#   2126:20  Double Ambig)
 &rst
  ixpk= 2126, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 293, 104, 109,
 igr2=  98,  99,  98,  99,
 &end
#
#   17 LYS  HN            8 SER  HB-         8.00    (#   2128:20  Unique         3.96, 5.66 A)
 &rst
  ixpk= 2128, nxpk= 20, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 119, 120,
 &end
#
#   17 LYS  HG+          11 ASP  HB-         8.00    (#   2145:20  Unique         5.97, 7.39 A)
 &rst
  ixpk= 2145, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 247, 248,
 igr2= 167, 168,
 &end
#
#    9 TYR  HA           16 THR  MG2         6.00    (#   2157:20  Unique         5.18, 7.28 A)
 &rst
  ixpk= 2157, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 232, 233, 234,
 &end
#
#    9 TYR  HN           18 THR  MG2         6.00    (#   2168:20  Unique         4.03, 5.20 A)
 &rst
  ixpk= 2168, nxpk= 20, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 268, 269, 270,
 &end
#
#   22 GLN  HA           23 GLY  HA+         6.00    (#   2182:20  Unique         4.49, 4.57 A)
 &rst
  ixpk= 2182, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 340, 341,
 &end
#
#   28 VAL  HB           26 PRO  HA          8.00    (#   2188:20  Unique         5.98, 6.54 A)
 &rst
  ixpk= 2188, nxpk= 20, iat= 411, 393, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    0 AMB  20-2:2199     0 AMB  20-1:2199   3.50    (#   2199:20  Double Ambig)
 &rst
  ixpk= 2199, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 449, 450, 449, 450,
 igr2= 468, 469, 468, 469,
 &end
#
#    0 AMB  20-2:2201     0 AMB  20-1:2201   6.00    (#   2201:20  Double Ambig)
 &rst
  ixpk= 2201, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
 igr1= 477, 478, 477, 478, 477, 478,
 igr2= 471, 472, 471, 472, 471, 472,
 &end
#
#    0 AMB  20-2:2203     0 AMB  20-1:2203   2.80    (#   2203:20  Double Ambig)
 &rst
  ixpk= 2203, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 503, 504, 503, 504, 520, 521, 520, 521,
 igr2= 500, 501, 500, 501, 500, 501,
 &end
#
#    0 AMB  20-2:2205    39 GLN  HA          8.00    (#   2205:20  Single Ambig)
 &rst
  ixpk= 2205, nxpk= 20, iat=  -1, 591, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 593, 594, 596, 597, 596, 597,
 &end
#
#    0 AMB  20-2:2208     0 AMB  20-1:2208   4.50    (#   2208:20  Double Ambig)
 &rst
  ixpk= 2208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 601, 602, 601, 602,
 igr2= 596, 597, 596, 597,
 &end
#
#    0 AMB  20-2:2211     0 AMB  20-1:2211   3.50    (#   2211:20  Double Ambig)
 &rst
  ixpk= 2211, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1= 679, 676, 677, 610, 611,
 igr2= 629, 630, 629, 630, 629, 630, 629, 630,
 &end
#
#    0 AMB  20-2:2212     0 AMB  20-1:2212   3.50    (#   2212:20  Double Ambig)
 &rst
  ixpk= 2212, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 593, 594, 593, 594,
 igr2= 629, 630, 629, 630,
 &end
#
#   38 LYS  HE-          42 ASP  HB+         3.50    (#   2216:20  Unique         2.54, 3.81 A)
 &rst
  ixpk= 2216, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 580, 581,
 igr2= 644, 645,
 &end
#
#    7 TYR  HE           44 LEU  HG          6.00    (#   2222:20  Unique         2.71, 5.30 A)
 &rst
  ixpk= 2222, nxpk= 20, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 104, 109,
 &end
#
#   16 THR  HA            0 AMB  20-1:2225   4.50    (#   2225:20  Single Ambig)
 &rst
  ixpk= 2225, nxpk= 20, iat= 228,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   39 GLN  HA           40 LEU  HN          2.80    (#      2:10  Unique         2.32, 2.48 A)
 &rst
  ixpk= 2, nxpk= 10, iat= 591, 606, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   40 LEU  HA           40 LEU  HN          2.80    (#      3:10  Unique         2.77, 2.82 A)
 &rst
  ixpk= 3, nxpk= 10, iat= 608, 606, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:4       40 LEU  HN          2.80    (#      4:10  Single Ambig)
 &rst
  ixpk= 4, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 593, 594, 596, 597, 596, 597,
 &end
#
#   33 MET  ME           40 LEU  HN          4.50    (#      5:10  Unique         2.77, 4.70 A)
 &rst
  ixpk= 5, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 507, 508, 509,
 &end
#
#   39 GLN  HB+          40 LEU  HN          4.50    (#      6:10  Unique         2.28, 3.01 A)
 &rst
  ixpk= 6, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 593, 594,
 &end
#
#   40 LEU  HB+          40 LEU  HN          2.80    (#      7:10  Unique         2.07, 2.92 A)
 &rst
  ixpk= 7, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 610, 611,
 &end
#
#   44 LEU  HA           45 ILE  HN          2.80    (#      8:10  Unique         2.07, 2.18 A)
 &rst
  ixpk= 8, nxpk= 10, iat= 674, 691, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   45 ILE  HA           45 ILE  HN          3.50    (#      9:10  Unique         2.96, 3.00 A)
 &rst
  ixpk= 9, nxpk= 10, iat= 693, 691, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:10      45 ILE  HN          3.50    (#     10:10  Single Ambig)
 &rst
  ixpk= 10, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 676, 677, 695,
 &end
#
#   45 ILE  HG1-         45 ILE  HN          2.80    (#     11:10  Unique         1.88, 2.76 A)
 &rst
  ixpk= 11, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 701, 702,
 &end
#
#   45 ILE  HG1+         45 ILE  HN          4.50    (#     12:10  Unique         1.88, 2.76 A)
 &rst
  ixpk= 12, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 701, 702,
 &end
#
#    0 AMB  10-2:13      45 ILE  HN          4.50    (#     13:10  Single Ambig)
 &rst
  ixpk= 13, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 697, 698, 699,  79,  80,
 &end
#
#    0 AMB  10-2:14      45 ILE  HN          3.50    (#     14:10  Single Ambig)
 &rst
  ixpk= 14, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#    4 PRO  HA            5 ALA  HN          2.80    (#     16:10  Unique         2.22, 2.36 A)
 &rst
  ixpk= 16, nxpk= 10, iat=  58,  62, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    5 ALA  HA            5 ALA  HN          4.50    (#     17:10  Unique         2.87, 2.92 A)
 &rst
  ixpk= 17, nxpk= 10, iat=  64,  62, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    4 PRO  HB+           5 ALA  HN          6.00    (#     18:10  Unique         2.52, 3.21 A)
 &rst
  ixpk= 18, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  55,  56,
 &end
#
#    5 ALA  MB            5 ALA  HN          2.80    (#     19:10  Unique         2.46, 3.29 A)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  66,  67,  68,
 &end
#
#    0 AMB  10-2:21      48 LEU  HN          2.80    (#     21:10  Single Ambig)
 &rst
  ixpk= 21, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 749, 734,
 &end
#
#    0 AMB  10-2:22      48 LEU  HN          2.80    (#     22:10  Single Ambig)
 &rst
  ixpk= 22, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 754, 751, 752,
 &end
#
#   11 ASP  HN           15 GLU  HN          6.00    (#     23:10  Unique         4.94, 5.59 A)
 &rst
  ixpk= 23, nxpk= 10, iat= 163, 211, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   15 GLU  HA           15 GLU  HN          2.80    (#     24:10  Unique         2.77, 2.84 A)
 &rst
  ixpk= 24, nxpk= 10, iat= 213, 211, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   14 GLY  HA+          15 GLU  HN          3.50    (#     25:10  Unique         2.22, 2.63 A)
 &rst
  ixpk= 25, nxpk= 10, iat=  -1, 211, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 206, 207,
 &end
#
#    0 AMB  10-2:26      15 GLU  HN          6.00    (#     26:10  Single Ambig)
 &rst
  ixpk= 26, nxpk= 10, iat=  -1, 211, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 194, 195, 194, 195,
 &end
#
#   15 GLU  HG-          15 GLU  HN          4.50    (#     27:10  Unique         1.99, 3.09 A)
 &rst
  ixpk= 27, nxpk= 10, iat=  -1, 211, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 218, 219,
 &end
#
#    0 AMB  10-2:28      15 GLU  HN          2.80    (#     28:10  Single Ambig)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1, 211, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 215, 216, 215, 216,
 &end
#
#    0 AMB  10-2:29      15 GLU  HN          6.00    (#     29:10  Single Ambig)
 &rst
  ixpk= 29, nxpk= 10, iat=  -1, 211, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   15 GLU  HG+          15 GLU  HN          3.50    (#     30:10  Unique         1.99, 3.09 A)
 &rst
  ixpk= 30, nxpk= 10, iat=  -1, 211, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 218, 219,
 &end
#
#   43 PHE  HN           44 LEU  HN          2.80    (#     31:10  Unique         1.89, 2.09 A)
 &rst
  ixpk= 31, nxpk= 10, iat= 652, 672, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   44 LEU  HA           44 LEU  HN          3.50    (#     32:10  Unique         2.82, 2.85 A)
 &rst
  ixpk= 32, nxpk= 10, iat= 674, 672, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 GLU  HA           44 LEU  HN          4.50    (#     33:10  Unique         2.62, 2.90 A)
 &rst
  ixpk= 33, nxpk= 10, iat= 627, 672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:34      44 LEU  HN          2.80    (#     34:10  Single Ambig)
 &rst
  ixpk= 34, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 676, 677, 679,
 &end
#
#   44 LEU  HB+          44 LEU  HN          2.80    (#     35:10  Unique         2.02, 2.65 A)
 &rst
  ixpk= 35, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 676, 677,
 &end
#
#    0 AMB  10-2:36      47 GLU  HN          3.50    (#     36:10  Single Ambig)
 &rst
  ixpk= 36, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 712,  74,
 &end
#
#   47 GLU  HB-          47 GLU  HN          3.50    (#     37:10  Unique         2.19, 3.15 A)
 &rst
  ixpk= 37, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 736, 737,
 &end
#
#   47 GLU  HB+          47 GLU  HN          2.80    (#     38:10  Unique         2.19, 3.15 A)
 &rst
  ixpk= 38, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 736, 737,
 &end
#
#   24 ARG  HA           25 THR  HN          2.80    (#     40:10  Unique         2.14, 2.20 A)
 &rst
  ixpk= 40, nxpk= 10, iat= 347, 369, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   25 THR  HB           25 THR  HN          2.80    (#     41:10  Unique         2.57, 2.62 A)
 &rst
  ixpk= 41, nxpk= 10, iat= 373, 369, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   25 THR  HA           25 THR  HN          3.50    (#     42:10  Unique         2.74, 2.80 A)
 &rst
  ixpk= 42, nxpk= 10, iat= 371, 369, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:43      25 THR  HN          2.80    (#     43:10  Single Ambig)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 349, 350, 349, 350, 352, 353,
 &end
#
#   18 THR  HA           19 TRP  HN          2.80    (#     45:10  Unique         2.31, 2.35 A)
 &rst
  ixpk= 45, nxpk= 10, iat= 264, 276, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   18 THR  HB           19 TRP  HN          3.50    (#     46:10  Unique         2.40, 2.48 A)
 &rst
  ixpk= 46, nxpk= 10, iat= 266, 276, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:47      19 TRP  HN          4.50    (#     47:10  Single Ambig)
 &rst
  ixpk= 47, nxpk= 10, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 280, 281,  98,  99,
 &end
#
#   23 GLY  HA-          24 ARG  HN          2.80    (#     49:10  Unique         2.17, 2.66 A)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1, 345, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 340, 341,
 &end
#
#   23 GLY  HA+          24 ARG  HN          2.80    (#     50:10  Unique         2.17, 2.66 A)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1, 345, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 340, 341,
 &end
#
#    0 AMB  10-2:51      24 ARG  HN          2.80    (#     51:10  Single Ambig)
 &rst
  ixpk= 51, nxpk= 10, iat=  -1, 345, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 352, 353, 349, 350, 349, 350,
 &end
#
#   24 ARG  HA           24 ARG  HN          4.50    (#     52:10  Unique         2.84, 2.89 A)
 &rst
  ixpk= 52, nxpk= 10, iat= 347, 345, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    2 ALA  HA            3 ARG  HN          3.50    (#     54:10  Unique         2.38, 2.73 A)
 &rst
  ixpk= 54, nxpk= 10, iat=  16,  24, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:55       3 ARG  HN          4.50    (#     55:10  Single Ambig)
 &rst
  ixpk= 55, nxpk= 10, iat=  -1,  24, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  31,  32,  31,  32,  28,  29,
 &end
#
#   33 MET  HN           32 ALA  HN          2.80    (#     56:10  Unique         2.78, 2.83 A)
 &rst
  ixpk= 56, nxpk= 10, iat= 496, 486, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   31 LYS  HN           32 ALA  HN          2.80    (#     57:10  Unique         2.80, 2.82 A)
 &rst
  ixpk= 57, nxpk= 10, iat= 464, 486, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   32 ALA  HA           32 ALA  HN          2.80    (#     58:10  Unique         2.84, 2.86 A)
 &rst
  ixpk= 58, nxpk= 10, iat= 488, 486, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:59      32 ALA  HN          2.80    (#     59:10  Single Ambig)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 468, 469, 468, 469,
 &end
#
#   32 ALA  MB           32 ALA  HN          2.80    (#     60:10  Unique         2.39, 2.86 A)
 &rst
  ixpk= 60, nxpk= 10, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 490, 491, 492,
 &end
#
#    9 TYR  HA           10 VAL  HN          2.80    (#     61:10  Unique         2.29, 2.38 A)
 &rst
  ixpk= 61, nxpk= 10, iat= 128, 147, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   10 VAL  HA           10 VAL  HN          3.50    (#     62:10  Unique         2.95, 2.98 A)
 &rst
  ixpk= 62, nxpk= 10, iat= 149, 147, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 TYR  HB-          10 VAL  HN          2.80    (#     63:10  Unique         2.11, 2.97 A)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 130, 131,
 &end
#
#    9 TYR  HB+          10 VAL  HN          2.80    (#     64:10  Unique         2.11, 2.97 A)
 &rst
  ixpk= 64, nxpk= 10, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 130, 131,
 &end
#
#   10 VAL  HB           10 VAL  HN          3.50    (#     65:10  Unique         2.44, 2.81 A)
 &rst
  ixpk= 65, nxpk= 10, iat= 151, 147, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:66      10 VAL  HN          2.80    (#     66:10  Single Ambig)
 &rst
  ixpk= 66, nxpk= 10, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   16 THR  HA           16 THR  HN          2.80    (#     67:10  Unique         2.81, 2.94 A)
 &rst
  ixpk= 67, nxpk= 10, iat= 228, 226, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 GLU  HA           16 THR  HN          2.80    (#     68:10  Unique         2.07, 2.15 A)
 &rst
  ixpk= 68, nxpk= 10, iat= 213, 226, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   16 THR  HB           16 THR  HN          2.80    (#     69:10  Unique         2.24, 2.46 A)
 &rst
  ixpk= 69, nxpk= 10, iat= 230, 226, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:70      16 THR  HN          2.80    (#     70:10  Single Ambig)
 &rst
  ixpk= 70, nxpk= 10, iat=  -1, 226, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1= 215, 216, 215, 216, 151,
 &end
#
#    0 AMB  10-2:72      49 GLU  HN          2.80    (#     72:10  Single Ambig)
 &rst
  ixpk= 72, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 749, 734,
 &end
#
#   49 GLU  HA           49 GLU  HN          3.50    (#     73:10  Unique         2.73, 2.93 A)
 &rst
  ixpk= 73, nxpk= 10, iat= 768, 766, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:74      49 GLU  HN          2.80    (#     74:10  Single Ambig)
 &rst
  ixpk= 74, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 770, 771, 770, 771,
 &end
#
#   31 LYS  HN           30 LYS  HN          2.80    (#     75:10  Unique         2.88, 2.97 A)
 &rst
  ixpk= 75, nxpk= 10, iat= 464, 442, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:76      30 LYS  HN          2.80    (#     76:10  Single Ambig)
 &rst
  ixpk= 76, nxpk= 10, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 444, 399,
 &end
#
#   30 LYS  HB-          30 LYS  HN          2.80    (#     77:10  Unique         2.18, 2.49 A)
 &rst
  ixpk= 77, nxpk= 10, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 446, 447,
 &end
#
#   30 LYS  HB+          30 LYS  HN          2.80    (#     78:10  Unique         2.18, 2.49 A)
 &rst
  ixpk= 78, nxpk= 10, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 446, 447,
 &end
#
#   29 ILE  HB           30 LYS  HN          3.50    (#     79:10  Unique         2.43, 2.57 A)
 &rst
  ixpk= 79, nxpk= 10, iat= 427, 442, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 THR  MG2          30 LYS  HN          3.50    (#     80:10  Unique         2.48, 3.50 A)
 &rst
  ixpk= 80, nxpk= 10, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 375, 376, 377,
 &end
#
#    9 TYR  HD            9 TYR  HN          2.80    (#     81:10  Unique         2.91, 3.90 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 134, 143,
 &end
#
#    8 SER  HA            9 TYR  HN          2.80    (#     82:10  Unique         2.25, 2.33 A)
 &rst
  ixpk= 82, nxpk= 10, iat= 117, 126, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    9 TYR  HA            9 TYR  HN          3.50    (#     83:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 83, nxpk= 10, iat= 128, 126, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 SER  HB-           9 TYR  HN          3.50    (#     84:10  Unique         2.25, 3.59 A)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 119, 120,
 &end
#
#    7 TYR  HN            6 LYS  HN          2.80    (#     85:10  Unique         1.78, 1.83 A)
 &rst
  ixpk= 85, nxpk= 10, iat=  94,  72, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 LYS  HA            6 LYS  HN          2.80    (#     86:10  Single Ambig)
 &rst
  ixpk= 86, nxpk= 10, iat=  74,  72, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    5 ALA  HA            6 LYS  HN          2.80    (#     87:10  Unique         2.23, 2.34 A)
 &rst
  ixpk= 87, nxpk= 10, iat=  64,  72, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 LYS  HB-           6 LYS  HN          2.80    (#     88:10  Unique         2.67, 3.22 A)
 &rst
  ixpk= 88, nxpk= 10, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  76,  77,
 &end
#
#    5 ALA  MB            6 LYS  HN          2.80    (#     89:10  Unique         2.45, 3.38 A)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  66,  67,  68,
 &end
#
#    0 AMB  10-2:91      42 ASP  HN          4.50    (#     91:10  Single Ambig)
 &rst
  ixpk= 91, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 589, 606,
 &end
#
#   41 GLU  HN           42 ASP  HN          2.80    (#     92:10  Unique         2.87, 2.94 A)
 &rst
  ixpk= 92, nxpk= 10, iat= 625, 640, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   43 PHE  HN           42 ASP  HN          2.80    (#     93:10  Unique         2.39, 2.56 A)
 &rst
  ixpk= 93, nxpk= 10, iat= 652, 640, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   42 ASP  HA           42 ASP  HN          2.80    (#     94:10  Unique         2.89, 2.91 A)
 &rst
  ixpk= 94, nxpk= 10, iat= 642, 640, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:95      42 ASP  HN          3.50    (#     95:10  Single Ambig)
 &rst
  ixpk= 95, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 627, 608,
 &end
#
#   42 ASP  HB-          42 ASP  HN          2.80    (#     96:10  Unique         2.38, 2.70 A)
 &rst
  ixpk= 96, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 644, 645,
 &end
#
#   42 ASP  HB+          42 ASP  HN          2.80    (#     97:10  Unique         2.38, 2.70 A)
 &rst
  ixpk= 97, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 644, 645,
 &end
#
#    0 AMB  10-2:98      42 ASP  HN          3.50    (#     98:10  Single Ambig)
 &rst
  ixpk= 98, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 629, 630, 629, 630, 571, 572,
 &end
#
#   39 GLN  HB+          42 ASP  HN          4.50    (#     99:10  Unique         3.66, 4.33 A)
 &rst
  ixpk= 99, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 593, 594,
 &end
#
#   39 GLN  HA           39 GLN  HN          3.50    (#    100:10  Unique         2.97, 2.99 A)
 &rst
  ixpk= 100, nxpk= 10, iat= 591, 589, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 LYS  HA           39 GLN  HN          2.80    (#    101:10  Unique         2.33, 2.41 A)
 &rst
  ixpk= 101, nxpk= 10, iat= 569, 589, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:102     39 GLN  HN          2.80    (#    102:10  Single Ambig)
 &rst
  ixpk= 102, nxpk= 10, iat=  -1, 589, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 593, 594, 596, 597, 596, 597,
 &end
#
#   38 LYS  HB-          39 GLN  HN          2.80    (#    103:10  Unique         2.17, 2.93 A)
 &rst
  ixpk= 103, nxpk= 10, iat=  -1, 589, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 571, 572,
 &end
#
#   39 GLN  HB+          39 GLN  HN          2.80    (#    104:10  Unique         2.59, 3.25 A)
 &rst
  ixpk= 104, nxpk= 10, iat=  -1, 589, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 593, 594,
 &end
#
#   11 ASP  HB-          12 GLU  HN          2.80    (#    105:10  Unique         2.36, 3.24 A)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 167, 168,
 &end
#
#   11 ASP  HB+          12 GLU  HN          3.50    (#    106:10  Unique         2.36, 3.24 A)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 167, 168,
 &end
#
#    0 AMB  10-2:107     12 GLU  HN          3.50    (#    107:10  Single Ambig)
 &rst
  ixpk= 107, nxpk= 10, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 182, 183, 182, 183,
 &end
#
#   12 GLU  HA           12 GLU  HN          3.50    (#    109:10  Unique         2.82, 2.90 A)
 &rst
  ixpk= 109, nxpk= 10, iat= 177, 175, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 GLU  HB-          12 GLU  HN          3.50    (#    110:10  Unique         2.28, 3.06 A)
 &rst
  ixpk= 110, nxpk= 10, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 179, 180,
 &end
#
#   12 GLU  HB+          12 GLU  HN          2.80    (#    111:10  Unique         2.28, 3.06 A)
 &rst
  ixpk= 111, nxpk= 10, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 179, 180,
 &end
#
#    6 LYS  HN            7 TYR  HN          2.80    (#    112:10  Unique         1.78, 1.83 A)
 &rst
  ixpk= 112, nxpk= 10, iat=  72,  94, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 LYS  HA            7 TYR  HN          3.50    (#    113:10  Single Ambig)
 &rst
  ixpk= 113, nxpk= 10, iat=  74,  94, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:114      7 TYR  HN          3.50    (#    114:10  Single Ambig)
 &rst
  ixpk= 114, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  98,  99, 280, 281,
 &end
#
#    7 TYR  HB+           7 TYR  HN          3.50    (#    115:10  Unique         2.73, 3.37 A)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  98,  99,
 &end
#
#   35 GLU  HN           34 GLU  HN          2.80    (#    116:10  Unique         2.59, 2.78 A)
 &rst
  ixpk= 116, nxpk= 10, iat= 528, 513, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   33 MET  HA           34 GLU  HN          4.50    (#    117:10  Unique         3.59, 3.60 A)
 &rst
  ixpk= 117, nxpk= 10, iat= 498, 513, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 GLU  HA           34 GLU  HN          2.80    (#    118:10  Unique         2.86, 2.88 A)
 &rst
  ixpk= 118, nxpk= 10, iat= 515, 513, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   34 GLU  HG-          34 GLU  HN          2.80    (#    119:10  Unique         2.23, 3.02 A)
 &rst
  ixpk= 119, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 520, 521,
 &end
#
#   34 GLU  HG+          34 GLU  HN          2.80    (#    120:10  Unique         2.23, 3.02 A)
 &rst
  ixpk= 120, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 520, 521,
 &end
#
#    0 AMB  10-2:121     34 GLU  HN          2.80    (#    121:10  Single Ambig)
 &rst
  ixpk= 121, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 517, 518, 500, 501, 500, 501,
 &end
#
#    0 AMB  10-2:122     22 GLN  HN          3.50    (#    122:10  Single Ambig)
 &rst
  ixpk= 122, nxpk= 10, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 328, 329, 328, 329,
 &end
#
#   22 GLN  HB-          22 GLN  HN          4.50    (#    123:10  Unique         2.38, 3.11 A)
 &rst
  ixpk= 123, nxpk= 10, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 325, 326,
 &end
#
#   22 GLN  HA           22 GLN  HN          4.50    (#    125:10  Unique         2.89, 2.96 A)
 &rst
  ixpk= 125, nxpk= 10, iat= 323, 321, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 GLN  HB+          22 GLN  HN          2.80    (#    126:10  Unique         2.38, 3.11 A)
 &rst
  ixpk= 126, nxpk= 10, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 325, 326,
 &end
#
#   32 ALA  HA           33 MET  HN          6.00    (#    127:10  Unique         3.60, 3.61 A)
 &rst
  ixpk= 127, nxpk= 10, iat= 488, 496, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   33 MET  HG+          33 MET  HN          2.80    (#    128:10  Unique         2.32, 3.01 A)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 503, 504,
 &end
#
#   32 ALA  HN           33 MET  HN          2.80    (#    129:10  Unique         2.78, 2.83 A)
 &rst
  ixpk= 129, nxpk= 10, iat= 486, 496, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   33 MET  HA           33 MET  HN          2.80    (#    130:10  Unique         2.86, 2.89 A)
 &rst
  ixpk= 130, nxpk= 10, iat= 498, 496, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   33 MET  HG-          33 MET  HN          2.80    (#    131:10  Unique         2.32, 3.01 A)
 &rst
  ixpk= 131, nxpk= 10, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 503, 504,
 &end
#
#    0 AMB  10-2:132     33 MET  HN          2.80    (#    132:10  Single Ambig)
 &rst
  ixpk= 132, nxpk= 10, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 500, 501, 500, 501,
 &end
#
#   32 ALA  MB           33 MET  HN          2.80    (#    133:10  Unique         2.68, 3.54 A)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 490, 491, 492,
 &end
#
#   30 LYS  HN           31 LYS  HN          2.80    (#    134:10  Unique         2.88, 2.97 A)
 &rst
  ixpk= 134, nxpk= 10, iat= 442, 464, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   32 ALA  HN           31 LYS  HN          2.80    (#    135:10  Unique         2.80, 2.82 A)
 &rst
  ixpk= 135, nxpk= 10, iat= 486, 464, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   31 LYS  HA           31 LYS  HN          2.80    (#    136:10  Unique         2.85, 2.88 A)
 &rst
  ixpk= 136, nxpk= 10, iat= 466, 464, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:137     31 LYS  HN          2.80    (#    137:10  Single Ambig)
 &rst
  ixpk= 137, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 446, 447, 449, 450,
 &end
#
#    0 AMB  10-2:138     31 LYS  HN          4.50    (#    138:10  Single Ambig)
 &rst
  ixpk= 138, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 444, 399,
 &end
#
#    0 AMB  10-2:139     31 LYS  HN          2.80    (#    139:10  Single Ambig)
 &rst
  ixpk= 139, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 468, 469, 468, 469,
 &end
#
#    0 AMB  10-2:140     38 LYS  HN          2.80    (#    140:10  Single Ambig)
 &rst
  ixpk= 140, nxpk= 10, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 498, 569,
 &end
#
#    0 AMB  10-2:141     38 LYS  HN          3.50    (#    141:10  Single Ambig)
 &rst
  ixpk= 141, nxpk= 10, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 562, 563, 562, 563,
 &end
#
#   38 LYS  HB-          38 LYS  HN          4.50    (#    142:10  Unique         2.26, 3.03 A)
 &rst
  ixpk= 142, nxpk= 10, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 571, 572,
 &end
#
#   38 LYS  HG+          38 LYS  HN          3.50    (#    143:10  Unique         2.21, 3.13 A)
 &rst
  ixpk= 143, nxpk= 10, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 574, 575,
 &end
#
#   38 LYS  HG-          38 LYS  HN          2.80    (#    144:10  Unique         2.21, 3.13 A)
 &rst
  ixpk= 144, nxpk= 10, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 574, 575,
 &end
#
#   37 GLY  HN           38 LYS  HN          2.80    (#    145:10  Unique         2.72, 2.82 A)
 &rst
  ixpk= 145, nxpk= 10, iat= 560, 567, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   42 ASP  HN           43 PHE  HN          2.80    (#    146:10  Unique         2.39, 2.56 A)
 &rst
  ixpk= 146, nxpk= 10, iat= 640, 652, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   43 PHE  HD           43 PHE  HN          2.80    (#    147:10  Unique         2.28, 3.77 A)
 &rst
  ixpk= 147, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 660, 668,
 &end
#
#   44 LEU  HN           43 PHE  HN          2.80    (#    148:10  Unique         1.89, 2.09 A)
 &rst
  ixpk= 148, nxpk= 10, iat= 672, 652, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   43 PHE  HB+          43 PHE  HN          2.80    (#    149:10  Unique         2.46, 3.12 A)
 &rst
  ixpk= 149, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 656, 657,
 &end
#
#   13 ASN  HA           13 ASN  HN          2.80    (#    150:10  Unique         2.85, 2.92 A)
 &rst
  ixpk= 150, nxpk= 10, iat= 192, 190, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   12 GLU  HA           13 ASN  HN          4.50    (#    151:10  Unique         3.47, 3.54 A)
 &rst
  ixpk= 151, nxpk= 10, iat= 177, 190, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:152     13 ASN  HN          2.80    (#    152:10  Single Ambig)
 &rst
  ixpk= 152, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 194, 195, 194, 195,
 &end
#
#    0 AMB  10-2:153     13 ASN  HN          4.50    (#    153:10  Single Ambig)
 &rst
  ixpk= 153, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 182, 183, 182, 183,
 &end
#
#    7 TYR  HA            8 SER  HN          2.80    (#    154:10  Unique         2.28, 2.35 A)
 &rst
  ixpk= 154, nxpk= 10, iat=  96, 115, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:155      8 SER  HN          4.50    (#    155:10  Single Ambig)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1, 115, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  98,  99, 656, 657,
 &end
#
#   35 GLU  HA           35 GLU  HN          3.50    (#    156:10  Unique         2.95, 2.98 A)
 &rst
  ixpk= 156, nxpk= 10, iat= 530, 528, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 VAL  HA           28 VAL  HN          2.80    (#    158:10  Unique         2.87, 2.88 A)
 &rst
  ixpk= 158, nxpk= 10, iat= 409, 407, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   28 VAL  HB           28 VAL  HN          2.80    (#    159:10  Unique         2.49, 2.54 A)
 &rst
  ixpk= 159, nxpk= 10, iat= 411, 407, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   27 ALA  MB           28 VAL  HN          2.80    (#    160:10  Unique         2.61, 3.44 A)
 &rst
  ixpk= 160, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 401, 402, 403,
 &end
#
#   28 VAL  MGY          28 VAL  HN          2.80    (#    161:10  Unique         2.19, 3.86 A)
 &rst
  ixpk= 161, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#   28 VAL  MGX          28 VAL  HN          4.50    (#    162:10  Unique         2.19, 3.86 A)
 &rst
  ixpk= 162, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#   34 GLU  HN           35 GLU  HN          2.80    (#    163:10  Unique         2.59, 2.78 A)
 &rst
  ixpk= 163, nxpk= 10, iat= 513, 528, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   36 GLN  HN           35 GLU  HN          2.80    (#    164:10  Unique         2.24, 2.36 A)
 &rst
  ixpk= 164, nxpk= 10, iat= 543, 528, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:165     35 GLU  HN          2.80    (#    165:10  Single Ambig)
 &rst
  ixpk= 165, nxpk= 10, iat=  -1, 528, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 535, 536, 550, 551,
 &end
#
#    0 AMB  10-2:166     35 GLU  HN          2.80    (#    166:10  Single Ambig)
 &rst
  ixpk= 166, nxpk= 10, iat=  -1, 528, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 535, 536, 520, 521,
 &end
#
#    0 AMB  10-2:167     35 GLU  HN          2.80    (#    167:10  Single Ambig)
 &rst
  ixpk= 167, nxpk= 10, iat=  -1, 528, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 532, 533, 532, 533, 517, 518,
 &end
#
#   19 TRP  HD1          19 TRP  HE1         2.80    (#    168:10  Unique         2.56, 2.57 A)
 &rst
  ixpk= 168, nxpk= 10, iat= 284, 286, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   35 GLU  HN           36 GLN  HN          2.80    (#    170:10  Unique         2.24, 2.36 A)
 &rst
  ixpk= 170, nxpk= 10, iat= 528, 543, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   36 GLN  HA           36 GLN  HN          3.50    (#    171:10  Unique         2.99, 3.00 A)
 &rst
  ixpk= 171, nxpk= 10, iat= 545, 543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 ALA  HA           36 GLN  HN          4.50    (#    172:10  Unique         3.06, 3.34 A)
 &rst
  ixpk= 172, nxpk= 10, iat= 488, 543, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:173     36 GLN  HN          2.80    (#    173:10  Single Ambig)
 &rst
  ixpk= 173, nxpk= 10, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 547, 548, 550, 551, 535, 536,
 &end
#
#    0 AMB  10-2:174     36 GLN  HN          2.80    (#    174:10  Single Ambig)
 &rst
  ixpk= 174, nxpk= 10, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 547, 548, 550, 551,
 &end
#
#    0 AMB  10-2:175     36 GLN  HN          2.80    (#    175:10  Single Ambig)
 &rst
  ixpk= 175, nxpk= 10, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 532, 533, 532, 533,
 &end
#
#    0 AMB  10-2:177     13 ASN  HD2-        2.80    (#    177:10  Single Ambig)
 &rst
  ixpk= 177, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 194, 195, 194, 195,
 igr2= 199, 200,
 &end
#
#   42 ASP  HN           41 GLU  HN          3.50    (#    178:10  Unique         2.87, 2.94 A)
 &rst
  ixpk= 178, nxpk= 10, iat= 640, 625, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:179     41 GLU  HN          2.80    (#    179:10  Single Ambig)
 &rst
  ixpk= 179, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 627, 608,
 &end
#
#    0 AMB  10-2:180     41 GLU  HN          2.80    (#    180:10  Single Ambig)
 &rst
  ixpk= 180, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 632, 633, 593, 594,
 &end
#
#   41 GLU  HG-          41 GLU  HN          4.50    (#    181:10  Unique         2.16, 3.37 A)
 &rst
  ixpk= 181, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 632, 633,
 &end
#
#    0 AMB  10-2:182     41 GLU  HN          2.80    (#    182:10  Single Ambig)
 &rst
  ixpk= 182, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 629, 630, 629, 630,
 &end
#
#   39 GLN  HB+          41 GLU  HN          4.50    (#    183:10  Unique         2.99, 3.34 A)
 &rst
  ixpk= 183, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 593, 594,
 &end
#
#    0 AMB  10-2:184     41 GLU  HN          2.80    (#    184:10  Single Ambig)
 &rst
  ixpk= 184, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 610, 611, 676, 677,
 &end
#
#    0 AMB  10-2:185      0 AMB  10-1:185    2.80    (#    185:10  Double Ambig)
 &rst
  ixpk= 185, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 194, 195, 194, 195,
 igr2= 199, 200, 199, 200,
 &end
#
#    0 AMB  10-2:188      0 AMB  10-1:188    3.50    (#    188:10  Double Ambig)
 &rst
  ixpk= 188, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 596, 597, 596, 597,
 igr2= 601, 602, 601, 602,
 &end
#
#   22 GLN  HA           23 GLY  HN          2.80    (#    196:10  Unique         2.26, 2.33 A)
 &rst
  ixpk= 196, nxpk= 10, iat= 323, 338, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   23 GLY  HA+          23 GLY  HN          2.80    (#    197:10  Unique         2.31, 2.61 A)
 &rst
  ixpk= 197, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 340, 341,
 &end
#
#   16 THR  HA           17 LYS  HN          4.50    (#    200:10  Unique         3.47, 3.51 A)
 &rst
  ixpk= 200, nxpk= 10, iat= 228, 240, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 PRO  HA           27 ALA  HN          2.80    (#    202:10  Unique         2.24, 2.26 A)
 &rst
  ixpk= 202, nxpk= 10, iat= 393, 397, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   27 ALA  MB           27 ALA  HN          2.80    (#    203:10  Unique         2.37, 2.84 A)
 &rst
  ixpk= 203, nxpk= 10, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 401, 402, 403,
 &end
#
#   14 GLY  HA-          14 GLY  HN          2.80    (#    204:10  Unique         2.35, 2.75 A)
 &rst
  ixpk= 204, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 206, 207,
 &end
#
#    0 AMB  10-2:205     14 GLY  HN          3.50    (#    205:10  Single Ambig)
 &rst
  ixpk= 205, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   14 GLY  HA+          14 GLY  HN          2.80    (#    206:10  Unique         2.35, 2.75 A)
 &rst
  ixpk= 206, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 206, 207,
 &end
#
#    0 AMB  10-2:207     14 GLY  HN          6.00    (#    207:10  Single Ambig)
 &rst
  ixpk= 207, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 194, 195, 194, 195,
 &end
#
#   10 VAL  HA           11 ASP  HN          2.80    (#    209:10  Unique         2.16, 2.25 A)
 &rst
  ixpk= 209, nxpk= 10, iat= 149, 163, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   11 ASP  HB-          11 ASP  HN          2.80    (#    210:10  Unique         2.46, 3.03 A)
 &rst
  ixpk= 210, nxpk= 10, iat=  -1, 163, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 167, 168,
 &end
#
#   11 ASP  HB+          11 ASP  HN          2.80    (#    211:10  Unique         2.46, 3.03 A)
 &rst
  ixpk= 211, nxpk= 10, iat=  -1, 163, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 167, 168,
 &end
#
#    0 AMB  10-2:212     11 ASP  HN          2.80    (#    212:10  Single Ambig)
 &rst
  ixpk= 212, nxpk= 10, iat=  -1, 163, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#    0 AMB  10-2:213     46 LYS  HN          4.50    (#    213:10  Single Ambig)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 697, 698, 699, 756, 757, 758, 760, 761, 762,
 &end
#
#    0 AMB  10-2:214     46 LYS  HN          3.50    (#    214:10  Single Ambig)
 &rst
  ixpk= 214, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  74, 712, 674,
 &end
#
#   45 ILE  HA           46 LYS  HN          4.50    (#    215:10  Unique         3.43, 3.56 A)
 &rst
  ixpk= 215, nxpk= 10, iat= 693, 710, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:216     46 LYS  HN          2.80    (#    216:10  Single Ambig)
 &rst
  ixpk= 216, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 714, 715, 676, 677,
 &end
#
#    0 AMB  10-2:217     46 LYS  HN          4.50    (#    217:10  Single Ambig)
 &rst
  ixpk= 217, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 701, 702,  76,  77,
 &end
#
#   36 GLN  HN           37 GLY  HN          2.80    (#    218:10  Unique         2.03, 2.12 A)
 &rst
  ixpk= 218, nxpk= 10, iat= 543, 560, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   38 LYS  HN           37 GLY  HN          2.80    (#    219:10  Unique         2.72, 2.82 A)
 &rst
  ixpk= 219, nxpk= 10, iat= 567, 560, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   36 GLN  HA           37 GLY  HN          4.50    (#    220:10  Unique         3.22, 3.30 A)
 &rst
  ixpk= 220, nxpk= 10, iat= 545, 560, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:221     37 GLY  HN          2.80    (#    221:10  Single Ambig)
 &rst
  ixpk= 221, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 562, 563, 562, 563,
 &end
#
#   17 LYS  HA           18 THR  HN          2.80    (#    222:10  Unique         2.29, 2.35 A)
 &rst
  ixpk= 222, nxpk= 10, iat= 242, 262, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   17 LYS  HB-          18 THR  HN          2.80    (#    223:10  Unique         1.99, 3.10 A)
 &rst
  ixpk= 223, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 244, 245,
 &end
#
#    0 AMB  10-2:224     18 THR  HN          2.80    (#    224:10  Single Ambig)
 &rst
  ixpk= 224, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1= 247, 248, 268, 269, 270,
 &end
#
#   17 LYS  HB+          18 THR  HN          4.50    (#    225:10  Unique         1.99, 3.10 A)
 &rst
  ixpk= 225, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 244, 245,
 &end
#
#   29 ILE  HN           30 LYS  HN          2.80    (#    231:10  Unique         2.60, 2.69 A)
 &rst
  ixpk= 231, nxpk= 10, iat= 423, 442, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    1 ALA  HA            2 ALA  HN          6.00    (#    232:10  Unique         2.30, 2.34 A)
 &rst
  ixpk= 232, nxpk= 10, iat=   6,  14, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:233      2 ALA  HN          6.00    (#    233:10  Single Ambig)
 &rst
  ixpk= 233, nxpk= 10, iat=  -1,  14, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1=  18,  19,  20,   8,   9,  10,
 &end
#
#    3 ARG  HA            3 ARG  HN          8.00    (#    234:10  Unique         2.33, 2.90 A)
 &rst
  ixpk= 234, nxpk= 10, iat=  26,  24, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   18 THR  HB            5 ALA  HN          8.00    (#    241:10  Unique         5.15, 5.58 A)
 &rst
  ixpk= 241, nxpk= 10, iat= 266,  62, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    4 PRO  HB-           5 ALA  HN          6.00    (#    244:10  Unique         2.52, 3.21 A)
 &rst
  ixpk= 244, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  55,  56,
 &end
#
#    0 AMB  10-2:245      5 ALA  HN          8.00    (#    245:10  Single Ambig)
 &rst
  ixpk= 245, nxpk= 10, iat=  -1,  62, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1=  52,  53,  52,  53,
 &end
#
#    6 LYS  HG+           6 LYS  HN          6.00    (#    252:10  Unique         2.59, 4.23 A)
 &rst
  ixpk= 252, nxpk= 10, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  79,  80,
 &end
#
#    6 LYS  HG-           6 LYS  HN          6.00    (#    253:10  Unique         2.59, 4.23 A)
 &rst
  ixpk= 253, nxpk= 10, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  79,  80,
 &end
#
#   19 TRP  HN            7 TYR  HN          4.50    (#    255:10  Unique         2.88, 2.95 A)
 &rst
  ixpk= 255, nxpk= 10, iat= 276,  94, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 ILE  HN            7 TYR  HN          8.00    (#    256:10  Unique         4.47, 4.65 A)
 &rst
  ixpk= 256, nxpk= 10, iat= 691,  94, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    7 TYR  HD            7 TYR  HN          4.50    (#    257:10  Unique         2.83, 4.16 A)
 &rst
  ixpk= 257, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 102, 111,
 &end
#
#    7 TYR  HA            7 TYR  HN          4.50    (#    258:10  Unique         2.96, 2.97 A)
 &rst
  ixpk= 258, nxpk= 10, iat=  96,  94, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 ALA  HA            7 TYR  HN          8.00    (#    259:10  Unique         3.72, 3.83 A)
 &rst
  ixpk= 259, nxpk= 10, iat=  64,  94, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    5 ALA  MB            7 TYR  HN          6.00    (#    260:10  Unique         2.43, 3.73 A)
 &rst
  ixpk= 260, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=  66,  67,  68,
 &end
#
#    0 AMB  10-2:261      7 TYR  HN          4.50    (#    261:10  Single Ambig)
 &rst
  ixpk= 261, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  76,  77,  76,  77,
 &end
#
#    6 LYS  HG+           7 TYR  HN          6.00    (#    262:10  Unique         3.49, 4.59 A)
 &rst
  ixpk= 262, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  79,  80,
 &end
#
#    0 AMB  10-2:263      7 TYR  HN          8.00    (#    263:10  Single Ambig)
 &rst
  ixpk= 263, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3=10.46, r4=10.96,
 igr1=  79,  80, 697, 698, 699,
 &end
#
#   45 ILE  MD1           7 TYR  HN          6.00    (#    264:10  Unique         2.85, 4.36 A)
 &rst
  ixpk= 264, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 704, 705, 706,
 &end
#
#    8 SER  HA            8 SER  HN          6.00    (#    266:10  Unique         2.92, 2.95 A)
 &rst
  ixpk= 266, nxpk= 10, iat= 117, 115, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   43 PHE  HB-           8 SER  HN          6.00    (#    267:10  Unique         2.53, 3.51 A)
 &rst
  ixpk= 267, nxpk= 10, iat=  -1, 115, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 656, 657,
 &end
#
#    8 SER  HB+           8 SER  HN          6.00    (#    268:10  Unique         2.75, 3.34 A)
 &rst
  ixpk= 268, nxpk= 10, iat=  -1, 115, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 119, 120,
 &end
#
#    7 TYR  HB+           8 SER  HN          6.00    (#    269:10  Unique         2.49, 3.22 A)
 &rst
  ixpk= 269, nxpk= 10, iat=  -1, 115, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  98,  99,
 &end
#
#   45 ILE  HG1-          8 SER  HN          8.00    (#    270:10  Unique         3.34, 4.13 A)
 &rst
  ixpk= 270, nxpk= 10, iat=  -1, 115, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 701, 702,
 &end
#
#   17 LYS  HN            9 TYR  HN          3.50    (#    271:10  Unique         2.86, 2.99 A)
 &rst
  ixpk= 271, nxpk= 10, iat= 240, 126, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 THR  HA            9 TYR  HN          4.50    (#    273:10  Unique         3.49, 3.64 A)
 &rst
  ixpk= 273, nxpk= 10, iat= 264, 126, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   16 THR  HA            9 TYR  HN          8.00    (#    275:10  Unique         6.20, 6.31 A)
 &rst
  ixpk= 275, nxpk= 10, iat= 228, 126, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    9 TYR  HB+           9 TYR  HN          6.00    (#    276:10  Unique         3.29, 3.69 A)
 &rst
  ixpk= 276, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 130, 131,
 &end
#
#    9 TYR  HB-           9 TYR  HN          6.00    (#    277:10  Unique         3.29, 3.69 A)
 &rst
  ixpk= 277, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 130, 131,
 &end
#
#   16 THR  MG2           9 TYR  HN          6.00    (#    278:10  Unique         4.60, 6.31 A)
 &rst
  ixpk= 278, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 232, 233, 234,
 &end
#
#    0 AMB  10-2:279      9 TYR  HN          8.00    (#    279:10  Single Ambig)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3=11.06, r4=11.56,
 igr1= 268, 269, 270, 247, 248, 387, 388,
 &end
#
#    9 TYR  HD           10 VAL  HN          4.50    (#    281:10  Unique         2.85, 4.30 A)
 &rst
  ixpk= 281, nxpk= 10, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 134, 143,
 &end
#
#   12 GLU  HN           11 ASP  HN          6.00    (#    282:10  Unique         2.09, 3.43 A)
 &rst
  ixpk= 282, nxpk= 10, iat= 175, 163, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   14 GLY  HN           11 ASP  HN          6.00    (#    286:10  Unique         2.99, 3.38 A)
 &rst
  ixpk= 286, nxpk= 10, iat= 204, 163, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   10 VAL  HN           11 ASP  HN          8.00    (#    287:10  Unique         4.32, 4.42 A)
 &rst
  ixpk= 287, nxpk= 10, iat= 147, 163, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   10 VAL  HB           11 ASP  HN          6.00    (#    289:10  Unique         2.28, 3.71 A)
 &rst
  ixpk= 289, nxpk= 10, iat= 151, 163, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   13 ASN  HN           12 GLU  HN          4.50    (#    293:10  Unique         1.97, 2.54 A)
 &rst
  ixpk= 293, nxpk= 10, iat= 190, 175, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 VAL  MGY          12 GLU  HN          6.00    (#    294:10  Unique         5.75, 7.79 A)
 &rst
  ixpk= 294, nxpk= 10, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#   12 GLU  HN           13 ASN  HN          4.50    (#    295:10  Unique         1.97, 2.54 A)
 &rst
  ixpk= 295, nxpk= 10, iat= 175, 190, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ASN  HD2+         13 ASN  HN          6.00    (#    300:10  Unique         2.63, 4.74 A)
 &rst
  ixpk= 300, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 199, 200,
 &end
#
#   14 GLY  HA+          13 ASN  HN          6.00    (#    302:10  Unique         4.69, 5.18 A)
 &rst
  ixpk= 302, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 206, 207,
 &end
#
#   11 ASP  HB-          13 ASN  HN          6.00    (#    303:10  Unique         2.61, 4.30 A)
 &rst
  ixpk= 303, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 167, 168,
 &end
#
#   11 ASP  HB+          13 ASN  HN          6.00    (#    305:10  Unique         2.61, 4.30 A)
 &rst
  ixpk= 305, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 167, 168,
 &end
#
#   12 GLU  HB+          13 ASN  HN          4.50    (#    306:10  Unique         2.35, 3.35 A)
 &rst
  ixpk= 306, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 179, 180,
 &end
#
#   12 GLU  HB-          13 ASN  HN          6.00    (#    307:10  Unique         2.35, 3.35 A)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 179, 180,
 &end
#
#    0 AMB  10-2:308     14 GLY  HN          6.00    (#    308:10  Single Ambig)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 179, 180, 215, 216, 215, 216,
 &end
#
#    0 AMB  10-2:309     14 GLY  HN          8.00    (#    309:10  Single Ambig)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 179, 180, 218, 219,
 &end
#
#   12 GLU  HA           14 GLY  HN          4.50    (#    310:10  Unique         3.60, 4.03 A)
 &rst
  ixpk= 310, nxpk= 10, iat= 177, 204, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 GLU  HA           14 GLY  HN          8.00    (#    311:10  Unique         5.13, 5.44 A)
 &rst
  ixpk= 311, nxpk= 10, iat= 213, 204, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   13 ASN  HA           14 GLY  HN          4.50    (#    313:10  Unique         2.92, 3.37 A)
 &rst
  ixpk= 313, nxpk= 10, iat= 192, 204, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 ASP  HN           14 GLY  HN          6.00    (#    317:10  Unique         2.99, 3.38 A)
 &rst
  ixpk= 317, nxpk= 10, iat= 163, 204, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   16 THR  HN           15 GLU  HN          8.00    (#    319:10  Unique         4.25, 4.48 A)
 &rst
  ixpk= 319, nxpk= 10, iat= 226, 211, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   14 GLY  HA-          15 GLU  HN          3.50    (#    322:10  Unique         2.22, 2.63 A)
 &rst
  ixpk= 322, nxpk= 10, iat=  -1, 211, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 206, 207,
 &end
#
#   11 ASP  HN           16 THR  HN          8.00    (#    325:10  Unique         3.34, 4.01 A)
 &rst
  ixpk= 325, nxpk= 10, iat= 163, 226, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   15 GLU  HG+          16 THR  HN          6.00    (#    333:10  Unique         3.51, 4.82 A)
 &rst
  ixpk= 333, nxpk= 10, iat=  -1, 226, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 218, 219,
 &end
#
#   15 GLU  HG-          16 THR  HN          6.00    (#    334:10  Unique         3.51, 4.82 A)
 &rst
  ixpk= 334, nxpk= 10, iat=  -1, 226, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 218, 219,
 &end
#
#   16 THR  MG2          16 THR  HN          4.50    (#    335:10  Unique         2.40, 4.48 A)
 &rst
  ixpk= 335, nxpk= 10, iat=  -1, 226, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 232, 233, 234,
 &end
#
#    0 AMB  10-2:336     16 THR  HN          6.00    (#    336:10  Single Ambig)
 &rst
  ixpk= 336, nxpk= 10, iat=  -1, 226, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#    9 TYR  HN           17 LYS  HN          3.50    (#    338:10  Unique         2.86, 2.99 A)
 &rst
  ixpk= 338, nxpk= 10, iat= 126, 240, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 LYS  HA           17 LYS  HN          4.50    (#    339:10  Unique         2.81, 2.96 A)
 &rst
  ixpk= 339, nxpk= 10, iat= 242, 240, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   16 THR  HB           17 LYS  HN          6.00    (#    340:10  Unique         2.11, 2.58 A)
 &rst
  ixpk= 340, nxpk= 10, iat= 230, 240, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   17 LYS  HB-          17 LYS  HN          4.50    (#    341:10  Unique         2.78, 3.40 A)
 &rst
  ixpk= 341, nxpk= 10, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 244, 245,
 &end
#
#   17 LYS  HG+          17 LYS  HN          6.00    (#    342:10  Unique         3.18, 4.16 A)
 &rst
  ixpk= 342, nxpk= 10, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 247, 248,
 &end
#
#    0 AMB  10-2:343     17 LYS  HN          4.50    (#    343:10  Single Ambig)
 &rst
  ixpk= 343, nxpk= 10, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 247, 248, 268, 269, 270,
 &end
#
#   16 THR  MG2          17 LYS  HN          2.80    (#    344:10  Unique         2.73, 3.92 A)
 &rst
  ixpk= 344, nxpk= 10, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 232, 233, 234,
 &end
#
#    0 AMB  10-2:345     17 LYS  HN          6.00    (#    345:10  Single Ambig)
 &rst
  ixpk= 345, nxpk= 10, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 153, 154, 155, 157, 158, 159, 153, 154, 155, 157,
       158, 159,
 &end
#
#   17 LYS  HB+          17 LYS  HN          3.50    (#    346:10  Unique         2.78, 3.40 A)
 &rst
  ixpk= 346, nxpk= 10, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 244, 245,
 &end
#
#   19 TRP  HN           18 THR  HN          8.00    (#    347:10  Unique         4.47, 4.52 A)
 &rst
  ixpk= 347, nxpk= 10, iat= 276, 262, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   18 THR  HA           18 THR  HN          4.50    (#    348:10  Unique         2.97, 2.98 A)
 &rst
  ixpk= 348, nxpk= 10, iat= 264, 262, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 THR  HB           18 THR  HN          8.00    (#    350:10  Unique         3.61, 3.76 A)
 &rst
  ixpk= 350, nxpk= 10, iat= 266, 262, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   17 LYS  HG+          18 THR  HN          8.00    (#    352:10  Unique         2.38, 4.33 A)
 &rst
  ixpk= 352, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 247, 248,
 &end
#
#    7 TYR  HN           19 TRP  HN          6.00    (#    353:10  Single Ambig)
 &rst
  ixpk= 353, nxpk= 10, iat=  94, 276, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:354     19 TRP  HN          6.00    (#    354:10  Single Ambig)
 &rst
  ixpk= 354, nxpk= 10, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 278, 117,
 &end
#
#   19 TRP  HB-          19 TRP  HN          6.00    (#    355:10  Unique         2.69, 3.05 A)
 &rst
  ixpk= 355, nxpk= 10, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 280, 281,
 &end
#
#    0 AMB  10-2:356     19 TRP  HN          6.00    (#    356:10  Single Ambig)
 &rst
  ixpk= 356, nxpk= 10, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 8.30, r4= 8.80,
 igr1= 268, 269, 270, 387, 388,  79,  80,
 &end
#
#   19 TRP  HE1          22 GLN  HN          4.50    (#    357:10  Unique         2.60, 2.99 A)
 &rst
  ixpk= 357, nxpk= 10, iat= 286, 321, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:360     22 GLN  HN          6.00    (#    360:10  Single Ambig)
 &rst
  ixpk= 360, nxpk= 10, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 304, 302,
 &end
#
#   21 GLY  HA-          22 GLN  HN          4.50    (#    361:10  Unique         3.09, 3.34 A)
 &rst
  ixpk= 361, nxpk= 10, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 316, 317,
 &end
#
#   22 GLN  HB+          23 GLY  HN          6.00    (#    362:10  Unique         2.23, 3.27 A)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 325, 326,
 &end
#
#   22 GLN  HB-          23 GLY  HN          6.00    (#    363:10  Unique         2.23, 3.27 A)
 &rst
  ixpk= 363, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 325, 326,
 &end
#
#    0 AMB  10-2:364     23 GLY  HN          6.00    (#    364:10  Single Ambig)
 &rst
  ixpk= 364, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 328, 329, 328, 329,
 &end
#
#   23 GLY  HA-          23 GLY  HN          4.50    (#    365:10  Unique         2.31, 2.61 A)
 &rst
  ixpk= 365, nxpk= 10, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 340, 341,
 &end
#
#    0 AMB  10-2:367     24 ARG  HN          8.00    (#    367:10  Single Ambig)
 &rst
  ixpk= 367, nxpk= 10, iat=  -1, 345, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 355, 356, 355, 356,
 &end
#
#   25 THR  MG2          25 THR  HN          4.50    (#    375:10  Unique         4.34, 4.52 A)
 &rst
  ixpk= 375, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 375, 376, 377,
 &end
#
#    0 AMB  10-2:376     25 THR  HN          8.00    (#    376:10  Single Ambig)
 &rst
  ixpk= 376, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 355, 356, 355, 356,
 &end
#
#   28 VAL  HN           27 ALA  HN          6.00    (#    384:10  Unique         2.96, 3.09 A)
 &rst
  ixpk= 384, nxpk= 10, iat= 407, 397, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   27 ALA  HA           27 ALA  HN          4.50    (#    385:10  Unique         2.71, 2.76 A)
 &rst
  ixpk= 385, nxpk= 10, iat= 399, 397, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 PRO  HB-          27 ALA  HN          6.00    (#    386:10  Unique         3.06, 3.49 A)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 390, 391,
 &end
#
#   26 PRO  HB+          28 VAL  HN          6.00    (#    387:10  Unique         3.50, 3.91 A)
 &rst
  ixpk= 387, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 390, 391,
 &end
#
#    0 AMB  10-2:388     28 VAL  HN          6.00    (#    388:10  Single Ambig)
 &rst
  ixpk= 388, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 387, 388, 427,
 &end
#
#    0 AMB  10-2:389     28 VAL  HN          8.00    (#    389:10  Single Ambig)
 &rst
  ixpk= 389, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3=11.54, r4=12.04,
 igr1= 446, 447, 474, 475, 474, 475, 490, 491, 492,
 &end
#
#   26 PRO  HB-          28 VAL  HN          8.00    (#    390:10  Unique         3.50, 3.91 A)
 &rst
  ixpk= 390, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 390, 391,
 &end
#
#   27 ALA  HA           28 VAL  HN          4.50    (#    391:10  Unique         3.59, 3.61 A)
 &rst
  ixpk= 391, nxpk= 10, iat= 399, 407, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 ILE  HN           28 VAL  HN          3.50    (#    393:10  Unique         2.71, 2.76 A)
 &rst
  ixpk= 393, nxpk= 10, iat= 423, 407, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 LYS  HN           28 VAL  HN          6.00    (#    395:10  Unique         4.22, 4.31 A)
 &rst
  ixpk= 395, nxpk= 10, iat= 442, 407, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   27 ALA  HN           28 VAL  HN          6.00    (#    400:10  Unique         2.96, 3.09 A)
 &rst
  ixpk= 400, nxpk= 10, iat= 397, 407, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   29 ILE  MD1          29 ILE  HN          6.00    (#    401:10  Unique         3.64, 4.49 A)
 &rst
  ixpk= 401, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 436, 437, 438,
 &end
#
#   29 ILE  HG1-         29 ILE  HN          6.00    (#    402:10  Unique         2.17, 2.86 A)
 &rst
  ixpk= 402, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 433, 434,
 &end
#
#    0 AMB  10-2:403     29 ILE  HN          4.50    (#    403:10  Single Ambig)
 &rst
  ixpk= 403, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 427, 387, 388,
 &end
#
#   28 VAL  HB           29 ILE  HN          8.00    (#    404:10  Unique         2.65, 3.15 A)
 &rst
  ixpk= 404, nxpk= 10, iat= 411, 423, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   29 ILE  HA           29 ILE  HN          6.00    (#    405:10  Unique         2.87, 2.90 A)
 &rst
  ixpk= 405, nxpk= 10, iat= 425, 423, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   30 LYS  HN           29 ILE  HN          4.50    (#    406:10  Unique         2.60, 2.69 A)
 &rst
  ixpk= 406, nxpk= 10, iat= 442, 423, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 VAL  HN           29 ILE  HN          6.00    (#    407:10  Unique         2.71, 2.76 A)
 &rst
  ixpk= 407, nxpk= 10, iat= 407, 423, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   29 ILE  MG2          30 LYS  HN          6.00    (#    408:10  Unique         3.42, 4.25 A)
 &rst
  ixpk= 408, nxpk= 10, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 429, 430, 431,
 &end
#
#   29 ILE  HA           30 LYS  HN          6.00    (#    409:10  Unique         3.58, 3.59 A)
 &rst
  ixpk= 409, nxpk= 10, iat= 425, 442, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   32 ALA  HN           30 LYS  HN          6.00    (#    410:10  Unique         4.28, 4.37 A)
 &rst
  ixpk= 410, nxpk= 10, iat= 486, 442, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:414     30 LYS  HN          8.00    (#    414:10  Single Ambig)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 407, 496,
 &end
#
#    0 AMB  10-2:415     31 LYS  HN          4.50    (#    415:10  Single Ambig)
 &rst
  ixpk= 415, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 471, 472, 471, 472,
 &end
#
#   28 VAL  HA           31 LYS  HN          6.00    (#    416:10  Unique         3.26, 3.44 A)
 &rst
  ixpk= 416, nxpk= 10, iat= 409, 464, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:420     32 ALA  HN          8.00    (#    420:10  Single Ambig)
 &rst
  ixpk= 420, nxpk= 10, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 442, 555, 556,
 &end
#
#   31 LYS  HA           32 ALA  HN          4.50    (#    422:10  Unique         3.54, 3.57 A)
 &rst
  ixpk= 422, nxpk= 10, iat= 466, 486, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:423     32 ALA  HN          8.00    (#    423:10  Single Ambig)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 444, 399,
 &end
#
#   29 ILE  HA           32 ALA  HN          6.00    (#    424:10  Unique         3.26, 3.59 A)
 &rst
  ixpk= 424, nxpk= 10, iat= 425, 486, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:427     32 ALA  HN          8.00    (#    427:10  Single Ambig)
 &rst
  ixpk= 427, nxpk= 10, iat=  -1, 486, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 500, 501, 500, 501, 517, 518,
 &end
#
#    0 AMB  10-2:428     32 ALA  HN          6.00    (#    428:10  Single Ambig)
 &rst
  ixpk= 428, nxpk= 10, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 471, 472, 471, 472, 571, 572,
 &end
#
#    0 AMB  10-2:429     32 ALA  HN          8.00    (#    429:10  Single Ambig)
 &rst
  ixpk= 429, nxpk= 10, iat=  -1, 486, r1= 1.30, r2= 1.80, r3=11.06, r4=11.56,
 igr1= 577, 578, 577, 578, 411, 574, 575,
 &end
#
#   34 GLU  HN           33 MET  HN          3.50    (#    430:10  Unique         2.63, 2.77 A)
 &rst
  ixpk= 430, nxpk= 10, iat= 513, 496, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 LYS  HA           33 MET  HN          6.00    (#    432:10  Unique         3.47, 3.61 A)
 &rst
  ixpk= 432, nxpk= 10, iat= 444, 496, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:433     33 MET  HN          8.00    (#    433:10  Single Ambig)
 &rst
  ixpk= 433, nxpk= 10, iat=  -1, 496, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 571, 572, 471, 472,
 &end
#
#   29 ILE  MG2          33 MET  HN          6.00    (#    434:10  Unique         4.41, 5.29 A)
 &rst
  ixpk= 434, nxpk= 10, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 429, 430, 431,
 &end
#
#    0 AMB  10-2:438     34 GLU  HN          6.00    (#    438:10  Single Ambig)
 &rst
  ixpk= 438, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 543, 486,
 &end
#
#   30 LYS  HA           34 GLU  HN          6.00    (#    439:10  Unique         3.99, 4.16 A)
 &rst
  ixpk= 439, nxpk= 10, iat= 444, 513, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   33 MET  HG-          34 GLU  HN          4.50    (#    440:10  Unique         4.42, 4.77 A)
 &rst
  ixpk= 440, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 503, 504,
 &end
#
#    0 AMB  10-2:441     34 GLU  HN          6.00    (#    441:10  Single Ambig)
 &rst
  ixpk= 441, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 474, 475, 474, 475, 490, 491, 492, 446, 447,
 &end
#
#   37 GLY  HN           35 GLU  HN          6.00    (#    444:10  Unique         3.71, 3.83 A)
 &rst
  ixpk= 444, nxpk= 10, iat= 560, 528, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   32 ALA  HA           35 GLU  HN          6.00    (#    445:10  Unique         3.44, 3.77 A)
 &rst
  ixpk= 445, nxpk= 10, iat= 488, 528, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   34 GLU  HN           36 GLN  HN          8.00    (#    447:10  Unique         3.99, 4.22 A)
 &rst
  ixpk= 447, nxpk= 10, iat= 513, 543, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   37 GLY  HN           36 GLN  HN          2.80    (#    448:10  Unique         2.03, 2.12 A)
 &rst
  ixpk= 448, nxpk= 10, iat= 560, 543, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:450     36 GLN  HN          4.50    (#    450:10  Single Ambig)
 &rst
  ixpk= 450, nxpk= 10, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 530, 498,
 &end
#
#    0 AMB  10-2:451     36 GLN  HN          6.00    (#    451:10  Single Ambig)
 &rst
  ixpk= 451, nxpk= 10, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 562, 563, 562, 563,
 &end
#
#    0 AMB  10-2:452     37 GLY  HN          6.00    (#    452:10  Single Ambig)
 &rst
  ixpk= 452, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 547, 548, 550, 551,
 &end
#
#    0 AMB  10-2:453     37 GLY  HN          6.00    (#    453:10  Single Ambig)
 &rst
  ixpk= 453, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 547, 548, 550, 551, 535, 536,
 &end
#
#   34 GLU  HA           37 GLY  HN          8.00    (#    455:10  Unique         4.15, 4.53 A)
 &rst
  ixpk= 455, nxpk= 10, iat= 515, 560, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    0 AMB  10-2:456     37 GLY  HN          6.00    (#    456:10  Single Ambig)
 &rst
  ixpk= 456, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 498, 530, 569,
 &end
#
#   35 GLU  HN           37 GLY  HN          6.00    (#    460:10  Unique         3.71, 3.83 A)
 &rst
  ixpk= 460, nxpk= 10, iat= 528, 560, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   39 GLN  HN           38 LYS  HN          8.00    (#    461:10  Unique         4.59, 4.63 A)
 &rst
  ixpk= 461, nxpk= 10, iat= 589, 567, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    0 AMB  10-2:470     38 LYS  HN          6.00    (#    470:10  Single Ambig)
 &rst
  ixpk= 470, nxpk= 10, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 547, 548, 503, 504,
 &end
#
#    0 AMB  10-2:471     38 LYS  HN          6.00    (#    471:10  Single Ambig)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 547, 548, 550, 551,
 &end
#
#   32 ALA  MB           38 LYS  HN          8.00    (#    472:10  Unique         3.89, 5.16 A)
 &rst
  ixpk= 472, nxpk= 10, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 490, 491, 492,
 &end
#
#   38 LYS  HB+          39 GLN  HN          3.50    (#    473:10  Unique         2.17, 2.93 A)
 &rst
  ixpk= 473, nxpk= 10, iat=  -1, 589, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 571, 572,
 &end
#
#    0 AMB  10-2:474     39 GLN  HN          4.50    (#    474:10  Single Ambig)
 &rst
  ixpk= 474, nxpk= 10, iat=  -1, 589, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 577, 578, 577, 578, 574, 575,
 &end
#
#   42 ASP  HB-          39 GLN  HN          4.50    (#    475:10  Unique         2.88, 3.59 A)
 &rst
  ixpk= 475, nxpk= 10, iat=  -1, 589, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 644, 645,
 &end
#
#   38 LYS  HN           39 GLN  HN          8.00    (#    476:10  Unique         4.59, 4.63 A)
 &rst
  ixpk= 476, nxpk= 10, iat= 567, 589, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   42 ASP  HN           39 GLN  HN          6.00    (#    477:10  Unique         3.27, 3.60 A)
 &rst
  ixpk= 477, nxpk= 10, iat= 640, 589, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   41 GLU  HN           40 LEU  HN          2.80    (#    480:10  Unique         2.67, 2.87 A)
 &rst
  ixpk= 480, nxpk= 10, iat= 625, 606, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:481     40 LEU  HN          6.00    (#    481:10  Single Ambig)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 615, 616, 617, 619, 620, 621, 615, 616, 617, 619,
       620, 621,
 &end
#
#   40 LEU  MDX          41 GLU  HN          8.00    (#    482:10  Unique         4.58, 5.67 A)
 &rst
  ixpk= 482, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 615, 616, 617, 619, 620, 621,
 &end
#
#   39 GLN  HA           41 GLU  HN          6.00    (#    483:10  Unique         4.30, 4.53 A)
 &rst
  ixpk= 483, nxpk= 10, iat= 591, 625, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   40 LEU  HN           41 GLU  HN          2.80    (#    486:10  Unique         2.67, 2.87 A)
 &rst
  ixpk= 486, nxpk= 10, iat= 606, 625, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:488     42 ASP  HN          6.00    (#    488:10  Single Ambig)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 676, 677, 610, 611, 679,
 &end
#
#   43 PHE  HB+          42 ASP  HN          8.00    (#    489:10  Unique         4.42, 5.39 A)
 &rst
  ixpk= 489, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 656, 657,
 &end
#
#   39 GLN  HA           42 ASP  HN          8.00    (#    490:10  Unique         4.75, 4.97 A)
 &rst
  ixpk= 490, nxpk= 10, iat= 591, 640, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   44 LEU  HN           42 ASP  HN          6.00    (#    491:10  Unique         3.84, 3.99 A)
 &rst
  ixpk= 491, nxpk= 10, iat= 672, 640, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   43 PHE  HD           42 ASP  HN          4.50    (#    492:10  Unique         3.23, 5.15 A)
 &rst
  ixpk= 492, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 660, 668,
 &end
#
#   41 GLU  HN           43 PHE  HN          8.00    (#    497:10  Unique         4.17, 4.30 A)
 &rst
  ixpk= 497, nxpk= 10, iat= 625, 652, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   43 PHE  HE           43 PHE  HN          6.00    (#    506:10  Unique         4.24, 5.50 A)
 &rst
  ixpk= 506, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 662, 666,
 &end
#
#    7 TYR  HD           43 PHE  HN          6.00    (#    507:10  Unique         3.86, 6.17 A)
 &rst
  ixpk= 507, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 102, 111,
 &end
#
#   43 PHE  HA           43 PHE  HN          4.50    (#    508:10  Unique         2.95, 2.99 A)
 &rst
  ixpk= 508, nxpk= 10, iat= 654, 652, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 ASP  HA           43 PHE  HN          4.50    (#    509:10  Unique         3.38, 3.43 A)
 &rst
  ixpk= 509, nxpk= 10, iat= 642, 652, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 PHE  HB-          43 PHE  HN          4.50    (#    510:10  Unique         2.46, 3.12 A)
 &rst
  ixpk= 510, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 656, 657,
 &end
#
#    0 AMB  10-2:511     43 PHE  HN          4.50    (#    511:10  Single Ambig)
 &rst
  ixpk= 511, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 627, 608,
 &end
#
#   42 ASP  HB-          43 PHE  HN          6.00    (#    512:10  Unique         2.79, 3.67 A)
 &rst
  ixpk= 512, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 644, 645,
 &end
#
#    0 AMB  10-2:513     43 PHE  HN          4.50    (#    513:10  Single Ambig)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 676, 677, 679, 610, 611,
 &end
#
#    0 AMB  10-2:514     44 LEU  HN          6.00    (#    514:10  Single Ambig)
 &rst
  ixpk= 514, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687,
 &end
#
#   48 LEU  MDY          44 LEU  HN          4.50    (#    515:10  Unique         3.55, 5.91 A)
 &rst
  ixpk= 515, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 756, 757, 758, 760, 761, 762,
 &end
#
#   41 GLU  HG-          44 LEU  HN          8.00    (#    516:10  Unique         4.90, 5.49 A)
 &rst
  ixpk= 516, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 632, 633,
 &end
#
#    0 AMB  10-2:517     44 LEU  HN          6.00    (#    517:10  Single Ambig)
 &rst
  ixpk= 517, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 656, 657,  98,  99,
 &end
#
#   42 ASP  HA           44 LEU  HN          6.00    (#    518:10  Unique         4.25, 4.40 A)
 &rst
  ixpk= 518, nxpk= 10, iat= 642, 672, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   43 PHE  HA           44 LEU  HN          4.50    (#    519:10  Unique         3.36, 3.43 A)
 &rst
  ixpk= 519, nxpk= 10, iat= 654, 672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 TYR  HE           44 LEU  HN          8.00    (#    520:10  Unique         3.61, 5.85 A)
 &rst
  ixpk= 520, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 104, 109,
 &end
#
#    7 TYR  HD           44 LEU  HN          4.50    (#    521:10  Unique         3.08, 5.24 A)
 &rst
  ixpk= 521, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 102, 111,
 &end
#
#   43 PHE  HD           44 LEU  HN          8.00    (#    527:10  Unique         4.00, 5.18 A)
 &rst
  ixpk= 527, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 660, 668,
 &end
#
#   42 ASP  HN           44 LEU  HN          6.00    (#    528:10  Unique         3.84, 3.99 A)
 &rst
  ixpk= 528, nxpk= 10, iat= 640, 672, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   45 ILE  HN           44 LEU  HN          6.00    (#    529:10  Unique         4.54, 4.61 A)
 &rst
  ixpk= 529, nxpk= 10, iat= 691, 672, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:530     45 ILE  HN          4.50    (#    530:10  Single Ambig)
 &rst
  ixpk= 530, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 676, 677, 679,
 &end
#
#    7 TYR  HA           45 ILE  HN          2.80    (#    531:10  Unique         2.81, 3.20 A)
 &rst
  ixpk= 531, nxpk= 10, iat=  96, 691, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    7 TYR  HD           45 ILE  HN          6.00    (#    532:10  Unique         4.14, 5.34 A)
 &rst
  ixpk= 532, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 102, 111,
 &end
#
#    6 LYS  HG-          47 GLU  HN          6.00    (#    534:10  Unique         2.34, 4.29 A)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  79,  80,
 &end
#
#    0 AMB  10-2:535     47 GLU  HN          8.00    (#    535:10  Single Ambig)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1=  76,  77, 717, 718, 717, 718,
 &end
#
#    0 AMB  10-2:536     47 GLU  HN          8.00    (#    536:10  Single Ambig)
 &rst
  ixpk= 536, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3=10.46, r4=10.96,
 igr1= 754, 676, 677, 751, 752,
 &end
#
#   46 LYS  HB+          47 GLU  HN          4.50    (#    537:10  Unique         2.01, 3.39 A)
 &rst
  ixpk= 537, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 714, 715,
 &end
#
#   47 GLU  HG+          47 GLU  HN          4.50    (#    538:10  Unique         2.40, 4.16 A)
 &rst
  ixpk= 538, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 739, 740,
 &end
#
#    0 AMB  10-2:540     48 LEU  HN          8.00    (#    540:10  Single Ambig)
 &rst
  ixpk= 540, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 756, 757, 758, 760, 761, 762,  79,  80,
 &end
#
#    0 AMB  10-2:541     48 LEU  HN          6.00    (#    541:10  Single Ambig)
 &rst
  ixpk= 541, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 736, 737, 770, 771, 770, 771,
 &end
#
#   47 GLU  HB-          48 LEU  HN          6.00    (#    542:10  Unique         3.67, 4.12 A)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 736, 737,
 &end
#
#    0 AMB  10-2:547     49 GLU  HN          4.50    (#    547:10  Single Ambig)
 &rst
  ixpk= 547, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 751, 752,  82,  83,  82,  83,
 &end
#
#    0 AMB  10-2:548     49 GLU  HN          6.00    (#    548:10  Single Ambig)
 &rst
  ixpk= 548, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 751, 752, 754,
 &end
#
#    0 AMB  10-2:549     49 GLU  HN          6.00    (#    549:10  Single Ambig)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 773, 774, 773, 774,
 &end
#
#   34 GLU  HN           32 ALA  HN          6.00    (#    552:10  Unique         4.19, 4.34 A)
 &rst
  ixpk= 552, nxpk= 10, iat= 513, 486, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   11 ASP  HN           10 VAL  HN          8.00    (#    555:10  Unique         4.32, 4.42 A)
 &rst
  ixpk= 555, nxpk= 10, iat= 163, 147, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   19 TRP  HB-           7 TYR  HN          8.00    (#    560:10  Unique         4.16, 4.96 A)
 &rst
  ixpk= 560, nxpk= 10, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 280, 281,
 &end
#
#    0 AMB  10-2:561      8 SER  HN          6.00    (#    561:10  Single Ambig)
 &rst
  ixpk= 561, nxpk= 10, iat=  -1, 115, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 674, 266,
 &end
#
#    7 TYR  HB+          19 TRP  HN          6.00    (#    564:10  Unique         2.84, 3.75 A)
 &rst
  ixpk= 564, nxpk= 10, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  98,  99,
 &end
#
#   26 PRO  HG+          27 ALA  HN          8.00    (#    565:10  Unique         4.73, 5.20 A)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 387, 388,
 &end
#
#   28 VAL  HA           30 LYS  HN          8.00    (#    568:10  Unique         4.58, 4.64 A)
 &rst
  ixpk= 568, nxpk= 10, iat= 409, 442, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   30 LYS  HG+          32 ALA  HN          8.00    (#    570:10  Unique         5.25, 5.82 A)
 &rst
  ixpk= 570, nxpk= 10, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 449, 450,
 &end
#
#   38 LYS  HN           33 MET  HN          8.00    (#    571:10  Unique         4.43, 4.69 A)
 &rst
  ixpk= 571, nxpk= 10, iat= 567, 496, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   32 ALA  HA           34 GLU  HN          8.00    (#    573:10  Unique         4.42, 4.64 A)
 &rst
  ixpk= 573, nxpk= 10, iat= 488, 513, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   36 GLN  HA           35 GLU  HN          6.00    (#    574:10  Unique         4.99, 5.12 A)
 &rst
  ixpk= 574, nxpk= 10, iat= 545, 528, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    7 TYR  HE           43 PHE  HN          8.00    (#    575:10  Unique         4.20, 6.80 A)
 &rst
  ixpk= 575, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 104, 109,
 &end
#
#   44 LEU  HA           43 PHE  HN          8.00    (#    576:10  Unique         4.52, 4.69 A)
 &rst
  ixpk= 576, nxpk= 10, iat= 674, 652, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   42 ASP  HB+          43 PHE  HN          6.00    (#    577:10  Unique         2.79, 3.67 A)
 &rst
  ixpk= 577, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 644, 645,
 &end
#
#    0 AMB  10-2:578     43 PHE  HN          8.00    (#    578:10  Single Ambig)
 &rst
  ixpk= 578, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 629, 630, 629, 630, 571, 572,
 &end
#
#    0 AMB  10-2:579     43 PHE  HN          8.00    (#    579:10  Single Ambig)
 &rst
  ixpk= 579, nxpk= 10, iat=  -1, 652, r1= 1.30, r2= 1.80, r3=12.95, r4=13.45,
 igr1= 681, 682, 683, 685, 686, 687, 681, 682, 683, 685,
       686, 687, 615, 616, 617, 619, 620, 621,
 &end
#
#   43 PHE  HB-          44 LEU  HN          8.00    (#    580:10  Unique         2.96, 3.70 A)
 &rst
  ixpk= 580, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 656, 657,
 &end
#
#   41 GLU  HA           45 ILE  HN          6.00    (#    581:10  Unique         6.00, 6.07 A)
 &rst
  ixpk= 581, nxpk= 10, iat= 627, 691, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    5 ALA  MB           45 ILE  HN          6.00    (#    582:10  Unique         6.66, 7.47 A)
 &rst
  ixpk= 582, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=  66,  67,  68,
 &end
#
#    6 LYS  HG+          45 ILE  HN          8.00    (#    583:10  Unique         2.99, 4.29 A)
 &rst
  ixpk= 583, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1=  79,  80,
 &end
#
#   45 ILE  HN           46 LYS  HN          8.00    (#    584:10  Unique         2.04, 2.22 A)
 &rst
  ixpk= 584, nxpk= 10, iat= 691, 710, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    0 AMB  10-2:586     46 LYS  HN          6.00    (#    586:10  Single Ambig)
 &rst
  ixpk= 586, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 695, 676, 677,
 &end
#
#   45 ILE  HG1+         46 LYS  HN          8.00    (#    587:10  Unique         2.44, 3.92 A)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 701, 702,
 &end
#
#   45 ILE  MD1          46 LYS  HN          8.00    (#    588:10  Unique         4.56, 5.32 A)
 &rst
  ixpk= 588, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 704, 705, 706,
 &end
#
#   36 GLN  HA           36 GLN  HE2+        8.00    (#    593:10  Unique         2.36, 4.55 A)
 &rst
  ixpk= 593, nxpk= 10, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 555, 556,
 &end
#
#    0 AMB  10-2:594      0 AMB  10-1:594    6.00    (#    594:10  Double Ambig)
 &rst
  ixpk= 594, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 550, 551, 547, 548,
 igr2= 555, 556, 555, 556,
 &end
#
#    0 AMB  10-2:595      0 AMB  10-1:595    6.00    (#    595:10  Double Ambig)
 &rst
  ixpk= 595, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
 igr1= 550, 551, 547, 548,
 igr2= 555, 556, 555, 556,
 &end
#
#    0 AMB  10-2:596      0 AMB  10-1:596    8.00    (#    596:10  Double Ambig)
 &rst
  ixpk= 596, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.70, r4=13.20,
 igr1= 532, 533, 532, 533,
 igr2= 555, 556, 555, 556,
 &end
#
#   13 ASN  HA           13 ASN  HD2+        8.00    (#    599:10  Unique         2.61, 4.14 A)
 &rst
  ixpk= 599, nxpk= 10, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 199, 200,
 &end
#
#   47 GLU  HA           47 GLU  HN          6.00    (#    618:10  Unique         2.30, 2.93 A)
 &rst
  ixpk= 618, nxpk= 10, iat= 734, 732, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:619     31 LYS  HN          3.50    (#    619:10  Single Ambig)
 &rst
  ixpk= 619, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 474, 475, 474, 475,
 &end
#
#   46 LYS  HB+          46 LYS  HN          6.00    (#    620:10  Unique         2.33, 2.76 A)
 &rst
  ixpk= 620, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 714, 715,
 &end
#
#   46 LYS  HB-          47 GLU  HN          4.50    (#    622:10  Unique         2.01, 3.39 A)
 &rst
  ixpk= 622, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 714, 715,
 &end
#
#    0 AMB  10-2:623     48 LEU  HN          3.50    (#    623:10  Single Ambig)
 &rst
  ixpk= 623, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 751, 752,  82,  83,  82,  83,
 &end
#
#   24 ARG  HG-          24 ARG  HN          6.00    (#    624:10  Unique         2.21, 3.62 A)
 &rst
  ixpk= 624, nxpk= 10, iat=  -1, 345, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 352, 353,
 &end
#
#   24 ARG  HG-          25 THR  HN          6.00    (#    625:10  Unique         2.94, 4.18 A)
 &rst
  ixpk= 625, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 352, 353,
 &end
#
#    6 LYS  HB+           6 LYS  HN          3.50    (#    626:10  Unique         2.67, 3.22 A)
 &rst
  ixpk= 626, nxpk= 10, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  76,  77,
 &end
#
#   31 LYS  HA           34 GLU  HN          6.00    (#    627:10  Unique         2.96, 3.24 A)
 &rst
  ixpk= 627, nxpk= 10, iat= 466, 513, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   13 ASN  HN           13 ASN  HD2+        6.00    (#    628:10  Unique         2.63, 4.74 A)
 &rst
  ixpk= 628, nxpk= 10, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 199, 200,
 &end
#
#   13 ASN  HN           13 ASN  HD2-        8.00    (#    629:10  Unique         2.63, 4.74 A)
 &rst
  ixpk= 629, nxpk= 10, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr2= 199, 200,
 &end
#
#   12 GLU  HB+          13 ASN  HD2-        8.00    (#    631:10  Unique         4.35, 6.99 A)
 &rst
  ixpk= 631, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 179, 180,
 igr2= 199, 200,
 &end
#
#    0 AMB  10-2:632      0 AMB  10-1:632    8.00    (#    632:10  Double Ambig)
 &rst
  ixpk= 632, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.70, r4=13.20,
 igr1= 328, 329, 328, 329,
 igr2= 333, 334, 333, 334,
 &end
#
#    0 AMB  10-2:634     36 GLN  HE2-        8.00    (#    634:10  Single Ambig)
 &rst
  ixpk= 634, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 550, 551, 547, 548,
 igr2= 555, 556,
 &end
#
#    0 AMB  10-2:635     36 GLN  HE2-        8.00    (#    635:10  Single Ambig)
 &rst
  ixpk= 635, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.31, r4=11.81,
 igr1= 550, 551, 547, 548,
 igr2= 555, 556,
 &end
#
#    0 AMB  10-2:639     39 GLN  HE2-        6.00    (#    639:10  Single Ambig)
 &rst
  ixpk= 639, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 596, 597, 596, 597,
 igr2= 601, 602,
 &end
#
#   10 VAL  HA           17 LYS  HN          4.50    (#    640:10  Unique         3.91, 4.14 A)
 &rst
  ixpk= 640, nxpk= 10, iat= 149, 240, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   20 THR  MG2          22 GLN  HN          8.00    (#    643:10  Unique         4.65, 5.11 A)
 &rst
  ixpk= 643, nxpk= 10, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 306, 307, 308,
 &end
#
#   19 TRP  HZ2          19 TRP  HE1         4.50    (#    647:10  Unique         2.85, 2.87 A)
 &rst
  ixpk= 647, nxpk= 10, iat= 289, 286, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 GLN  HN           19 TRP  HE1         6.00    (#    648:10  Unique         2.60, 2.99 A)
 &rst
  ixpk= 648, nxpk= 10, iat= 321, 286, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   32 ALA  MB           36 GLN  HE2+        8.00    (#    650:10  Unique         4.52, 7.12 A)
 &rst
  ixpk= 650, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 490, 491, 492,
 igr2= 555, 556,
 &end
#
#   26 PRO  HB+          27 ALA  HN          8.00    (#    653:10  Unique         3.06, 3.49 A)
 &rst
  ixpk= 653, nxpk= 10, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 390, 391,
 &end
#
#   17 LYS  HD+          18 THR  HN          6.00    (#    656:10  Unique         3.36, 4.27 A)
 &rst
  ixpk= 656, nxpk= 10, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 250, 251,
 &end
#
#    0 AMB  10-2:658     37 GLY  HN          6.00    (#    658:10  Single Ambig)
 &rst
  ixpk= 658, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 532, 533, 532, 533,
 &end
#
#   17 LYS  HB+           9 TYR  HN          8.00    (#    659:10  Unique         3.76, 4.68 A)
 &rst
  ixpk= 659, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 244, 245,
 &end
#
#   17 LYS  HB-           9 TYR  HN          8.00    (#    660:10  Unique         3.76, 4.68 A)
 &rst
  ixpk= 660, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 244, 245,
 &end
#
#   17 LYS  HA            9 TYR  HN          8.00    (#    661:10  Unique         4.70, 4.87 A)
 &rst
  ixpk= 661, nxpk= 10, iat= 242, 126, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    5 ALA  MB           19 TRP  HN          8.00    (#    663:10  Unique         2.58, 3.69 A)
 &rst
  ixpk= 663, nxpk= 10, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1=  66,  67,  68,
 &end
#
#   33 MET  HG+          40 LEU  HN          6.00    (#    664:10  Unique         3.70, 5.11 A)
 &rst
  ixpk= 664, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 503, 504,
 &end
#
#    3 ARG  HB-           3 ARG  HN          8.00    (#    665:10  Unique         2.40, 3.23 A)
 &rst
  ixpk= 665, nxpk= 10, iat=  -1,  24, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1=  28,  29,
 &end
#
#    7 TYR  HD            6 LYS  HN          8.00    (#    667:10  Unique         2.61, 4.82 A)
 &rst
  ixpk= 667, nxpk= 10, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 102, 111,
 &end
#
#    9 TYR  HN            8 SER  HN          6.00    (#    672:10  Unique         4.36, 4.42 A)
 &rst
  ixpk= 672, nxpk= 10, iat= 126, 115, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   45 ILE  HN            8 SER  HN          8.00    (#    673:10  Unique         4.49, 5.06 A)
 &rst
  ixpk= 673, nxpk= 10, iat= 691, 115, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    8 SER  HB-           8 SER  HN          6.00    (#    674:10  Unique         2.75, 3.34 A)
 &rst
  ixpk= 674, nxpk= 10, iat=  -1, 115, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 119, 120,
 &end
#
#    8 SER  HB+           9 TYR  HN          4.50    (#    678:10  Unique         2.25, 3.59 A)
 &rst
  ixpk= 678, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 119, 120,
 &end
#
#   43 PHE  HD           10 VAL  HN          6.00    (#    682:10  Unique         4.19, 6.59 A)
 &rst
  ixpk= 682, nxpk= 10, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 660, 668,
 &end
#
#    9 TYR  HE           10 VAL  HN          8.00    (#    683:10  Unique         5.18, 6.36 A)
 &rst
  ixpk= 683, nxpk= 10, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 136, 141,
 &end
#
#   11 ASP  HN           13 ASN  HN          6.00    (#    686:10  Unique         3.26, 4.05 A)
 &rst
  ixpk= 686, nxpk= 10, iat= 163, 190, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   12 GLU  HB+          13 ASN  HD2+        6.00    (#    691:10  Unique         4.35, 6.99 A)
 &rst
  ixpk= 691, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 179, 180,
 igr2= 199, 200,
 &end
#
#   12 GLU  HB-          13 ASN  HD2+        8.00    (#    693:10  Unique         4.35, 6.99 A)
 &rst
  ixpk= 693, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 179, 180,
 igr2= 199, 200,
 &end
#
#   18 THR  HN           17 LYS  HN          6.00    (#    699:10  Unique         4.43, 4.46 A)
 &rst
  ixpk= 699, nxpk= 10, iat= 262, 240, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   19 TRP  HD1          22 GLN  HN          6.00    (#    702:10  Unique         3.95, 4.19 A)
 &rst
  ixpk= 702, nxpk= 10, iat= 284, 321, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:703     22 GLN  HE2-        6.00    (#    703:10  Single Ambig)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 328, 329, 328, 329,
 igr2= 333, 334,
 &end
#
#   24 ARG  HN           23 GLY  HN          6.00    (#    704:10  Unique         3.78, 4.50 A)
 &rst
  ixpk= 704, nxpk= 10, iat= 345, 338, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   22 GLN  HN           23 GLY  HN          8.00    (#    705:10  Unique         4.47, 4.58 A)
 &rst
  ixpk= 705, nxpk= 10, iat= 321, 338, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#    9 TYR  HD           28 VAL  HN          6.00    (#    709:10  Unique         4.33, 5.58 A)
 &rst
  ixpk= 709, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 134, 143,
 &end
#
#   29 ILE  HG1-         28 VAL  HN          8.00    (#    711:10  Unique         4.35, 5.19 A)
 &rst
  ixpk= 711, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 433, 434,
 &end
#
#   29 ILE  MD1          28 VAL  HN          8.00    (#    712:10  Unique         5.94, 6.74 A)
 &rst
  ixpk= 712, nxpk= 10, iat=  -1, 407, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 436, 437, 438,
 &end
#
#   30 LYS  HB-          29 ILE  HN          6.00    (#    713:10  Unique         4.33, 4.89 A)
 &rst
  ixpk= 713, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 446, 447,
 &end
#
#   28 VAL  MGX          29 ILE  HN          6.00    (#    714:10  Unique         2.70, 4.44 A)
 &rst
  ixpk= 714, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#   28 VAL  MGY          29 ILE  HN          8.00    (#    715:10  Unique         2.70, 4.44 A)
 &rst
  ixpk= 715, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 413, 414, 415, 417, 418, 419,
 &end
#
#   25 THR  MG2          29 ILE  HN          8.00    (#    716:10  Unique         4.09, 5.08 A)
 &rst
  ixpk= 716, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 9.61, r4=10.11,
 igr1= 375, 376, 377,
 &end
#
#   26 PRO  HB+          29 ILE  HN          6.00    (#    717:10  Unique         2.52, 3.53 A)
 &rst
  ixpk= 717, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 390, 391,
 &end
#
#   29 ILE  HG1+         29 ILE  HN          8.00    (#    718:10  Unique         2.17, 2.86 A)
 &rst
  ixpk= 718, nxpk= 10, iat=  -1, 423, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 433, 434,
 &end
#
#   30 LYS  HG-          30 LYS  HN          4.50    (#    719:10  Unique         4.21, 4.42 A)
 &rst
  ixpk= 719, nxpk= 10, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 449, 450,
 &end
#
#   29 ILE  HG1-         30 LYS  HN          6.00    (#    720:10  Unique         4.23, 4.62 A)
 &rst
  ixpk= 720, nxpk= 10, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 433, 434,
 &end
#
#    0 AMB  10-2:722     31 LYS  HN          8.00    (#    722:10  Single Ambig)
 &rst
  ixpk= 722, nxpk= 10, iat=  -1, 464, r1= 1.30, r2= 1.80, r3=11.54, r4=12.04,
 igr1= 425, 477, 478, 477, 478, 455, 456, 455, 456,
 &end
#
#   28 VAL  HA           32 ALA  HN          8.00    (#    723:10  Unique         3.69, 3.88 A)
 &rst
  ixpk= 723, nxpk= 10, iat= 409, 486, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,  &end
#
#   34 GLU  HB+          34 GLU  HN          2.80    (#    724:10  Unique         2.36, 3.02 A)
 &rst
  ixpk= 724, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 517, 518,
 &end
#
#   38 LYS  HG+          37 GLY  HN          6.00    (#    727:10  Unique         4.30, 5.40 A)
 &rst
  ixpk= 727, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 574, 575,
 &end
#
#   43 PHE  HD           40 LEU  HN          8.00    (#    730:10  Unique         4.39, 6.88 A)
 &rst
  ixpk= 730, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
 igr1= 660, 668,
 &end
#
#    0 AMB  10-2:731     40 LEU  HN          2.80    (#    731:10  Single Ambig)
 &rst
  ixpk= 731, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 610, 611, 613,
 &end
#
#   44 LEU  HB+          40 LEU  HN          6.00    (#    732:10  Unique         6.22, 7.01 A)
 &rst
  ixpk= 732, nxpk= 10, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 676, 677,
 &end
#
#   48 LEU  MDY          41 GLU  HN          6.00    (#    733:10  Unique         3.06, 5.93 A)
 &rst
  ixpk= 733, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 756, 757, 758, 760, 761, 762,
 &end
#
#   43 PHE  HE           42 ASP  HN          6.00    (#    734:10  Unique         4.25, 6.10 A)
 &rst
  ixpk= 734, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 662, 666,
 &end
#
#   38 LYS  HG+          42 ASP  HN          6.00    (#    735:10  Unique         5.43, 6.73 A)
 &rst
  ixpk= 735, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 574, 575,
 &end
#
#   40 LEU  MDX          42 ASP  HN          8.00    (#    736:10  Unique         5.50, 7.06 A)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1, 640, r1= 1.30, r2= 1.80, r3=10.78, r4=11.28,
 igr1= 615, 616, 617, 619, 620, 621,
 &end
#
#   46 LYS  HN           45 ILE  HN          6.00    (#    737:10  Unique         2.04, 2.22 A)
 &rst
  ixpk= 737, nxpk= 10, iat= 710, 691, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   44 LEU  HN           45 ILE  HN          6.00    (#    738:10  Unique         4.54, 4.61 A)
 &rst
  ixpk= 738, nxpk= 10, iat= 672, 691, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   47 GLU  HN           46 LYS  HN          2.80    (#    739:10  Unique         2.10, 2.65 A)
 &rst
  ixpk= 739, nxpk= 10, iat= 732, 710, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   45 ILE  HN           46 LYS  HN          6.00    (#    740:10  Unique         2.04, 2.22 A)
 &rst
  ixpk= 740, nxpk= 10, iat= 691, 710, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA  91           H1       ALA  91   1.975  -5.726 -10.472
    2    H2   ALA  91           H2       ALA  91   1.185  -5.905  -9.053
    3    H3   ALA  91           H3       ALA  91   0.918  -4.578  -9.979
    4    HA   ALA  91           HA       ALA  91   3.177  -3.816  -9.666
    5    HB1  ALA  91           HB1      ALA  91   1.744  -4.365  -7.023
    6    HB2  ALA  91           HB2      ALA  91   3.012  -3.153  -7.293
    7    HB3  ALA  91           HB3      ALA  91   1.451  -2.984  -8.106
    8    H    ALA  92           H        ALA  92   5.202  -3.985  -8.499
    9    HA   ALA  92           HA       ALA  92   5.942  -6.571  -7.284
   10    HB1  ALA  92           HB1      ALA  92   7.287  -5.499  -9.809
   11    HB2  ALA  92           HB2      ALA  92   7.784  -6.935  -8.891
   12    HB3  ALA  92           HB3      ALA  92   6.228  -6.925  -9.728
   13    H    ARG  93           H        ARG  93   8.259  -6.527  -6.552
   14    HA   ARG  93           HA       ARG  93   9.386  -3.846  -5.951
   15    HB2  ARG  93           HB2      ARG  93   9.512  -4.330  -3.531
   16    HB3  ARG  93           HB3      ARG  93   7.889  -4.096  -4.145
   17    HG2  ARG  93           HG2      ARG  93   7.421  -6.509  -4.068
   18    HG3  ARG  93           HG3      ARG  93   9.091  -6.848  -3.594
   19    HD2  ARG  93           HD2      ARG  93   7.713  -6.938  -1.612
   20    HD3  ARG  93           HD3      ARG  93   8.772  -5.544  -1.511
   21    HE   ARG  93           HE       ARG  93   6.955  -4.101  -1.642
   22   HH11  ARG  93          HH11      ARG  93   5.742  -7.336  -2.275
   23   HH12  ARG  93          HH12      ARG  93   4.081  -6.839  -2.119
   24   HH21  ARG  93          HH21      ARG  93   4.820  -3.537  -1.482
   25   HH22  ARG  93          HH22      ARG  93   3.576  -4.735  -1.686
   26    HA   PRO  94           HA       PRO  94  12.528  -7.210  -6.790
   27    HB2  PRO  94           HB2      PRO  94  13.460  -6.546  -9.249
   28    HB3  PRO  94           HB3      PRO  94  11.844  -7.265  -9.031
   29    HG2  PRO  94           HG2      PRO  94  12.516  -4.301  -9.239
   30    HG3  PRO  94           HG3      PRO  94  11.363  -5.242 -10.246
   31    HD2  PRO  94           HD2      PRO  94  10.537  -3.866  -8.034
   32    HD3  PRO  94           HD3      PRO  94   9.835  -5.448  -8.488
   33    H    ALA  95           H        ALA  95  12.875  -4.998  -5.069
   34    HA   ALA  95           HA       ALA  95  14.221  -3.416  -4.197
   35    HB1  ALA  95           HB1      ALA  95  16.440  -5.219  -5.233
   36    HB2  ALA  95           HB2      ALA  95  16.526  -4.100  -3.853
   37    HB3  ALA  95           HB3      ALA  95  15.463  -5.507  -3.779
   38    H    LYS  96           H        LYS  96  16.605  -2.223  -4.722
   39    HA   LYS  96           HA       LYS  96  16.299  -0.848  -7.333
   40    HB2  LYS  96           HB2      LYS  96  15.079   0.264  -5.398
   41    HB3  LYS  96           HB3      LYS  96  16.653   0.553  -4.651
   42    HG2  LYS  96           HG2      LYS  96  17.301   1.987  -6.584
   43    HG3  LYS  96           HG3      LYS  96  15.764   1.607  -7.386
   44    HD2  LYS  96           HD2      LYS  96  14.534   2.586  -5.409
   45    HD3  LYS  96           HD3      LYS  96  16.086   2.983  -4.681
   46    HE2  LYS  96           HE2      LYS  96  15.264   4.985  -5.598
   47    HE3  LYS  96           HE3      LYS  96  16.584   4.474  -6.647
   48    HZ1  LYS  96           HZ1      LYS  96  14.476   5.238  -7.799
   49    HZ2  LYS  96           HZ2      LYS  96  14.978   3.773  -8.305
   50    HZ3  LYS  96           HZ3      LYS  96  13.706   3.911  -7.257
   51    H    TYR  97           H        TYR  97  18.443  -1.698  -4.662
   52    HA   TYR  97           HA       TYR  97  20.752  -1.285  -6.499
   53    HB2  TYR  97           HB2      TYR  97  20.894  -0.792  -3.515
   54    HB3  TYR  97           HB3      TYR  97  22.050  -0.317  -4.752
   55    HD1  TYR  97           HD2      TYR  97  21.451   1.599  -6.339
   56    HD2  TYR  97           HD1      TYR  97  19.103   0.630  -2.856
   57    HE1  TYR  97           HE2      TYR  97  20.321   3.807  -6.481
   58    HE2  TYR  97           HE1      TYR  97  18.069   2.885  -2.929
   59    HH   TYR  97           HH       TYR  97  17.995   4.934  -4.001
   60    H    SER  98           H        SER  98  22.595  -2.642  -6.037
   61    HA   SER  98           HA       SER  98  22.268  -4.958  -4.201
   62    HB2  SER  98           HB2      SER  98  21.463  -5.644  -6.469
   63    HB3  SER  98           HB3      SER  98  23.049  -5.178  -7.125
   64    HG   SER  98           HG       SER  98  23.157  -7.322  -6.734
   65    H    TYR  99           H        TYR  99  24.176  -5.714  -3.399
   66    HA   TYR  99           HA       TYR  99  26.751  -4.592  -4.353
   67    HB2  TYR  99           HB2      TYR  99  27.386  -3.739  -2.195
   68    HB3  TYR  99           HB3      TYR  99  25.910  -2.982  -2.725
   69    HD1  TYR  99           HD1      TYR  99  23.734  -3.498  -1.616
   70    HD2  TYR  99           HD2      TYR  99  27.447  -5.193  -0.228
   71    HE1  TYR  99           HE1      TYR  99  22.712  -3.927   0.627
   72    HE2  TYR  99           HE2      TYR  99  26.426  -5.638   1.994
   73    HH   TYR  99           HH       TYR  99  24.561  -5.379   3.330
   74    H    VAL 100           H        VAL 100  28.618  -5.447  -2.978
   75    HA   VAL 100           HA       VAL 100  28.397  -8.408  -2.836
   76    HB   VAL 100           HB       VAL 100  30.622  -8.391  -3.815
   77   HG11  VAL 100          HG11      VAL 100  28.790  -6.640  -5.497
   78   HG12  VAL 100          HG12      VAL 100  30.061  -7.752  -6.063
   79   HG13  VAL 100          HG13      VAL 100  28.618  -8.382  -5.269
   80   HG21  VAL 100          HG21      VAL 100  31.696  -6.411  -4.722
   81   HG22  VAL 100          HG22      VAL 100  30.419  -5.368  -4.074
   82   HG23  VAL 100          HG23      VAL 100  31.513  -6.244  -2.976
   83    H    ASP 101           H        ASP 101  30.405  -9.395  -1.803
   84    HA   ASP 101           HA       ASP 101  31.656  -7.738   0.324
   85    HB2  ASP 101           HB2      ASP 101  29.804  -8.807   1.470
   86    HB3  ASP 101           HB3      ASP 101  30.297 -10.395   0.867
   87    H    GLU 102           H        GLU 102  31.720 -11.077  -1.154
   88    HA   GLU 102           HA       GLU 102  34.566 -10.626  -1.806
   89    HB2  GLU 102           HB2      GLU 102  34.634 -11.571   0.440
   90    HB3  GLU 102           HB3      GLU 102  33.549 -12.889  -0.028
   91    HG2  GLU 102           HG2      GLU 102  35.211 -13.777  -1.559
   92    HG3  GLU 102           HG3      GLU 102  36.262 -12.381  -1.300
   93    H    ASN 103           H        ASN 103  32.117 -13.311  -1.838
   94    HA   ASN 103           HA       ASN 103  33.321 -14.435  -4.172
   95    HB2  ASN 103           HB2      ASN 103  31.755 -16.204  -3.892
   96    HB3  ASN 103           HB3      ASN 103  32.257 -15.713  -2.285
   97   HD21  ASN 103          HD22      ASN 103  29.602 -16.769  -3.871
   98   HD22  ASN 103          HD21      ASN 103  28.371 -15.894  -2.980
   99    H    GLY 104           H        GLY 104  30.841 -12.049  -3.931
  100    HA2  GLY 104           HA2      GLY 104  30.382 -11.391  -6.557
  101    HA3  GLY 104           HA3      GLY 104  29.350 -12.805  -6.328
  102    H    GLU 105           H        GLU 105  27.633 -11.176  -6.838
  103    HA   GLU 105           HA       GLU 105  26.729  -9.158  -5.055
  104    HB2  GLU 105           HB2      GLU 105  25.144 -11.079  -6.774
  105    HB3  GLU 105           HB3      GLU 105  24.464  -9.743  -5.829
  106    HG2  GLU 105           HG2      GLU 105  25.905  -8.134  -7.064
  107    HG3  GLU 105           HG3      GLU 105  26.515  -9.458  -8.061
  108    H    THR 106           H        THR 106  26.019  -9.156  -3.067
  109    HA   THR 106           HA       THR 106  25.592 -11.753  -1.773
  110    HB   THR 106           HB       THR 106  27.716 -10.535  -1.268
  111    HG1  THR 106           HG1      THR 106  27.628 -11.323   0.821
  112   HG21  THR 106          HG21      THR 106  26.754  -8.243  -0.792
  113   HG22  THR 106          HG22      THR 106  25.975  -8.916   0.650
  114   HG23  THR 106          HG23      THR 106  27.735  -8.894   0.512
  115    H    LYS 107           H        LYS 107  24.487  -8.359  -1.771
  116    HA   LYS 107           HA       LYS 107  21.867  -9.126  -0.614
  117    HB2  LYS 107           HB2      LYS 107  23.898  -7.327   0.768
  118    HB3  LYS 107           HB3      LYS 107  22.170  -7.141   1.050
  119    HG2  LYS 107           HG2      LYS 107  22.047  -9.538   1.762
  120    HG3  LYS 107           HG3      LYS 107  23.818  -9.625   1.640
  121    HD2  LYS 107           HD2      LYS 107  24.051  -7.850   3.329
  122    HD3  LYS 107           HD3      LYS 107  22.279  -7.708   3.443
  123    HE2  LYS 107           HE2      LYS 107  22.142 -10.094   4.149
  124    HE3  LYS 107           HE3      LYS 107  23.900 -10.230   4.050
  125    HZ1  LYS 107           HZ1      LYS 107  22.426  -8.419   5.904
  126    HZ2  LYS 107           HZ2      LYS 107  23.171  -9.809   6.328
  127    HZ3  LYS 107           HZ3      LYS 107  24.054  -8.535   5.816
  128    H    THR 108           H        THR 108  20.342  -7.364  -0.613
  129    HA   THR 108           HA       THR 108  20.826  -5.246  -2.659
  130    HB   THR 108           HB       THR 108  18.555  -5.670  -3.536
  131    HG1  THR 108           HG1      THR 108  17.544  -7.654  -2.920
  132   HG21  THR 108          HG21      THR 108  20.520  -6.795  -4.595
  133   HG22  THR 108          HG22      THR 108  20.204  -8.230  -3.601
  134   HG23  THR 108          HG23      THR 108  19.004  -7.685  -4.792
  135    H    TRP 109           H        TRP 109  19.186  -3.533  -2.673
  136    HA   TRP 109           HA       TRP 109  17.825  -2.984  -0.096
  137    HB2  TRP 109           HB2      TRP 109  20.195  -2.292   0.184
  138    HB3  TRP 109           HB3      TRP 109  20.071  -1.273  -1.238
  139    HD1  TRP 109           HD1      TRP 109  17.729  -1.492   1.864
  140    HE1  TRP 109           HE1      TRP 109  17.497   0.842   2.902
  141    HE3  TRP 109           HE3      TRP 109  21.003   1.077  -1.146
  142    HZ2  TRP 109           HZ2      TRP 109  18.724   3.425   2.613
  143    HZ3  TRP 109           HZ3      TRP 109  21.483   3.469  -0.692
  144    HH2  TRP 109           HH2      TRP 109  20.377   4.645   1.193
  145    H    THR 110           H        THR 110  16.409  -1.144  -0.162
  146    HA   THR 110           HA       THR 110  15.275  -0.585  -2.860
  147    HB   THR 110           HB       THR 110  13.231  -0.050  -1.512
  148    HG1  THR 110           HG1      THR 110  13.400  -0.672   0.747
  149   HG21  THR 110          HG21      THR 110  14.404  -2.767  -0.770
  150   HG22  THR 110          HG22      THR 110  12.694  -2.299  -0.744
  151   HG23  THR 110          HG23      THR 110  13.553  -2.385  -2.286
  152    H    GLY 111           H        GLY 111  16.998   1.034  -0.356
  153    HA2  GLY 111           HA2      GLY 111  17.621   3.350  -0.407
  154    HA3  GLY 111           HA3      GLY 111  16.139   3.745  -1.276
  155    H    GLN 112           H        GLN 112  14.911   1.687   0.928
  156    HA   GLN 112           HA       GLN 112  13.946   3.788   2.690
  157    HB2  GLN 112           HB2      GLN 112  12.609   1.861   1.785
  158    HB3  GLN 112           HB3      GLN 112  13.560   0.759   2.795
  159    HG2  GLN 112           HG2      GLN 112  12.765   1.913   4.826
  160    HG3  GLN 112           HG3      GLN 112  11.857   3.066   3.841
  161   HE21  GLN 112          HE22      GLN 112  11.215   0.626   5.851
  162   HE22  GLN 112          HE21      GLN 112   9.890  -0.144   4.995
  163    H    GLY 113           H        GLY 113  14.473   4.170   4.824
  164    HA2  GLY 113           HA2      GLY 113  15.445   3.964   6.910
  165    HA3  GLY 113           HA3      GLY 113  15.808   2.286   6.538
  166    H    ARG 114           H        ARG 114  17.713   2.780   7.833
  167    HA   ARG 114           HA       ARG 114  19.808   4.572   7.143
  168    HB2  ARG 114           HB2      ARG 114  19.473   3.371   9.318
  169    HB3  ARG 114           HB3      ARG 114  19.973   1.862   8.542
  170    HG2  ARG 114           HG2      ARG 114  22.222   2.843   8.106
  171    HG3  ARG 114           HG3      ARG 114  21.688   4.369   8.851
  172    HD2  ARG 114           HD2      ARG 114  21.231   3.143  10.973
  173    HD3  ARG 114           HD3      ARG 114  21.825   1.646  10.225
  174    HE   ARG 114           HE       ARG 114  23.825   3.677   9.985
  175   HH11  ARG 114          HH11      ARG 114  22.416   1.674  12.495
  176   HH12  ARG 114          HH12      ARG 114  23.839   1.759  13.497
  177   HH21  ARG 114          HH21      ARG 114  25.617   3.753  11.328
  178   HH22  ARG 114          HH22      ARG 114  25.609   2.892  12.838
  179    H    THR 115           H        THR 115  21.376   4.565   5.652
  180    HA   THR 115           HA       THR 115  21.499   2.917   3.417
  181    HB   THR 115           HB       THR 115  23.807   4.462   4.642
  182    HG1  THR 115           HG1      THR 115  22.984   6.169   3.404
  183   HG21  THR 115          HG21      THR 115  23.188   3.683   1.752
  184   HG22  THR 115          HG22      THR 115  24.494   4.776   2.260
  185   HG23  THR 115          HG23      THR 115  24.541   3.079   2.741
  186    HA   PRO 116           HA       PRO 116  23.404  -0.868   5.019
  187    HB2  PRO 116           HB2      PRO 116  24.263  -1.200   2.147
  188    HB3  PRO 116           HB3      PRO 116  23.479  -2.383   3.242
  189    HG2  PRO 116           HG2      PRO 116  22.064  -1.094   1.306
  190    HG3  PRO 116           HG3      PRO 116  21.350  -1.398   2.924
  191    HD2  PRO 116           HD2      PRO 116  22.516   1.162   1.837
  192    HD3  PRO 116           HD3      PRO 116  21.085   0.894   2.884
  193    H    ALA 117           H        ALA 117  25.494  -1.552   5.616
  194    HA   ALA 117           HA       ALA 117  27.408   0.413   5.931
  195    HB1  ALA 117           HB1      ALA 117  27.805  -2.611   5.993
  196    HB2  ALA 117           HB2      ALA 117  28.870  -1.400   6.743
  197    HB3  ALA 117           HB3      ALA 117  27.207  -1.592   7.322
  198    H    VAL 118           H        VAL 118  27.565  -2.173   3.406
  199    HA   VAL 118           HA       VAL 118  30.072  -1.287   2.347
  200    HB   VAL 118           HB       VAL 118  27.847  -2.844   0.978
  201   HG11  VAL 118          HG11      VAL 118  29.375  -1.984  -0.747
  202   HG12  VAL 118          HG12      VAL 118  30.779  -2.548   0.191
  203   HG13  VAL 118          HG13      VAL 118  29.645  -3.711  -0.522
  204   HG21  VAL 118          HG21      VAL 118  28.716  -4.009   2.981
  205   HG22  VAL 118          HG22      VAL 118  29.253  -4.834   1.520
  206   HG23  VAL 118          HG23      VAL 118  30.379  -3.787   2.402
  207    H    ILE 119           H        ILE 119  26.729  -0.383   1.466
  208    HA   ILE 119           HA       ILE 119  27.421   1.307  -0.775
  209    HB   ILE 119           HB       ILE 119  25.037   1.443   1.114
  210   HG12  ILE 119          HG12      ILE 119  25.119  -0.751   0.015
  211   HG13  ILE 119          HG13      ILE 119  23.756   0.213  -0.516
  212   HG21  ILE 119          HG21      ILE 119  23.912   2.619  -0.792
  213   HG22  ILE 119          HG22      ILE 119  25.222   3.549  -0.063
  214   HG23  ILE 119          HG23      ILE 119  25.489   2.728  -1.605
  215   HD11  ILE 119          HD11      ILE 119  24.737  -0.995  -2.383
  216   HD12  ILE 119          HD12      ILE 119  24.954   0.735  -2.639
  217   HD13  ILE 119          HD13      ILE 119  26.325  -0.264  -2.090
  218    H    LYS 120           H        LYS 120  26.980   1.962   2.713
  219    HA   LYS 120           HA       LYS 120  27.517   4.779   2.706
  220    HB2  LYS 120           HB2      LYS 120  26.476   3.808   4.596
  221    HB3  LYS 120           HB3      LYS 120  27.691   2.547   4.759
  222    HG2  LYS 120           HG2      LYS 120  29.363   4.136   5.528
  223    HG3  LYS 120           HG3      LYS 120  28.236   5.493   5.264
  224    HD2  LYS 120           HD2      LYS 120  26.729   4.616   6.995
  225    HD3  LYS 120           HD3      LYS 120  27.711   3.155   7.147
  226    HE2  LYS 120           HE2      LYS 120  28.202   4.568   9.020
  227    HE3  LYS 120           HE3      LYS 120  29.623   4.492   7.986
  228    HZ1  LYS 120           HZ1      LYS 120  29.103   6.768   8.768
  229    HZ2  LYS 120           HZ2      LYS 120  29.105   6.698   7.136
  230    HZ3  LYS 120           HZ3      LYS 120  27.679   6.755   7.970
  231    H    LYS 121           H        LYS 121  29.763   2.032   3.262
  232    HA   LYS 121           HA       LYS 121  32.089   3.722   3.423
  233    HB2  LYS 121           HB2      LYS 121  31.793   0.740   2.848
  234    HB3  LYS 121           HB3      LYS 121  33.351   1.547   2.991
  235    HG2  LYS 121           HG2      LYS 121  31.287   1.187   5.190
  236    HG3  LYS 121           HG3      LYS 121  32.893   0.483   5.055
  237    HD2  LYS 121           HD2      LYS 121  33.644   3.072   5.045
  238    HD3  LYS 121           HD3      LYS 121  32.062   3.290   5.788
  239    HE2  LYS 121           HE2      LYS 121  33.535   3.098   7.592
  240    HE3  LYS 121           HE3      LYS 121  32.764   1.512   7.516
  241    HZ1  LYS 121           HZ1      LYS 121  34.773   0.666   6.414
  242    HZ2  LYS 121           HZ2      LYS 121  35.422   2.172   6.308
  243    HZ3  LYS 121           HZ3      LYS 121  35.243   1.449   7.768
  244    H    ALA 122           H        ALA 122  30.629   2.119   0.583
  245    HA   ALA 122           HA       ALA 122  32.663   2.897  -1.245
  246    HB1  ALA 122           HB1      ALA 122  30.933   1.246  -1.753
  247    HB2  ALA 122           HB2      ALA 122  29.668   2.495  -1.666
  248    HB3  ALA 122           HB3      ALA 122  30.897   2.563  -2.941
  249    H    MET 123           H        MET 123  29.702   4.663  -0.187
  250    HA   MET 123           HA       MET 123  30.149   6.973  -1.800
  251    HB2  MET 123           HB2      MET 123  28.612   6.566   0.789
  252    HB3  MET 123           HB3      MET 123  28.618   8.088  -0.113
  253    HG2  MET 123           HG2      MET 123  27.644   7.040  -2.063
  254    HG3  MET 123           HG3      MET 123  27.810   5.440  -1.360
  255    HE1  MET 123           HE1      MET 123  26.388   8.854   0.237
  256    HE2  MET 123           HE2      MET 123  25.810   8.772  -1.446
  257    HE3  MET 123           HE3      MET 123  24.664   8.598  -0.097
  258    H    GLU 124           H        GLU 124  31.214   6.293   1.572
  259    HA   GLU 124           HA       GLU 124  32.415   8.935   1.754
  260    HB2  GLU 124           HB2      GLU 124  32.171   6.668   3.749
  261    HB3  GLU 124           HB3      GLU 124  32.924   8.226   4.093
  262    HG2  GLU 124           HG2      GLU 124  30.766   9.350   3.349
  263    HG3  GLU 124           HG3      GLU 124  30.021   7.751   3.311
  264    H    GLU 125           H        GLU 125  33.779   5.652   1.417
  265    HA   GLU 125           HA       GLU 125  36.528   6.821   1.641
  266    HB2  GLU 125           HB2      GLU 125  35.614   3.956   2.033
  267    HB3  GLU 125           HB3      GLU 125  37.278   4.532   2.091
  268    HG2  GLU 125           HG2      GLU 125  36.467   6.184   3.923
  269    HG3  GLU 125           HG3      GLU 125  35.031   5.170   4.021
  270    H    GLN 126           H        GLN 126  34.416   5.363  -0.714
  271    HA   GLN 126           HA       GLN 126  36.713   5.340  -2.646
  272    HB2  GLN 126           HB2      GLN 126  34.045   3.925  -2.955
  273    HB3  GLN 126           HB3      GLN 126  35.415   3.887  -4.063
  274    HG2  GLN 126           HG2      GLN 126  36.801   2.826  -2.275
  275    HG3  GLN 126           HG3      GLN 126  35.379   2.761  -1.229
  276   HE21  GLN 126          HE22      GLN 126  36.668   0.375  -1.776
  277   HE22  GLN 126          HE21      GLN 126  35.689  -0.563  -2.892
  278    H    GLY 127           H        GLY 127  34.218   7.339  -1.664
  279    HA2  GLY 127           HA2      GLY 127  33.335   9.264  -2.533
  280    HA3  GLY 127           HA3      GLY 127  34.538   9.174  -3.820
  281    H    LYS 128           H        LYS 128  32.327   6.478  -3.519
  282    HA   LYS 128           HA       LYS 128  31.360   6.898  -6.240
  283    HB2  LYS 128           HB2      LYS 128  30.904   4.764  -4.112
  284    HB3  LYS 128           HB3      LYS 128  30.040   4.735  -5.648
  285    HG2  LYS 128           HG2      LYS 128  32.152   4.750  -6.903
  286    HG3  LYS 128           HG3      LYS 128  33.077   4.732  -5.389
  287    HD2  LYS 128           HD2      LYS 128  32.252   2.556  -4.794
  288    HD3  LYS 128           HD3      LYS 128  31.015   2.596  -6.067
  289    HE2  LYS 128           HE2      LYS 128  32.810   2.658  -7.794
  290    HE3  LYS 128           HE3      LYS 128  34.040   2.546  -6.513
  291    HZ1  LYS 128           HZ1      LYS 128  33.045   0.381  -5.892
  292    HZ2  LYS 128           HZ2      LYS 128  31.933   0.531  -7.116
  293    HZ3  LYS 128           HZ3      LYS 128  33.530   0.355  -7.458
  294    H    GLN 129           H        GLN 129  29.085   6.464  -6.776
  295    HA   GLN 129           HA       GLN 129  27.079   7.712  -4.946
  296    HB2  GLN 129           HB2      GLN 129  27.331   8.109  -7.958
  297    HB3  GLN 129           HB3      GLN 129  25.942   8.605  -6.980
  298    HG2  GLN 129           HG2      GLN 129  27.451  10.076  -5.628
  299    HG3  GLN 129           HG3      GLN 129  28.795   9.635  -6.678
  300   HE21  GLN 129          HE22      GLN 129  29.150  10.977  -8.464
  301   HE22  GLN 129          HE21      GLN 129  27.939  12.081  -9.095
  302    H    LEU 130           H        LEU 130  24.836   7.001  -5.535
  303    HA   LEU 130           HA       LEU 130  24.737   4.211  -5.101
  304    HB2  LEU 130           HB2      LEU 130  22.580   6.213  -5.910
  305    HB3  LEU 130           HB3      LEU 130  22.254   4.555  -5.465
  306    HG   LEU 130           HG       LEU 130  21.684   5.921  -3.639
  307   HD11  LEU 130          HD11      LEU 130  22.686   3.711  -3.126
  308   HD12  LEU 130          HD12      LEU 130  24.279   4.496  -2.942
  309   HD13  LEU 130          HD13      LEU 130  22.963   4.908  -1.841
  310   HD21  LEU 130          HD21      LEU 130  24.550   6.905  -3.370
  311   HD22  LEU 130          HD22      LEU 130  23.201   7.860  -4.055
  312   HD23  LEU 130          HD23      LEU 130  23.151   7.315  -2.373
  313    H    GLU 131           H        GLU 131  24.583   5.929  -8.128
  314    HA   GLU 131           HA       GLU 131  23.384   3.936  -9.770
  315    HB2  GLU 131           HB2      GLU 131  24.354   5.101 -11.646
  316    HB3  GLU 131           HB3      GLU 131  23.698   6.248 -10.484
  317    HG2  GLU 131           HG2      GLU 131  26.002   6.689  -9.628
  318    HG3  GLU 131           HG3      GLU 131  26.654   5.530 -10.791
  319    H    ASP 132           H        ASP 132  26.639   3.937  -8.379
  320    HA   ASP 132           HA       ASP 132  27.702   1.953 -10.179
  321    HB2  ASP 132           HB2      ASP 132  29.064   3.420  -8.622
  322    HB3  ASP 132           HB3      ASP 132  28.534   2.389  -7.295
  323    H    PHE 133           H        PHE 133  25.356   1.757  -7.696
  324    HA   PHE 133           HA       PHE 133  25.533  -1.224  -7.465
  325    HB2  PHE 133           HB2      PHE 133  24.476   0.839  -5.492
  326    HB3  PHE 133           HB3      PHE 133  24.558  -0.892  -5.231
  327    HD1  PHE 133           HD1      PHE 133  26.824  -2.043  -5.120
  328    HD2  PHE 133           HD2      PHE 133  26.409   2.248  -5.125
  329    HE1  PHE 133           HE1      PHE 133  29.139  -1.824  -4.263
  330    HE2  PHE 133           HE2      PHE 133  28.724   2.471  -4.266
  331    HZ   PHE 133           HZ       PHE 133  30.099   0.420  -3.852
  332    H    LEU 134           H        LEU 134  23.581   1.374  -8.523
  333    HA   LEU 134           HA       LEU 134  20.932   0.489  -8.207
  334    HB2  LEU 134           HB2      LEU 134  21.747   2.711  -8.865
  335    HB3  LEU 134           HB3      LEU 134  22.338   2.076 -10.399
  336    HG   LEU 134           HG       LEU 134  20.330   3.518 -10.437
  337   HD11  LEU 134          HD11      LEU 134  19.118   2.338 -12.158
  338   HD12  LEU 134          HD12      LEU 134  20.863   2.139 -12.364
  339   HD13  LEU 134          HD13      LEU 134  19.889   0.808 -11.722
  340   HD21  LEU 134          HD21      LEU 134  19.195   2.519  -8.440
  341   HD22  LEU 134          HD22      LEU 134  18.157   2.721  -9.855
  342   HD23  LEU 134          HD23      LEU 134  18.765   1.120  -9.446
  343    H    ILE 135           H        ILE 135  19.667  -0.876  -9.111
  344    HA   ILE 135           HA       ILE 135  20.584  -2.525 -11.454
  345    HB   ILE 135           HB       ILE 135  19.564  -4.441 -10.504
  346   HG12  ILE 135          HG12      ILE 135  18.183  -2.499  -8.679
  347   HG13  ILE 135          HG13      ILE 135  17.551  -3.873  -9.553
  348   HG21  ILE 135          HG21      ILE 135  20.980  -4.833  -8.641
  349   HG22  ILE 135          HG22      ILE 135  21.840  -3.737  -9.720
  350   HG23  ILE 135          HG23      ILE 135  21.082  -3.101  -8.249
  351   HD11  ILE 135          HD11      ILE 135  18.673  -5.388  -7.889
  352   HD12  ILE 135          HD12      ILE 135  19.192  -3.929  -7.000
  353   HD13  ILE 135          HD13      ILE 135  17.470  -4.289  -7.178
  354    H    LYS 136           H        LYS 136  18.046  -0.367 -10.673
  355    HA   LYS 136           HA       LYS 136  16.317  -1.602 -12.768
  356    HB2  LYS 136           HB2      LYS 136  15.690  -2.246 -10.381
  357    HB3  LYS 136           HB3      LYS 136  15.272  -0.564 -10.102
  358    HG2  LYS 136           HG2      LYS 136  13.256  -1.727 -10.603
  359    HG3  LYS 136           HG3      LYS 136  13.611  -0.745 -12.029
  360    HD2  LYS 136           HD2      LYS 136  14.532  -2.753 -13.181
  361    HD3  LYS 136           HD3      LYS 136  14.267  -3.723 -11.716
  362    HE2  LYS 136           HE2      LYS 136  11.825  -3.313 -11.885
  363    HE3  LYS 136           HE3      LYS 136  12.081  -2.280 -13.297
  364    HZ1  LYS 136           HZ1      LYS 136  11.432  -4.534 -13.954
  365    HZ2  LYS 136           HZ2      LYS 136  12.937  -4.235 -14.495
  366    HZ3  LYS 136           HZ3      LYS 136  12.714  -5.199 -13.192
  367    H    GLU 137           H        GLU 137  15.961   1.365 -10.740
  368    HA   GLU 137           HA       GLU 137  16.081   3.085 -13.143
  369    HB2  GLU 137           HB2      GLU 137  13.779   2.078 -13.116
  370    HB3  GLU 137           HB3      GLU 137  13.521   2.739 -11.503
  371    HG2  GLU 137           HG2      GLU 137  13.721   5.035 -12.390
  372    HG3  GLU 137           HG3      GLU 137  14.119   4.404 -13.990
  373    H    LEU 138           H        LEU 138  16.590   5.210 -12.608
  374    HA   LEU 138           HA       LEU 138  16.382   6.124  -9.803
  375    HB2  LEU 138           HB2      LEU 138  18.636   4.963 -10.455
  376    HB3  LEU 138           HB3      LEU 138  18.957   6.412 -11.388
  377    HG   LEU 138           HG       LEU 138  18.801   7.750  -9.244
  378   HD11  LEU 138          HD11      LEU 138  18.533   4.996  -7.979
  379   HD12  LEU 138          HD12      LEU 138  18.954   6.478  -7.097
  380   HD13  LEU 138          HD13      LEU 138  17.379   6.345  -7.874
  381   HD21  LEU 138          HD21      LEU 138  20.772   5.426  -9.109
  382   HD22  LEU 138          HD22      LEU 138  20.983   6.890 -10.099
  383   HD23  LEU 138          HD23      LEU 138  20.938   7.012  -8.334
  384    H    GLU 139           H        GLU 139  14.915   6.801 -12.200
  385    HA   GLU 139           HA       GLU 139  15.625   9.340 -13.328
  386    HB2  GLU 139           HB2      GLU 139  14.021   7.719 -14.307
  387    HB3  GLU 139           HB3      GLU 139  12.877   8.074 -13.007
  388    HG2  GLU 139           HG2      GLU 139  12.758  10.436 -13.738
  389    HG3  GLU 139           HG3      GLU 139  13.967  10.121 -14.987
  Start of MODEL    2
    1    H1   ALA  91           H1       ALA  91   6.444 -15.438   3.028
    2    H2   ALA  91           H2       ALA  91   6.740 -15.531   1.421
    3    H3   ALA  91           H3       ALA  91   7.962 -15.745   2.492
    4    HA   ALA  91           HA       ALA  91   6.462 -13.240   2.062
    5    HB1  ALA  91           HB1      ALA  91   8.861 -13.735   3.897
    6    HB2  ALA  91           HB2      ALA  91   8.060 -12.176   3.605
    7    HB3  ALA  91           HB3      ALA  91   7.181 -13.478   4.420
    8    H    ALA  92           H        ALA  92   7.664 -11.504   1.053
    9    HA   ALA  92           HA       ALA  92  10.168 -12.124  -0.379
   10    HB1  ALA  92           HB1      ALA  92   9.163 -11.560  -2.580
   11    HB2  ALA  92           HB2      ALA  92   8.393 -12.991  -1.877
   12    HB3  ALA  92           HB3      ALA  92   7.565 -11.420  -1.822
   13    H    ARG  93           H        ARG  93  10.936 -10.194  -1.630
   14    HA   ARG  93           HA       ARG  93   9.990  -7.543  -0.696
   15    HB2  ARG  93           HB2      ARG  93  11.618  -8.367   1.012
   16    HB3  ARG  93           HB3      ARG  93  12.821  -8.590  -0.256
   17    HG2  ARG  93           HG2      ARG  93  12.703  -6.099  -0.699
   18    HG3  ARG  93           HG3      ARG  93  11.566  -5.950   0.630
   19    HD2  ARG  93           HD2      ARG  93  13.910  -5.301   1.201
   20    HD3  ARG  93           HD3      ARG  93  13.217  -6.544   2.237
   21    HE   ARG  93           HE       ARG  93  14.930  -7.915   1.685
   22   HH11  ARG  93          HH11      ARG  93  14.661  -5.913  -1.256
   23   HH12  ARG  93          HH12      ARG  93  16.217  -6.489  -1.789
   24   HH21  ARG  93          HH21      ARG  93  16.803  -8.623   0.759
   25   HH22  ARG  93          HH22      ARG  93  17.310  -7.949  -0.774
   26    HA   PRO  94           HA       PRO  94  11.427  -6.654  -4.922
   27    HB2  PRO  94           HB2      PRO  94  10.998  -3.962  -5.024
   28    HB3  PRO  94           HB3      PRO  94   9.660  -5.150  -4.989
   29    HG2  PRO  94           HG2      PRO  94  10.843  -3.615  -2.649
   30    HG3  PRO  94           HG3      PRO  94   9.114  -3.762  -3.109
   31    HD2  PRO  94           HD2      PRO  94  10.253  -5.355  -1.214
   32    HD3  PRO  94           HD3      PRO  94   9.007  -5.987  -2.329
   33    H    ALA  95           H        ALA  95  13.017  -4.995  -5.961
   34    HA   ALA  95           HA       ALA  95  15.180  -4.082  -4.157
   35    HB1  ALA  95           HB1      ALA  95  15.586  -6.115  -6.406
   36    HB2  ALA  95           HB2      ALA  95  16.888  -5.322  -5.495
   37    HB3  ALA  95           HB3      ALA  95  15.765  -6.422  -4.663
   38    H    LYS  96           H        LYS  96  16.655  -2.666  -5.102
   39    HA   LYS  96           HA       LYS  96  16.238  -1.664  -7.843
   40    HB2  LYS  96           HB2      LYS  96  14.850  -0.310  -6.209
   41    HB3  LYS  96           HB3      LYS  96  16.316   0.105  -5.357
   42    HG2  LYS  96           HG2      LYS  96  15.639   1.961  -6.744
   43    HG3  LYS  96           HG3      LYS  96  17.161   1.331  -7.331
   44    HD2  LYS  96           HD2      LYS  96  15.681   1.935  -9.184
   45    HD3  LYS  96           HD3      LYS  96  16.082   0.233  -9.201
   46    HE2  LYS  96           HE2      LYS  96  13.785   0.287  -9.744
   47    HE3  LYS  96           HE3      LYS  96  13.803  -0.202  -8.052
   48    HZ1  LYS  96           HZ1      LYS  96  13.229   2.525  -9.130
   49    HZ2  LYS  96           HZ2      LYS  96  12.156   1.534  -8.408
   50    HZ3  LYS  96           HZ3      LYS  96  13.344   2.211  -7.509
   51    H    TYR  97           H        TYR  97  18.316  -1.990  -5.044
   52    HA   TYR  97           HA       TYR  97  20.731  -1.480  -6.718
   53    HB2  TYR  97           HB2      TYR  97  20.476  -0.924  -3.747
   54    HB3  TYR  97           HB3      TYR  97  21.800  -0.482  -4.801
   55    HD1  TYR  97           HD1      TYR  97  18.274   0.264  -3.877
   56    HD2  TYR  97           HD2      TYR  97  21.776   1.626  -5.975
   57    HE1  TYR  97           HE1      TYR  97  17.198   2.482  -4.242
   58    HE2  TYR  97           HE2      TYR  97  20.703   3.842  -6.323
   59    HH   TYR  97           HH       TYR  97  18.828   5.160  -5.950
   60    H    SER  98           H        SER  98  22.600  -2.769  -6.144
   61    HA   SER  98           HA       SER  98  22.197  -5.070  -4.261
   62    HB2  SER  98           HB2      SER  98  23.372  -5.210  -7.067
   63    HB3  SER  98           HB3      SER  98  23.463  -6.503  -5.861
   64    HG   SER  98           HG       SER  98  21.705  -6.827  -7.293
   65    H    TYR  99           H        TYR  99  24.096  -5.818  -3.209
   66    HA   TYR  99           HA       TYR  99  26.672  -4.570  -3.971
   67    HB2  TYR  99           HB2      TYR  99  27.204  -3.832  -1.763
   68    HB3  TYR  99           HB3      TYR  99  25.709  -3.101  -2.276
   69    HD1  TYR  99           HD2      TYR  99  23.531  -3.781  -1.273
   70    HD2  TYR  99           HD1      TYR  99  27.284  -5.379   0.132
   71    HE1  TYR  99           HE2      TYR  99  22.465  -4.375   0.904
   72    HE2  TYR  99           HE1      TYR  99  26.223  -5.987   2.293
   73    HH   TYR  99           HH       TYR  99  22.787  -5.221   3.026
   74    H    VAL 100           H        VAL 100  28.490  -5.378  -2.678
   75    HA   VAL 100           HA       VAL 100  28.544  -8.374  -2.717
   76    HB   VAL 100           HB       VAL 100  30.433  -6.226  -3.792
   77   HG11  VAL 100          HG11      VAL 100  31.905  -8.047  -4.606
   78   HG12  VAL 100          HG12      VAL 100  31.903  -7.902  -2.852
   79   HG13  VAL 100          HG13      VAL 100  30.992  -9.212  -3.632
   80   HG21  VAL 100          HG21      VAL 100  30.101  -7.298  -5.965
   81   HG22  VAL 100          HG22      VAL 100  29.035  -8.511  -5.237
   82   HG23  VAL 100          HG23      VAL 100  28.544  -6.803  -5.288
   83    H    ASP 101           H        ASP 101  29.455  -9.313  -0.916
   84    HA   ASP 101           HA       ASP 101  30.707  -7.629   1.168
   85    HB2  ASP 101           HB2      ASP 101  29.273  -9.468   1.823
   86    HB3  ASP 101           HB3      ASP 101  30.291 -10.631   0.968
   87    H    GLU 102           H        GLU 102  31.877 -10.436  -0.812
   88    HA   GLU 102           HA       GLU 102  34.387  -9.094  -1.397
   89    HB2  GLU 102           HB2      GLU 102  34.885  -9.955   0.853
   90    HB3  GLU 102           HB3      GLU 102  34.316 -11.570   0.403
   91    HG2  GLU 102           HG2      GLU 102  36.108 -11.810  -1.205
   92    HG3  GLU 102           HG3      GLU 102  36.609 -10.132  -0.974
   93    H    ASN 103           H        ASN 103  33.018 -12.447  -1.258
   94    HA   ASN 103           HA       ASN 103  34.430 -13.264  -3.582
   95    HB2  ASN 103           HB2      ASN 103  33.765 -14.686  -1.634
   96    HB3  ASN 103           HB3      ASN 103  32.076 -14.562  -2.136
   97   HD21  ASN 103          HD22      ASN 103  31.479 -16.506  -3.041
   98   HD22  ASN 103          HD21      ASN 103  32.492 -17.447  -4.124
   99    H    GLY 104           H        GLY 104  31.277 -11.788  -3.318
  100    HA2  GLY 104           HA2      GLY 104  30.798 -11.333  -6.035
  101    HA3  GLY 104           HA3      GLY 104  30.074 -12.905  -5.691
  102    H    GLU 105           H        GLU 105  28.197 -11.550  -6.452
  103    HA   GLU 105           HA       GLU 105  26.934  -9.522  -5.002
  104    HB2  GLU 105           HB2      GLU 105  24.901 -10.148  -6.058
  105    HB3  GLU 105           HB3      GLU 105  26.219 -10.177  -7.210
  106    HG2  GLU 105           HG2      GLU 105  24.831 -12.589  -5.961
  107    HG3  GLU 105           HG3      GLU 105  24.621 -11.988  -7.594
  108    H    THR 106           H        THR 106  25.937  -9.319  -3.167
  109    HA   THR 106           HA       THR 106  25.705 -11.688  -1.394
  110    HB   THR 106           HB       THR 106  26.748  -8.886  -1.019
  111    HG1  THR 106           HG1      THR 106  27.992 -10.851  -1.690
  112   HG21  THR 106          HG21      THR 106  27.111  -9.392   1.361
  113   HG22  THR 106          HG22      THR 106  25.432  -9.107   0.945
  114   HG23  THR 106          HG23      THR 106  26.004 -10.781   1.219
  115    H    LYS 107           H        LYS 107  24.371  -8.339  -1.671
  116    HA   LYS 107           HA       LYS 107  21.669  -9.327  -0.877
  117    HB2  LYS 107           HB2      LYS 107  23.475  -7.563   0.815
  118    HB3  LYS 107           HB3      LYS 107  21.723  -7.387   0.917
  119    HG2  LYS 107           HG2      LYS 107  21.497  -9.777   1.514
  120    HG3  LYS 107           HG3      LYS 107  23.264  -9.947   1.498
  121    HD2  LYS 107           HD2      LYS 107  23.476  -8.265   3.279
  122    HD3  LYS 107           HD3      LYS 107  21.705  -8.065   3.313
  123    HE2  LYS 107           HE2      LYS 107  21.464 -10.482   3.891
  124    HE3  LYS 107           HE3      LYS 107  23.219 -10.666   3.866
  125    HZ1  LYS 107           HZ1      LYS 107  21.714  -8.904   5.747
  126    HZ2  LYS 107           HZ2      LYS 107  22.406 -10.330   6.129
  127    HZ3  LYS 107           HZ3      LYS 107  23.347  -9.061   5.721
  128    H    THR 108           H        THR 108  20.075  -7.540  -0.799
  129    HA   THR 108           HA       THR 108  20.619  -5.429  -2.840
  130    HB   THR 108           HB       THR 108  18.447  -5.819  -3.851
  131    HG1  THR 108           HG1      THR 108  17.531  -8.005  -3.196
  132   HG21  THR 108          HG21      THR 108  20.470  -7.142  -4.628
  133   HG22  THR 108          HG22      THR 108  19.826  -8.521  -3.723
  134   HG23  THR 108          HG23      THR 108  18.896  -7.805  -5.066
  135    H    TRP 109           H        TRP 109  19.029  -3.718  -2.938
  136    HA   TRP 109           HA       TRP 109  17.622  -3.058  -0.398
  137    HB2  TRP 109           HB2      TRP 109  19.952  -2.377  -0.097
  138    HB3  TRP 109           HB3      TRP 109  19.937  -1.485  -1.602
  139    HD1  TRP 109           HD1      TRP 109  17.690  -1.404   1.579
  140    HE1  TRP 109           HE1      TRP 109  17.431   1.031   2.359
  141    HE3  TRP 109           HE3      TRP 109  20.584   0.932  -1.966
  142    HZ2  TRP 109           HZ2      TRP 109  18.470   3.603   1.664
  143    HZ3  TRP 109           HZ3      TRP 109  20.955   3.376  -1.845
  144    HH2  TRP 109           HH2      TRP 109  19.939   4.722  -0.023
  145    H    THR 110           H        THR 110  16.282  -1.145  -0.579
  146    HA   THR 110           HA       THR 110  15.073  -0.884  -3.295
  147    HB   THR 110           HB       THR 110  12.998  -0.387  -1.942
  148    HG1  THR 110           HG1      THR 110  13.148  -0.876   0.294
  149   HG21  THR 110          HG21      THR 110  13.432  -2.693  -2.718
  150   HG22  THR 110          HG22      THR 110  14.354  -3.030  -1.235
  151   HG23  THR 110          HG23      THR 110  12.616  -2.674  -1.150
  152    H    GLY 111           H        GLY 111  16.958   1.032  -1.272
  153    HA2  GLY 111           HA2      GLY 111  17.424   3.318  -1.466
  154    HA3  GLY 111           HA3      GLY 111  16.025   3.543  -2.504
  155    H    GLN 112           H        GLN 112  15.701   1.962   0.650
  156    HA   GLN 112           HA       GLN 112  14.393   4.371   1.835
  157    HB2  GLN 112           HB2      GLN 112  13.234   1.565   1.564
  158    HB3  GLN 112           HB3      GLN 112  12.532   2.821   2.576
  159    HG2  GLN 112           HG2      GLN 112  12.842   3.066  -0.451
  160    HG3  GLN 112           HG3      GLN 112  11.405   2.494   0.367
  161   HE21  GLN 112          HE22      GLN 112  13.422   5.410  -0.169
  162   HE22  GLN 112          HE21      GLN 112  12.155   6.523   0.353
  163    H    GLY 113           H        GLY 113  13.935   4.139   4.160
  164    HA2  GLY 113           HA2      GLY 113  14.527   3.645   6.340
  165    HA3  GLY 113           HA3      GLY 113  15.331   2.178   5.793
  166    H    ARG 114           H        ARG 114  17.541   2.228   5.348
  167    HA   ARG 114           HA       ARG 114  19.085   4.750   5.389
  168    HB2  ARG 114           HB2      ARG 114  19.633   2.425   7.304
  169    HB3  ARG 114           HB3      ARG 114  20.764   3.736   6.992
  170    HG2  ARG 114           HG2      ARG 114  18.012   4.051   8.273
  171    HG3  ARG 114           HG3      ARG 114  19.558   4.008   9.116
  172    HD2  ARG 114           HD2      ARG 114  20.304   6.041   7.934
  173    HD3  ARG 114           HD3      ARG 114  18.769   6.146   7.083
  174    HE   ARG 114           HE       ARG 114  19.312   6.751   9.914
  175   HH11  ARG 114          HH11      ARG 114  16.727   6.277   7.566
  176   HH12  ARG 114          HH12      ARG 114  15.584   7.176   8.536
  177   HH21  ARG 114          HH21      ARG 114  17.798   7.866  11.079
  178   HH22  ARG 114          HH22      ARG 114  16.177   8.041  10.479
  179    H    THR 115           H        THR 115  21.042   4.629   4.307
  180    HA   THR 115           HA       THR 115  21.358   2.826   2.178
  181    HB   THR 115           HB       THR 115  23.540   4.461   3.516
  182    HG1  THR 115           HG1      THR 115  22.845   6.099   2.129
  183   HG21  THR 115          HG21      THR 115  24.442   4.603   1.195
  184   HG22  THR 115          HG22      THR 115  24.426   2.945   1.798
  185   HG23  THR 115          HG23      THR 115  23.180   3.478   0.646
  186    HA   PRO 116           HA       PRO 116  23.098  -0.845   4.232
  187    HB2  PRO 116           HB2      PRO 116  24.304  -1.202   1.479
  188    HB3  PRO 116           HB3      PRO 116  23.533  -2.420   2.543
  189    HG2  PRO 116           HG2      PRO 116  22.146  -1.336   0.481
  190    HG3  PRO 116           HG3      PRO 116  21.354  -1.561   2.073
  191    HD2  PRO 116           HD2      PRO 116  22.488   0.975   0.885
  192    HD3  PRO 116           HD3      PRO 116  20.992   0.716   1.839
  193    H    ALA 117           H        ALA 117  25.051  -1.428   5.178
  194    HA   ALA 117           HA       ALA 117  26.911   0.546   5.679
  195    HB1  ALA 117           HB1      ALA 117  27.273  -2.477   5.920
  196    HB2  ALA 117           HB2      ALA 117  28.237  -1.240   6.757
  197    HB3  ALA 117           HB3      ALA 117  26.509  -1.401   7.109
  198    H    VAL 118           H        VAL 118  27.442  -2.170   3.349
  199    HA   VAL 118           HA       VAL 118  30.070  -1.403   2.581
  200    HB   VAL 118           HB       VAL 118  27.959  -2.852   0.936
  201   HG11  VAL 118          HG11      VAL 118  29.882  -3.769  -0.343
  202   HG12  VAL 118          HG12      VAL 118  29.726  -2.035  -0.569
  203   HG13  VAL 118          HG13      VAL 118  30.975  -2.673   0.527
  204   HG21  VAL 118          HG21      VAL 118  30.246  -3.880   2.677
  205   HG22  VAL 118          HG22      VAL 118  28.514  -4.049   3.027
  206   HG23  VAL 118          HG23      VAL 118  29.214  -4.892   1.645
  207    H    ILE 119           H        ILE 119  26.931  -0.397   1.210
  208    HA   ILE 119           HA       ILE 119  28.049   1.201  -0.926
  209    HB   ILE 119           HB       ILE 119  25.302   1.274   0.386
  210   HG12  ILE 119          HG12      ILE 119  26.348  -0.103  -2.125
  211   HG13  ILE 119          HG13      ILE 119  25.813  -0.896  -0.648
  212   HG21  ILE 119          HG21      ILE 119  24.562   2.513  -1.605
  213   HG22  ILE 119          HG22      ILE 119  25.802   3.426  -0.769
  214   HG23  ILE 119          HG23      ILE 119  26.214   2.523  -2.242
  215   HD11  ILE 119          HD11      ILE 119  24.080  -1.160  -2.245
  216   HD12  ILE 119          HD12      ILE 119  23.494   0.033  -1.070
  217   HD13  ILE 119          HD13      ILE 119  24.076   0.553  -2.671
  218    H    LYS 120           H        LYS 120  26.948   1.998   2.384
  219    HA   LYS 120           HA       LYS 120  27.456   4.822   2.371
  220    HB2  LYS 120           HB2      LYS 120  26.107   3.936   4.088
  221    HB3  LYS 120           HB3      LYS 120  27.209   2.627   4.437
  222    HG2  LYS 120           HG2      LYS 120  27.126   4.162   6.266
  223    HG3  LYS 120           HG3      LYS 120  28.751   4.076   5.599
  224    HD2  LYS 120           HD2      LYS 120  28.544   6.271   4.601
  225    HD3  LYS 120           HD3      LYS 120  26.795   6.323   4.919
  226    HE2  LYS 120           HE2      LYS 120  27.108   6.474   7.281
  227    HE3  LYS 120           HE3      LYS 120  28.801   5.984   7.177
  228    HZ1  LYS 120           HZ1      LYS 120  28.500   8.404   7.533
  229    HZ2  LYS 120           HZ2      LYS 120  29.393   8.050   6.211
  230    HZ3  LYS 120           HZ3      LYS 120  27.817   8.552   6.055
  231    H    LYS 121           H        LYS 121  29.610   2.126   3.372
  232    HA   LYS 121           HA       LYS 121  31.878   3.829   3.873
  233    HB2  LYS 121           HB2      LYS 121  31.688   0.852   3.267
  234    HB3  LYS 121           HB3      LYS 121  33.189   1.654   3.688
  235    HG2  LYS 121           HG2      LYS 121  30.725   1.366   5.455
  236    HG3  LYS 121           HG3      LYS 121  32.270   0.553   5.636
  237    HD2  LYS 121           HD2      LYS 121  31.690   3.513   6.067
  238    HD3  LYS 121           HD3      LYS 121  32.041   2.298   7.295
  239    HE2  LYS 121           HE2      LYS 121  34.325   1.991   6.401
  240    HE3  LYS 121           HE3      LYS 121  33.987   3.147   5.108
  241    HZ1  LYS 121           HZ1      LYS 121  33.632   4.863   6.844
  242    HZ2  LYS 121           HZ2      LYS 121  34.107   3.792   8.003
  243    HZ3  LYS 121           HZ3      LYS 121  35.167   4.256   6.830
  244    H    ALA 122           H        ALA 122  30.931   2.074   0.896
  245    HA   ALA 122           HA       ALA 122  33.204   2.828  -0.638
  246    HB1  ALA 122           HB1      ALA 122  31.640   1.038  -1.259
  247    HB2  ALA 122           HB2      ALA 122  30.341   2.231  -1.494
  248    HB3  ALA 122           HB3      ALA 122  31.762   2.235  -2.556
  249    H    MET 123           H        MET 123  30.086   4.555  -0.138
  250    HA   MET 123           HA       MET 123  30.581   6.715  -1.918
  251    HB2  MET 123           HB2      MET 123  28.969   6.545   0.650
  252    HB3  MET 123           HB3      MET 123  29.024   7.996  -0.357
  253    HG2  MET 123           HG2      MET 123  28.007   6.902  -2.209
  254    HG3  MET 123           HG3      MET 123  28.228   5.307  -1.498
  255    HE1  MET 123           HE1      MET 123  26.222   8.676  -1.401
  256    HE2  MET 123           HE2      MET 123  25.084   8.417  -0.067
  257    HE3  MET 123           HE3      MET 123  26.811   8.642   0.276
  258    H    GLU 124           H        GLU 124  31.452   6.458   1.582
  259    HA   GLU 124           HA       GLU 124  32.668   9.092   1.454
  260    HB2  GLU 124           HB2      GLU 124  32.798   9.033   3.796
  261    HB3  GLU 124           HB3      GLU 124  31.241   8.352   3.311
  262    HG2  GLU 124           HG2      GLU 124  32.226   6.048   3.637
  263    HG3  GLU 124           HG3      GLU 124  33.712   6.819   4.203
  264    H    GLU 125           H        GLU 125  33.996   5.825   1.352
  265    HA   GLU 125           HA       GLU 125  36.755   6.932   1.704
  266    HB2  GLU 125           HB2      GLU 125  35.859   4.038   1.776
  267    HB3  GLU 125           HB3      GLU 125  37.465   4.686   2.134
  268    HG2  GLU 125           HG2      GLU 125  36.308   6.089   3.966
  269    HG3  GLU 125           HG3      GLU 125  34.920   5.017   3.731
  270    H    GLN 126           H        GLN 126  34.737   5.664  -0.835
  271    HA   GLN 126           HA       GLN 126  37.132   5.528  -2.643
  272    HB2  GLN 126           HB2      GLN 126  34.642   3.788  -2.772
  273    HB3  GLN 126           HB3      GLN 126  36.023   3.725  -3.865
  274    HG2  GLN 126           HG2      GLN 126  37.497   3.083  -1.973
  275    HG3  GLN 126           HG3      GLN 126  36.098   3.052  -0.889
  276   HE21  GLN 126          HE22      GLN 126  38.061   0.902  -2.207
  277   HE22  GLN 126          HE21      GLN 126  36.909  -0.339  -2.673
  278    H    GLY 127           H        GLY 127  34.367   7.337  -2.061
  279    HA2  GLY 127           HA2      GLY 127  33.414   9.043  -3.241
  280    HA3  GLY 127           HA3      GLY 127  34.642   8.835  -4.485
  281    H    LYS 128           H        LYS 128  32.731   6.018  -3.871
  282    HA   LYS 128           HA       LYS 128  31.508   6.069  -6.532
  283    HB2  LYS 128           HB2      LYS 128  31.379   4.179  -4.153
  284    HB3  LYS 128           HB3      LYS 128  30.402   3.912  -5.603
  285    HG2  LYS 128           HG2      LYS 128  32.281   3.614  -7.012
  286    HG3  LYS 128           HG3      LYS 128  33.389   4.359  -5.864
  287    HD2  LYS 128           HD2      LYS 128  33.847   2.018  -5.874
  288    HD3  LYS 128           HD3      LYS 128  33.173   2.479  -4.329
  289    HE2  LYS 128           HE2      LYS 128  32.082   0.486  -4.719
  290    HE3  LYS 128           HE3      LYS 128  30.875   1.647  -5.290
  291    HZ1  LYS 128           HZ1      LYS 128  32.817   0.263  -7.093
  292    HZ2  LYS 128           HZ2      LYS 128  31.293  -0.262  -6.827
  293    HZ3  LYS 128           HZ3      LYS 128  31.517   1.168  -7.563
  294    H    GLN 129           H        GLN 129  29.179   5.691  -6.871
  295    HA   GLN 129           HA       GLN 129  27.453   7.327  -5.063
  296    HB2  GLN 129           HB2      GLN 129  26.505   8.384  -6.982
  297    HB3  GLN 129           HB3      GLN 129  28.266   8.539  -7.056
  298    HG2  GLN 129           HG2      GLN 129  28.361   6.709  -8.739
  299    HG3  GLN 129           HG3      GLN 129  26.603   6.578  -8.688
  300   HE21  GLN 129          HE22      GLN 129  25.341   8.593  -9.287
  301   HE22  GLN 129          HE21      GLN 129  26.071   9.663 -10.499
  302    H    LEU 130           H        LEU 130  25.096   6.944  -5.358
  303    HA   LEU 130           HA       LEU 130  24.556   4.204  -4.873
  304    HB2  LEU 130           HB2      LEU 130  22.640   6.484  -5.562
  305    HB3  LEU 130           HB3      LEU 130  22.158   4.901  -4.985
  306    HG   LEU 130           HG       LEU 130  21.942   6.331  -3.178
  307   HD11  LEU 130          HD11      LEU 130  22.998   4.112  -2.698
  308   HD12  LEU 130          HD12      LEU 130  24.582   4.915  -2.671
  309   HD13  LEU 130          HD13      LEU 130  23.338   5.357  -1.483
  310   HD21  LEU 130          HD21      LEU 130  23.576   7.786  -2.237
  311   HD22  LEU 130          HD22      LEU 130  24.839   7.233  -3.337
  312   HD23  LEU 130          HD23      LEU 130  23.447   8.172  -3.958
  313    H    GLU 131           H        GLU 131  24.162   6.080  -7.870
  314    HA   GLU 131           HA       GLU 131  22.792   4.092  -9.410
  315    HB2  GLU 131           HB2      GLU 131  24.748   6.252 -10.325
  316    HB3  GLU 131           HB3      GLU 131  23.657   5.336 -11.348
  317    HG2  GLU 131           HG2      GLU 131  22.584   7.394 -11.039
  318    HG3  GLU 131           HG3      GLU 131  21.712   6.224 -10.043
  319    H    ASP 132           H        ASP 132  26.172   4.162  -8.395
  320    HA   ASP 132           HA       ASP 132  27.071   2.319 -10.433
  321    HB2  ASP 132           HB2      ASP 132  28.479   4.011  -9.066
  322    HB3  ASP 132           HB3      ASP 132  28.422   2.811  -7.771
  323    H    PHE 133           H        PHE 133  25.156   1.990  -7.662
  324    HA   PHE 133           HA       PHE 133  25.544  -0.979  -7.505
  325    HB2  PHE 133           HB2      PHE 133  24.362   0.963  -5.482
  326    HB3  PHE 133           HB3      PHE 133  24.493  -0.770  -5.280
  327    HD1  PHE 133           HD2      PHE 133  26.738  -1.857  -4.974
  328    HD2  PHE 133           HD1      PHE 133  26.276   2.422  -5.113
  329    HE1  PHE 133           HE2      PHE 133  28.928  -1.590  -3.844
  330    HE2  PHE 133           HE1      PHE 133  28.470   2.694  -3.986
  331    HZ   PHE 133           HZ       PHE 133  29.786   0.677  -3.325
  332    H    LEU 134           H        LEU 134  23.349   1.555  -8.376
  333    HA   LEU 134           HA       LEU 134  20.834   0.172  -8.170
  334    HB2  LEU 134           HB2      LEU 134  21.441   2.690  -8.318
  335    HB3  LEU 134           HB3      LEU 134  21.521   2.443 -10.054
  336    HG   LEU 134           HG       LEU 134  19.097   2.068  -8.256
  337   HD11  LEU 134          HD11      LEU 134  18.251   4.072  -9.350
  338   HD12  LEU 134          HD12      LEU 134  19.829   4.423  -8.640
  339   HD13  LEU 134          HD13      LEU 134  19.686   4.162 -10.391
  340   HD21  LEU 134          HD21      LEU 134  19.411   1.676 -11.252
  341   HD22  LEU 134          HD22      LEU 134  18.676   0.583 -10.044
  342   HD23  LEU 134          HD23      LEU 134  17.849   2.066 -10.493
  343    H    ILE 135           H        ILE 135  20.050  -1.389  -9.457
  344    HA   ILE 135           HA       ILE 135  21.132  -1.717 -12.243
  345    HB   ILE 135           HB       ILE 135  20.908  -4.098 -12.043
  346   HG12  ILE 135          HG12      ILE 135  19.125  -4.098 -10.222
  347   HG13  ILE 135          HG13      ILE 135  20.363  -5.339 -10.188
  348   HG21  ILE 135          HG21      ILE 135  22.726  -2.894  -9.923
  349   HG22  ILE 135          HG22      ILE 135  22.880  -4.507 -10.654
  350   HG23  ILE 135          HG23      ILE 135  23.064  -3.056 -11.658
  351   HD11  ILE 135          HD11      ILE 135  20.252  -2.912  -8.373
  352   HD12  ILE 135          HD12      ILE 135  19.850  -4.577  -7.948
  353   HD13  ILE 135          HD13      ILE 135  21.521  -4.140  -8.354
  354    H    LYS 136           H        LYS 136  18.101  -1.708 -10.413
  355    HA   LYS 136           HA       LYS 136  16.694  -3.052 -12.592
  356    HB2  LYS 136           HB2      LYS 136  16.356  -3.321 -10.047
  357    HB3  LYS 136           HB3      LYS 136  15.463  -1.805 -10.113
  358    HG2  LYS 136           HG2      LYS 136  13.968  -3.703 -10.089
  359    HG3  LYS 136           HG3      LYS 136  13.791  -2.847 -11.612
  360    HD2  LYS 136           HD2      LYS 136  15.134  -4.589 -12.776
  361    HD3  LYS 136           HD3      LYS 136  15.501  -5.349 -11.221
  362    HE2  LYS 136           HE2      LYS 136  13.796  -6.658 -12.263
  363    HE3  LYS 136           HE3      LYS 136  13.061  -5.825 -10.895
  364    HZ1  LYS 136           HZ1      LYS 136  12.110  -4.210 -12.486
  365    HZ2  LYS 136           HZ2      LYS 136  12.830  -4.970 -13.746
  366    HZ3  LYS 136           HZ3      LYS 136  11.664  -5.725 -12.895
  367    H    GLU 137           H        GLU 137  17.486   0.170 -12.287
  368    HA   GLU 137           HA       GLU 137  15.262   1.020 -14.103
  369    HB2  GLU 137           HB2      GLU 137  15.056   1.539 -11.516
  370    HB3  GLU 137           HB3      GLU 137  16.181   2.848 -11.890
  371    HG2  GLU 137           HG2      GLU 137  14.512   3.607 -13.677
  372    HG3  GLU 137           HG3      GLU 137  13.424   2.352 -13.091
  373    H    LEU 138           H        LEU 138  18.176   0.396 -14.531
  374    HA   LEU 138           HA       LEU 138  18.916   2.840 -16.032
  375    HB2  LEU 138           HB2      LEU 138  20.729   1.373 -14.075
  376    HB3  LEU 138           HB3      LEU 138  21.315   2.506 -15.281
  377    HG   LEU 138           HG       LEU 138  19.459   3.239 -12.977
  378   HD11  LEU 138          HD11      LEU 138  21.784   2.645 -12.318
  379   HD12  LEU 138          HD12      LEU 138  22.410   3.848 -13.452
  380   HD13  LEU 138          HD13      LEU 138  21.425   4.368 -12.066
  381   HD21  LEU 138          HD21      LEU 138  20.001   5.581 -13.619
  382   HD22  LEU 138          HD22      LEU 138  20.880   4.987 -15.048
  383   HD23  LEU 138          HD23      LEU 138  19.120   4.761 -14.902
  384    H    GLU 139           H        GLU 139  20.542   2.435 -17.664
  385    HA   GLU 139           HA       GLU 139  20.901  -0.356 -18.617
  386    HB2  GLU 139           HB2      GLU 139  19.636   1.878 -20.264
  387    HB3  GLU 139           HB3      GLU 139  20.235   0.349 -20.907
  388    HG2  GLU 139           HG2      GLU 139  18.602  -0.890 -19.467
  389    HG3  GLU 139           HG3      GLU 139  17.940   0.655 -18.924
  Start of MODEL    3
    1    H1   ALA  91           H1       ALA  91   3.584  -7.599   3.431
    2    H2   ALA  91           H2       ALA  91   3.199  -8.884   2.494
    3    H3   ALA  91           H3       ALA  91   4.725  -8.714   3.060
    4    HA   ALA  91           HA       ALA  91   4.658  -8.134   0.740
    5    HB1  ALA  91           HB1      ALA  91   3.339  -6.196  -0.024
    6    HB2  ALA  91           HB2      ALA  91   2.278  -7.443   0.646
    7    HB3  ALA  91           HB3      ALA  91   2.656  -5.991   1.602
    8    H    ALA  92           H        ALA  92   6.008  -6.481  -0.169
    9    HA   ALA  92           HA       ALA  92   7.160  -4.415   1.599
   10    HB1  ALA  92           HB1      ALA  92   8.811  -6.686   0.381
   11    HB2  ALA  92           HB2      ALA  92   9.457  -5.282   1.263
   12    HB3  ALA  92           HB3      ALA  92   8.458  -6.470   2.111
   13    H    ARG  93           H        ARG  93   8.822  -3.104   0.383
   14    HA   ARG  93           HA       ARG  93   7.837  -2.267  -2.243
   15    HB2  ARG  93           HB2      ARG  93  10.176  -1.459  -0.465
   16    HB3  ARG  93           HB3      ARG  93  10.104  -0.920  -2.133
   17    HG2  ARG  93           HG2      ARG  93   9.209   0.810  -0.787
   18    HG3  ARG  93           HG3      ARG  93   7.904   0.135  -1.754
   19    HD2  ARG  93           HD2      ARG  93   7.032  -1.063   0.203
   20    HD3  ARG  93           HD3      ARG  93   8.431  -0.541   1.168
   21    HE   ARG  93           HE       ARG  93   7.029   1.719   0.025
   22   HH11  ARG  93          HH11      ARG  93   6.690  -0.558   2.682
   23   HH12  ARG  93          HH12      ARG  93   5.746   0.558   3.627
   24   HH21  ARG  93          HH21      ARG  93   5.837   3.084   1.295
   25   HH22  ARG  93          HH22      ARG  93   5.279   2.560   2.858
   26    HA   PRO  94           HA       PRO  94  10.458  -4.846  -4.806
   27    HB2  PRO  94           HB2      PRO  94  10.791  -3.324  -7.047
   28    HB3  PRO  94           HB3      PRO  94   9.223  -4.060  -6.608
   29    HG2  PRO  94           HG2      PRO  94  10.156  -1.222  -6.067
   30    HG3  PRO  94           HG3      PRO  94   8.606  -1.761  -6.788
   31    HD2  PRO  94           HD2      PRO  94   8.833  -1.142  -4.144
   32    HD3  PRO  94           HD3      PRO  94   7.780  -2.475  -4.698
   33    H    ALA  95           H        ALA  95  12.655  -5.088  -5.483
   34    HA   ALA  95           HA       ALA  95  14.641  -3.480  -4.130
   35    HB1  ALA  95           HB1      ALA  95  16.244  -4.943  -5.320
   36    HB2  ALA  95           HB2      ALA  95  14.949  -5.888  -4.564
   37    HB3  ALA  95           HB3      ALA  95  14.922  -5.588  -6.319
   38    H    LYS  96           H        LYS  96  16.224  -2.154  -5.007
   39    HA   LYS  96           HA       LYS  96  16.170  -1.445  -7.853
   40    HB2  LYS  96           HB2      LYS  96  14.657   0.185  -6.840
   41    HB3  LYS  96           HB3      LYS  96  15.867   0.631  -5.631
   42    HG2  LYS  96           HG2      LYS  96  17.230   1.730  -7.224
   43    HG3  LYS  96           HG3      LYS  96  16.470   0.916  -8.588
   44    HD2  LYS  96           HD2      LYS  96  15.850   3.242  -8.568
   45    HD3  LYS  96           HD3      LYS  96  14.424   2.226  -8.301
   46    HE2  LYS  96           HE2      LYS  96  14.568   2.680  -5.844
   47    HE3  LYS  96           HE3      LYS  96  15.998   3.682  -6.126
   48    HZ1  LYS  96           HZ1      LYS  96  13.277   4.262  -7.206
   49    HZ2  LYS  96           HZ2      LYS  96  13.984   5.047  -5.963
   50    HZ3  LYS  96           HZ3      LYS  96  14.601   5.190  -7.468
   51    H    TYR  97           H        TYR  97  18.009  -2.004  -5.023
   52    HA   TYR  97           HA       TYR  97  20.488  -1.298  -6.511
   53    HB2  TYR  97           HB2      TYR  97  20.169  -1.028  -3.520
   54    HB3  TYR  97           HB3      TYR  97  21.477  -0.425  -4.519
   55    HD1  TYR  97           HD1      TYR  97  18.020   0.132  -3.333
   56    HD2  TYR  97           HD2      TYR  97  21.230   1.713  -5.744
   57    HE1  TYR  97           HE1      TYR  97  16.875   2.333  -3.411
   58    HE2  TYR  97           HE2      TYR  97  20.032   3.901  -5.865
   59    HH   TYR  97           HH       TYR  97  17.018   4.555  -4.076
   60    H    SER  98           H        SER  98  22.373  -2.630  -5.947
   61    HA   SER  98           HA       SER  98  22.021  -4.820  -4.030
   62    HB2  SER  98           HB2      SER  98  22.492  -6.632  -5.509
   63    HB3  SER  98           HB3      SER  98  21.135  -5.737  -6.209
   64    HG   SER  98           HG       SER  98  22.820  -6.303  -7.749
   65    H    TYR  99           H        TYR  99  23.985  -6.054  -3.597
   66    HA   TYR  99           HA       TYR  99  26.500  -4.896  -4.609
   67    HB2  TYR  99           HB2      TYR  99  27.405  -4.393  -2.428
   68    HB3  TYR  99           HB3      TYR  99  25.986  -3.456  -2.765
   69    HD1  TYR  99           HD1      TYR  99  23.783  -4.017  -1.614
   70    HD2  TYR  99           HD2      TYR  99  27.542  -5.816  -0.491
   71    HE1  TYR  99           HE1      TYR  99  22.899  -4.444   0.680
   72    HE2  TYR  99           HE2      TYR  99  26.639  -6.286   1.775
   73    HH   TYR  99           HH       TYR  99  24.858  -6.037   3.228
   74    H    VAL 100           H        VAL 100  28.406  -5.884  -3.778
   75    HA   VAL 100           HA       VAL 100  28.276  -8.867  -3.644
   76    HB   VAL 100           HB       VAL 100  30.000  -7.108  -5.453
   77   HG11  VAL 100          HG11      VAL 100  30.646  -9.162  -6.608
   78   HG12  VAL 100          HG12      VAL 100  31.116  -9.256  -4.915
   79   HG13  VAL 100          HG13      VAL 100  29.674 -10.130  -5.489
   80   HG21  VAL 100          HG21      VAL 100  27.570  -8.801  -6.178
   81   HG22  VAL 100          HG22      VAL 100  27.729  -7.040  -6.329
   82   HG23  VAL 100          HG23      VAL 100  28.696  -8.094  -7.352
   83    H    ASP 101           H        ASP 101  30.129  -9.833  -2.679
   84    HA   ASP 101           HA       ASP 101  32.180  -8.105  -1.428
   85    HB2  ASP 101           HB2      ASP 101  30.066  -8.503   0.091
   86    HB3  ASP 101           HB3      ASP 101  30.715 -10.131   0.278
   87    H    GLU 102           H        GLU 102  33.533  -9.995   0.066
   88    HA   GLU 102           HA       GLU 102  35.076 -11.317  -1.928
   89    HB2  GLU 102           HB2      GLU 102  35.829 -10.521   0.316
   90    HB3  GLU 102           HB3      GLU 102  34.946 -11.868   1.066
   91    HG2  GLU 102           HG2      GLU 102  36.376 -13.486  -0.112
   92    HG3  GLU 102           HG3      GLU 102  37.172 -12.175  -0.992
   93    H    ASN 103           H        ASN 103  32.362 -12.521   0.009
   94    HA   ASN 103           HA       ASN 103  32.659 -15.293  -0.714
   95    HB2  ASN 103           HB2      ASN 103  30.293 -13.703   0.377
   96    HB3  ASN 103           HB3      ASN 103  30.325 -15.457   0.228
   97   HD21  ASN 103          HD22      ASN 103  30.412 -13.334   2.597
   98   HD22  ASN 103          HD21      ASN 103  31.607 -14.085   3.641
   99    H    GLY 104           H        GLY 104  31.508 -12.623  -2.571
  100    HA2  GLY 104           HA2      GLY 104  30.956 -13.135  -4.960
  101    HA3  GLY 104           HA3      GLY 104  29.860 -14.374  -4.370
  102    H    GLU 105           H        GLU 105  28.196 -13.267  -5.578
  103    HA   GLU 105           HA       GLU 105  27.191 -10.665  -4.985
  104    HB2  GLU 105           HB2      GLU 105  25.002 -11.552  -5.747
  105    HB3  GLU 105           HB3      GLU 105  26.311 -11.675  -6.904
  106    HG2  GLU 105           HG2      GLU 105  25.570 -14.083  -5.206
  107    HG3  GLU 105           HG3      GLU 105  24.612 -13.637  -6.604
  108    H    THR 106           H        THR 106  26.035  -9.826  -3.300
  109    HA   THR 106           HA       THR 106  25.762 -11.631  -0.973
  110    HB   THR 106           HB       THR 106  26.677  -8.776  -1.191
  111    HG1  THR 106           HG1      THR 106  28.088 -10.667  -1.496
  112   HG21  THR 106          HG21      THR 106  25.364  -8.726   0.795
  113   HG22  THR 106          HG22      THR 106  25.951 -10.335   1.315
  114   HG23  THR 106          HG23      THR 106  27.046  -8.930   1.290
  115    H    LYS 107           H        LYS 107  24.295  -8.439  -1.919
  116    HA   LYS 107           HA       LYS 107  21.617  -9.473  -1.095
  117    HB2  LYS 107           HB2      LYS 107  23.216  -7.355   0.383
  118    HB3  LYS 107           HB3      LYS 107  21.474  -7.374   0.496
  119    HG2  LYS 107           HG2      LYS 107  23.319  -9.612   1.418
  120    HG3  LYS 107           HG3      LYS 107  22.593  -8.395   2.433
  121    HD2  LYS 107           HD2      LYS 107  21.015 -10.466   0.843
  122    HD3  LYS 107           HD3      LYS 107  21.464 -10.598   2.540
  123    HE2  LYS 107           HE2      LYS 107  20.215  -8.497   3.044
  124    HE3  LYS 107           HE3      LYS 107  19.682  -8.416   1.359
  125    HZ1  LYS 107           HZ1      LYS 107  18.004  -9.485   2.764
  126    HZ2  LYS 107           HZ2      LYS 107  18.564 -10.585   1.695
  127    HZ3  LYS 107           HZ3      LYS 107  19.053 -10.634   3.256
  128    H    THR 108           H        THR 108  19.894  -7.987  -1.351
  129    HA   THR 108           HA       THR 108  20.295  -5.750  -3.284
  130    HB   THR 108           HB       THR 108  17.890  -6.096  -3.863
  131    HG1  THR 108           HG1      THR 108  16.963  -8.104  -3.217
  132   HG21  THR 108          HG21      THR 108  19.646  -8.557  -4.278
  133   HG22  THR 108          HG22      THR 108  18.192  -8.141  -5.212
  134   HG23  THR 108          HG23      THR 108  19.616  -7.102  -5.296
  135    H    TRP 109           H        TRP 109  18.749  -3.959  -3.054
  136    HA   TRP 109           HA       TRP 109  17.442  -3.588  -0.428
  137    HB2  TRP 109           HB2      TRP 109  19.717  -2.790  -0.047
  138    HB3  TRP 109           HB3      TRP 109  19.656  -1.787  -1.480
  139    HD1  TRP 109           HD1      TRP 109  17.343  -2.063   1.644
  140    HE1  TRP 109           HE1      TRP 109  16.906   0.294   2.576
  141    HE3  TRP 109           HE3      TRP 109  20.269   0.672  -1.577
  142    HZ2  TRP 109           HZ2      TRP 109  17.853   2.959   2.128
  143    HZ3  TRP 109           HZ3      TRP 109  20.503   3.118  -1.260
  144    HH2  TRP 109           HH2      TRP 109  19.317   4.272   0.591
  145    H    THR 110           H        THR 110  15.978  -1.778  -0.393
  146    HA   THR 110           HA       THR 110  14.626  -1.425  -3.024
  147    HB   THR 110           HB       THR 110  12.630  -1.096  -1.593
  148    HG1  THR 110           HG1      THR 110  13.085  -1.508   0.732
  149   HG21  THR 110          HG21      THR 110  14.184  -3.483  -0.496
  150   HG22  THR 110          HG22      THR 110  12.427  -3.275  -0.575
  151   HG23  THR 110          HG23      THR 110  13.352  -3.490  -2.065
  152    H    GLY 111           H        GLY 111  16.258   0.458  -0.611
  153    HA2  GLY 111           HA2      GLY 111  16.670   2.825  -0.800
  154    HA3  GLY 111           HA3      GLY 111  15.138   3.031  -1.646
  155    H    GLN 112           H        GLN 112  14.235   0.950   0.723
  156    HA   GLN 112           HA       GLN 112  13.134   3.061   2.447
  157    HB2  GLN 112           HB2      GLN 112  12.976   0.018   2.599
  158    HB3  GLN 112           HB3      GLN 112  12.093   1.128   3.634
  159    HG2  GLN 112           HG2      GLN 112  11.775   0.927   0.604
  160    HG3  GLN 112           HG3      GLN 112  10.683   0.252   1.803
  161   HE21  GLN 112          HE22      GLN 112  11.032   2.909  -0.238
  162   HE22  GLN 112          HE21      GLN 112  10.031   4.023   0.670
  163    H    GLY 113           H        GLY 113  13.584   3.426   4.618
  164    HA2  GLY 113           HA2      GLY 113  14.843   3.522   6.565
  165    HA3  GLY 113           HA3      GLY 113  15.575   1.976   6.149
  166    H    ARG 114           H        ARG 114  17.437   3.138   7.175
  167    HA   ARG 114           HA       ARG 114  18.865   5.230   5.725
  168    HB2  ARG 114           HB2      ARG 114  19.884   3.229   7.797
  169    HB3  ARG 114           HB3      ARG 114  20.736   4.675   7.261
  170    HG2  ARG 114           HG2      ARG 114  18.127   4.603   8.839
  171    HG3  ARG 114           HG3      ARG 114  19.729   5.004   9.453
  172    HD2  ARG 114           HD2      ARG 114  19.806   6.979   7.924
  173    HD3  ARG 114           HD3      ARG 114  18.153   6.595   7.386
  174    HE   ARG 114           HE       ARG 114  18.150   6.751  10.223
  175   HH11  ARG 114          HH11      ARG 114  18.487   8.968   7.520
  176   HH12  ARG 114          HH12      ARG 114  17.864  10.317   8.428
  177   HH21  ARG 114          HH21      ARG 114  17.371   8.519  11.323
  178   HH22  ARG 114          HH22      ARG 114  17.233  10.057  10.525
  179    H    THR 115           H        THR 115  20.761   5.072   4.517
  180    HA   THR 115           HA       THR 115  20.963   3.114   2.542
  181    HB   THR 115           HB       THR 115  23.217   4.867   3.567
  182    HG1  THR 115           HG1      THR 115  22.386   6.375   2.106
  183   HG21  THR 115          HG21      THR 115  23.989   3.235   1.877
  184   HG22  THR 115          HG22      THR 115  22.657   3.714   0.797
  185   HG23  THR 115          HG23      THR 115  23.950   4.864   1.197
  186    HA   PRO 116           HA       PRO 116  22.898  -0.412   4.604
  187    HB2  PRO 116           HB2      PRO 116  24.082  -0.790   1.848
  188    HB3  PRO 116           HB3      PRO 116  23.376  -2.026   2.940
  189    HG2  PRO 116           HG2      PRO 116  21.927  -1.044   0.881
  190    HG3  PRO 116           HG3      PRO 116  21.159  -1.232   2.491
  191    HD2  PRO 116           HD2      PRO 116  22.236   1.279   1.206
  192    HD3  PRO 116           HD3      PRO 116  20.742   1.034   2.155
  193    H    ALA 117           H        ALA 117  24.857  -0.857   5.603
  194    HA   ALA 117           HA       ALA 117  26.588   1.262   5.989
  195    HB1  ALA 117           HB1      ALA 117  27.938  -0.347   7.304
  196    HB2  ALA 117           HB2      ALA 117  26.199  -0.554   7.596
  197    HB3  ALA 117           HB3      ALA 117  27.070  -1.698   6.551
  198    H    VAL 118           H        VAL 118  27.406  -1.675   4.008
  199    HA   VAL 118           HA       VAL 118  29.987  -0.623   3.370
  200    HB   VAL 118           HB       VAL 118  29.416  -3.025   3.385
  201   HG11  VAL 118          HG11      VAL 118  28.196  -2.583   0.630
  202   HG12  VAL 118          HG12      VAL 118  28.440  -4.123   1.470
  203   HG13  VAL 118          HG13      VAL 118  27.267  -2.960   2.103
  204   HG21  VAL 118          HG21      VAL 118  31.492  -2.204   2.325
  205   HG22  VAL 118          HG22      VAL 118  30.884  -3.683   1.574
  206   HG23  VAL 118          HG23      VAL 118  30.656  -2.125   0.756
  207    H    ILE 119           H        ILE 119  26.893  -0.209   1.726
  208    HA   ILE 119           HA       ILE 119  27.908   1.049  -0.687
  209    HB   ILE 119           HB       ILE 119  25.266   1.201   0.805
  210   HG12  ILE 119          HG12      ILE 119  24.286   0.165  -1.111
  211   HG13  ILE 119          HG13      ILE 119  25.755   0.348  -2.063
  212   HG21  ILE 119          HG21      ILE 119  25.992   2.736  -1.727
  213   HG22  ILE 119          HG22      ILE 119  24.351   2.528  -1.072
  214   HG23  ILE 119          HG23      ILE 119  25.539   3.443  -0.163
  215   HD11  ILE 119          HD11      ILE 119  26.865  -1.403  -0.885
  216   HD12  ILE 119          HD12      ILE 119  25.575  -1.496   0.344
  217   HD13  ILE 119          HD13      ILE 119  25.242  -1.962  -1.328
  218    H    LYS 120           H        LYS 120  26.819   2.346   2.491
  219    HA   LYS 120           HA       LYS 120  27.488   5.077   2.006
  220    HB2  LYS 120           HB2      LYS 120  26.032   4.444   3.818
  221    HB3  LYS 120           HB3      LYS 120  27.278   3.443   4.573
  222    HG2  LYS 120           HG2      LYS 120  28.631   5.377   5.112
  223    HG3  LYS 120           HG3      LYS 120  27.587   6.438   4.151
  224    HD2  LYS 120           HD2      LYS 120  27.133   6.800   6.485
  225    HD3  LYS 120           HD3      LYS 120  25.717   6.032   5.754
  226    HE2  LYS 120           HE2      LYS 120  26.393   3.842   6.692
  227    HE3  LYS 120           HE3      LYS 120  27.885   4.553   7.327
  228    HZ1  LYS 120           HZ1      LYS 120  26.163   4.401   9.053
  229    HZ2  LYS 120           HZ2      LYS 120  26.524   5.969   8.780
  230    HZ3  LYS 120           HZ3      LYS 120  25.137   5.335   8.193
  231    H    LYS 121           H        LYS 121  29.491   2.469   3.431
  232    HA   LYS 121           HA       LYS 121  31.734   4.200   3.855
  233    HB2  LYS 121           HB2      LYS 121  31.168   1.629   4.677
  234    HB3  LYS 121           HB3      LYS 121  32.366   1.312   3.428
  235    HG2  LYS 121           HG2      LYS 121  33.637   1.585   5.404
  236    HG3  LYS 121           HG3      LYS 121  33.798   3.149   4.596
  237    HD2  LYS 121           HD2      LYS 121  31.799   3.930   6.080
  238    HD3  LYS 121           HD3      LYS 121  31.980   2.402   6.922
  239    HE2  LYS 121           HE2      LYS 121  33.132   3.923   8.249
  240    HE3  LYS 121           HE3      LYS 121  34.418   3.066   7.392
  241    HZ1  LYS 121           HZ1      LYS 121  34.592   5.582   7.497
  242    HZ2  LYS 121           HZ2      LYS 121  34.744   5.001   5.990
  243    HZ3  LYS 121           HZ3      LYS 121  33.317   5.691   6.475
  244    H    ALA 122           H        ALA 122  30.968   2.092   1.049
  245    HA   ALA 122           HA       ALA 122  33.337   2.675  -0.416
  246    HB1  ALA 122           HB1      ALA 122  30.513   2.081  -1.405
  247    HB2  ALA 122           HB2      ALA 122  32.004   1.952  -2.371
  248    HB3  ALA 122           HB3      ALA 122  31.749   0.870  -0.985
  249    H    MET 123           H        MET 123  30.207   4.444  -0.289
  250    HA   MET 123           HA       MET 123  30.911   6.509  -2.125
  251    HB2  MET 123           HB2      MET 123  28.953   6.483   0.197
  252    HB3  MET 123           HB3      MET 123  29.099   7.805  -0.966
  253    HG2  MET 123           HG2      MET 123  28.455   6.342  -2.807
  254    HG3  MET 123           HG3      MET 123  28.517   4.930  -1.782
  255    HE1  MET 123           HE1      MET 123  25.209   8.174  -1.624
  256    HE2  MET 123           HE2      MET 123  26.828   8.500  -0.975
  257    HE3  MET 123           HE3      MET 123  26.611   8.202  -2.716
  258    H    GLU 124           H        GLU 124  31.473   6.300   1.431
  259    HA   GLU 124           HA       GLU 124  32.653   8.914   1.657
  260    HB2  GLU 124           HB2      GLU 124  32.794   6.419   3.385
  261    HB3  GLU 124           HB3      GLU 124  33.596   7.937   3.808
  262    HG2  GLU 124           HG2      GLU 124  31.442   9.127   3.770
  263    HG3  GLU 124           HG3      GLU 124  30.598   7.629   3.404
  264    H    GLU 125           H        GLU 125  34.204   5.653   1.480
  265    HA   GLU 125           HA       GLU 125  36.853   6.751   1.793
  266    HB2  GLU 125           HB2      GLU 125  35.989   3.987   0.857
  267    HB3  GLU 125           HB3      GLU 125  37.622   4.439   1.329
  268    HG2  GLU 125           HG2      GLU 125  35.179   4.270   3.113
  269    HG3  GLU 125           HG3      GLU 125  36.582   3.223   3.123
  270    H    GLN 126           H        GLN 126  34.981   6.057  -1.099
  271    HA   GLN 126           HA       GLN 126  37.393   6.584  -2.810
  272    HB2  GLN 126           HB2      GLN 126  35.054   4.714  -3.339
  273    HB3  GLN 126           HB3      GLN 126  36.413   5.008  -4.427
  274    HG2  GLN 126           HG2      GLN 126  37.973   4.136  -2.680
  275    HG3  GLN 126           HG3      GLN 126  36.584   3.714  -1.673
  276   HE21  GLN 126          HE22      GLN 126  38.780   2.205  -3.521
  277   HE22  GLN 126          HE21      GLN 126  37.771   0.960  -4.238
  278    H    GLY 127           H        GLY 127  34.660   8.170  -1.894
  279    HA2  GLY 127           HA2      GLY 127  33.470   9.917  -2.778
  280    HA3  GLY 127           HA3      GLY 127  34.613   9.969  -4.124
  281    H    LYS 128           H        LYS 128  33.059   6.929  -3.773
  282    HA   LYS 128           HA       LYS 128  31.776   7.030  -6.336
  283    HB2  LYS 128           HB2      LYS 128  31.658   5.064  -4.003
  284    HB3  LYS 128           HB3      LYS 128  30.705   4.827  -5.476
  285    HG2  LYS 128           HG2      LYS 128  32.718   4.890  -6.859
  286    HG3  LYS 128           HG3      LYS 128  33.729   5.183  -5.436
  287    HD2  LYS 128           HD2      LYS 128  33.939   2.878  -6.035
  288    HD3  LYS 128           HD3      LYS 128  33.013   2.946  -4.526
  289    HE2  LYS 128           HE2      LYS 128  30.904   2.632  -5.767
  290    HE3  LYS 128           HE3      LYS 128  31.761   2.773  -7.308
  291    HZ1  LYS 128           HZ1      LYS 128  32.115   0.537  -5.370
  292    HZ2  LYS 128           HZ2      LYS 128  31.310   0.495  -6.809
  293    HZ3  LYS 128           HZ3      LYS 128  32.933   0.698  -6.788
  294    H    GLN 129           H        GLN 129  29.526   6.489  -6.759
  295    HA   GLN 129           HA       GLN 129  27.619   8.042  -5.044
  296    HB2  GLN 129           HB2      GLN 129  27.748   7.949  -8.086
  297    HB3  GLN 129           HB3      GLN 129  26.579   8.850  -7.119
  298    HG2  GLN 129           HG2      GLN 129  29.584   9.364  -7.270
  299    HG3  GLN 129           HG3      GLN 129  28.327  10.325  -8.024
  300   HE21  GLN 129          HE22      GLN 129  30.441  10.540  -5.524
  301   HE22  GLN 129          HE21      GLN 129  29.453  11.492  -4.432
  302    H    LEU 130           H        LEU 130  25.396   7.365  -5.204
  303    HA   LEU 130           HA       LEU 130  25.200   4.612  -4.696
  304    HB2  LEU 130           HB2      LEU 130  23.835   6.447  -3.715
  305    HB3  LEU 130           HB3      LEU 130  23.021   6.656  -5.268
  306    HG   LEU 130           HG       LEU 130  22.043   4.402  -5.069
  307   HD11  LEU 130          HD11      LEU 130  23.746   3.236  -3.722
  308   HD12  LEU 130          HD12      LEU 130  23.391   4.308  -2.341
  309   HD13  LEU 130          HD13      LEU 130  22.174   3.150  -2.936
  310   HD21  LEU 130          HD21      LEU 130  20.835   6.346  -4.147
  311   HD22  LEU 130          HD22      LEU 130  20.510   4.886  -3.196
  312   HD23  LEU 130          HD23      LEU 130  21.639   6.111  -2.578
  313    H    GLU 131           H        GLU 131  24.668   6.283  -7.701
  314    HA   GLU 131           HA       GLU 131  23.153   4.315  -9.110
  315    HB2  GLU 131           HB2      GLU 131  23.861   5.425 -11.131
  316    HB3  GLU 131           HB3      GLU 131  23.431   6.609  -9.898
  317    HG2  GLU 131           HG2      GLU 131  25.854   6.960  -9.408
  318    HG3  GLU 131           HG3      GLU 131  26.272   5.788 -10.658
  319    H    ASP 132           H        ASP 132  26.568   4.179  -8.178
  320    HA   ASP 132           HA       ASP 132  27.297   2.142 -10.069
  321    HB2  ASP 132           HB2      ASP 132  28.888   3.468  -8.650
  322    HB3  ASP 132           HB3      ASP 132  28.362   2.524  -7.251
  323    H    PHE 133           H        PHE 133  25.335   2.069  -7.190
  324    HA   PHE 133           HA       PHE 133  25.297  -0.913  -7.069
  325    HB2  PHE 133           HB2      PHE 133  24.278   1.163  -5.090
  326    HB3  PHE 133           HB3      PHE 133  24.307  -0.574  -4.856
  327    HD1  PHE 133           HD2      PHE 133  26.493  -1.791  -4.595
  328    HD2  PHE 133           HD1      PHE 133  26.275   2.512  -4.715
  329    HE1  PHE 133           HE2      PHE 133  28.737  -1.646  -3.550
  330    HE2  PHE 133           HE1      PHE 133  28.519   2.652  -3.663
  331    HZ   PHE 133           HZ       PHE 133  29.754   0.562  -3.090
  332    H    LEU 134           H        LEU 134  23.371   1.837  -7.976
  333    HA   LEU 134           HA       LEU 134  20.749   0.659  -7.818
  334    HB2  LEU 134           HB2      LEU 134  21.535   3.131  -7.970
  335    HB3  LEU 134           HB3      LEU 134  21.644   2.861  -9.703
  336    HG   LEU 134           HG       LEU 134  19.146   2.626  -7.980
  337   HD11  LEU 134          HD11      LEU 134  18.453   4.698  -9.096
  338   HD12  LEU 134          HD12      LEU 134  19.984   4.932  -8.244
  339   HD13  LEU 134          HD13      LEU 134  19.976   4.737 -10.011
  340   HD21  LEU 134          HD21      LEU 134  17.921   2.684 -10.198
  341   HD22  LEU 134          HD22      LEU 134  19.472   2.341 -10.986
  342   HD23  LEU 134          HD23      LEU 134  18.762   1.183  -9.832
  343    H    ILE 135           H        ILE 135  19.954  -0.899  -9.007
  344    HA   ILE 135           HA       ILE 135  21.132  -1.572 -11.687
  345    HB   ILE 135           HB       ILE 135  20.798  -3.991 -11.046
  346   HG12  ILE 135          HG12      ILE 135  20.915  -4.601  -8.697
  347   HG13  ILE 135          HG13      ILE 135  20.690  -2.933  -8.191
  348   HG21  ILE 135          HG21      ILE 135  22.979  -2.874 -11.164
  349   HG22  ILE 135          HG22      ILE 135  22.827  -2.375  -9.469
  350   HG23  ILE 135          HG23      ILE 135  22.931  -4.095  -9.886
  351   HD11  ILE 135          HD11      ILE 135  18.659  -4.363  -7.960
  352   HD12  ILE 135          HD12      ILE 135  18.370  -2.987  -9.036
  353   HD13  ILE 135          HD13      ILE 135  18.640  -4.613  -9.713
  354    H    LYS 136           H        LYS 136  18.155  -0.678 -10.431
  355    HA   LYS 136           HA       LYS 136  16.394  -2.566 -11.624
  356    HB2  LYS 136           HB2      LYS 136  15.693  -0.965  -9.924
  357    HB3  LYS 136           HB3      LYS 136  15.975   0.398 -11.020
  358    HG2  LYS 136           HG2      LYS 136  14.170  -0.422 -12.500
  359    HG3  LYS 136           HG3      LYS 136  13.914  -1.817 -11.434
  360    HD2  LYS 136           HD2      LYS 136  13.262  -0.325  -9.599
  361    HD3  LYS 136           HD3      LYS 136  13.583   1.106 -10.589
  362    HE2  LYS 136           HE2      LYS 136  11.540  -1.054 -11.298
  363    HE3  LYS 136           HE3      LYS 136  11.141   0.401 -10.386
  364    HZ1  LYS 136           HZ1      LYS 136  11.841   1.747 -12.308
  365    HZ2  LYS 136           HZ2      LYS 136  12.183   0.411 -13.184
  366    HZ3  LYS 136           HZ3      LYS 136  10.655   0.722 -12.730
  367    H    GLU 137           H        GLU 137  17.689   0.430 -13.012
  368    HA   GLU 137           HA       GLU 137  16.699  -0.399 -15.713
  369    HB2  GLU 137           HB2      GLU 137  15.223   1.170 -14.118
  370    HB3  GLU 137           HB3      GLU 137  16.260   2.432 -14.762
  371    HG2  GLU 137           HG2      GLU 137  15.524   1.873 -17.054
  372    HG3  GLU 137           HG3      GLU 137  14.666   0.451 -16.464
  373    H    LEU 138           H        LEU 138  19.456  -0.150 -14.515
  374    HA   LEU 138           HA       LEU 138  20.667   1.776 -16.464
  375    HB2  LEU 138           HB2      LEU 138  21.605   1.140 -13.644
  376    HB3  LEU 138           HB3      LEU 138  22.413   2.226 -14.777
  377    HG   LEU 138           HG       LEU 138  19.664   2.703 -13.560
  378   HD11  LEU 138          HD11      LEU 138  21.578   2.886 -11.984
  379   HD12  LEU 138          HD12      LEU 138  22.323   4.094 -13.047
  380   HD13  LEU 138          HD13      LEU 138  20.760   4.437 -12.266
  381   HD21  LEU 138          HD21      LEU 138  21.390   4.500 -15.321
  382   HD22  LEU 138          HD22      LEU 138  19.831   3.784 -15.773
  383   HD23  LEU 138          HD23      LEU 138  19.896   4.989 -14.486
  384    H    GLU 139           H        GLU 139  20.127  -1.148 -16.609
  385    HA   GLU 139           HA       GLU 139  22.750  -2.031 -17.641
  386    HB2  GLU 139           HB2      GLU 139  22.686  -2.815 -15.279
  387    HB3  GLU 139           HB3      GLU 139  21.190  -3.694 -15.620
  388    HG2  GLU 139           HG2      GLU 139  22.392  -5.092 -17.286
  389    HG3  GLU 139           HG3      GLU 139  23.870  -4.167 -17.010
  Start of MODEL    4
    1    H1   ALA  91           H1       ALA  91   4.914 -15.985  -5.885
    2    H2   ALA  91           H2       ALA  91   3.531 -15.465  -5.176
    3    H3   ALA  91           H3       ALA  91   4.121 -14.686  -6.490
    4    HA   ALA  91           HA       ALA  91   4.559 -13.395  -4.521
    5    HB1  ALA  91           HB1      ALA  91   6.040 -14.266  -2.757
    6    HB2  ALA  91           HB2      ALA  91   4.596 -15.274  -2.909
    7    HB3  ALA  91           HB3      ALA  91   6.144 -15.835  -3.583
    8    H    ALA  92           H        ALA  92   6.517 -12.131  -4.247
    9    HA   ALA  92           HA       ALA  92   8.852 -12.743  -5.951
   10    HB1  ALA  92           HB1      ALA  92   8.642 -10.595  -7.176
   11    HB2  ALA  92           HB2      ALA  92   7.243 -11.634  -7.483
   12    HB3  ALA  92           HB3      ALA  92   7.099 -10.268  -6.355
   13    H    ARG  93           H        ARG  93  10.554 -11.065  -5.719
   14    HA   ARG  93           HA       ARG  93  10.529  -9.455  -3.216
   15    HB2  ARG  93           HB2      ARG  93  11.304 -11.799  -2.712
   16    HB3  ARG  93           HB3      ARG  93  12.698 -11.523  -3.764
   17    HG2  ARG  93           HG2      ARG  93  13.371  -9.590  -2.312
   18    HG3  ARG  93           HG3      ARG  93  11.976  -9.889  -1.272
   19    HD2  ARG  93           HD2      ARG  93  14.220 -11.884  -1.810
   20    HD3  ARG  93           HD3      ARG  93  14.144 -10.803  -0.407
   21    HE   ARG  93           HE       ARG  93  11.712 -12.174  -0.400
   22   HH11  ARG  93          HH12      ARG  93  15.070 -13.102  -0.068
   23   HH12  ARG  93          HH11      ARG  93  14.692 -14.509   0.887
   24   HH21  ARG  93          HH21      ARG  93  11.284 -13.993   0.818
   25   HH22  ARG  93          HH22      ARG  93  12.595 -14.987   1.382
   26    HA   PRO  94           HA       PRO  94  12.552  -7.440  -6.916
   27    HB2  PRO  94           HB2      PRO  94  11.114  -5.106  -6.968
   28    HB3  PRO  94           HB3      PRO  94  10.530  -6.631  -7.703
   29    HG2  PRO  94           HG2      PRO  94   9.863  -5.517  -4.957
   30    HG3  PRO  94           HG3      PRO  94   8.730  -6.105  -6.216
   31    HD2  PRO  94           HD2      PRO  94   9.548  -7.684  -4.152
   32    HD3  PRO  94           HD3      PRO  94   9.304  -8.355  -5.796
   33    H    ALA  95           H        ALA  95  13.846  -5.482  -7.027
   34    HA   ALA  95           HA       ALA  95  14.442  -4.001  -4.550
   35    HB1  ALA  95           HB1      ALA  95  15.785  -6.067  -4.338
   36    HB2  ALA  95           HB2      ALA  95  16.495  -5.789  -5.943
   37    HB3  ALA  95           HB3      ALA  95  16.838  -4.674  -4.604
   38    H    LYS  96           H        LYS  96  16.257  -2.412  -4.957
   39    HA   LYS  96           HA       LYS  96  16.158  -1.251  -7.691
   40    HB2  LYS  96           HB2      LYS  96  14.734  -0.071  -6.030
   41    HB3  LYS  96           HB3      LYS  96  16.155   0.200  -5.012
   42    HG2  LYS  96           HG2      LYS  96  17.198   1.563  -6.779
   43    HG3  LYS  96           HG3      LYS  96  15.837   1.262  -7.859
   44    HD2  LYS  96           HD2      LYS  96  15.714   2.716  -5.177
   45    HD3  LYS  96           HD3      LYS  96  15.810   3.502  -6.744
   46    HE2  LYS  96           HE2      LYS  96  13.485   1.799  -5.712
   47    HE3  LYS  96           HE3      LYS  96  13.550   3.556  -5.810
   48    HZ1  LYS  96           HZ1      LYS  96  13.399   1.667  -8.088
   49    HZ2  LYS  96           HZ2      LYS  96  12.411   2.927  -7.736
   50    HZ3  LYS  96           HZ3      LYS  96  13.933   3.204  -8.302
   51    H    TYR  97           H        TYR  97  18.192  -2.086  -4.968
   52    HA   TYR  97           HA       TYR  97  20.579  -1.402  -6.607
   53    HB2  TYR  97           HB2      TYR  97  20.432  -1.037  -3.593
   54    HB3  TYR  97           HB3      TYR  97  21.728  -0.546  -4.666
   55    HD1  TYR  97           HD2      TYR  97  21.488   1.491  -6.080
   56    HD2  TYR  97           HD1      TYR  97  18.429   0.305  -3.283
   57    HE1  TYR  97           HE2      TYR  97  20.415   3.713  -6.313
   58    HE2  TYR  97           HE1      TYR  97  17.437   2.577  -3.419
   59    HH   TYR  97           HH       TYR  97  17.579   4.693  -4.353
   60    H    SER  98           H        SER  98  22.417  -2.688  -6.172
   61    HA   SER  98           HA       SER  98  22.132  -5.197  -4.572
   62    HB2  SER  98           HB2      SER  98  22.737  -4.880  -7.525
   63    HB3  SER  98           HB3      SER  98  23.337  -6.276  -6.587
   64    HG   SER  98           HG       SER  98  21.332  -6.765  -7.520
   65    H    TYR  99           H        TYR  99  24.036  -5.841  -3.581
   66    HA   TYR  99           HA       TYR  99  26.535  -4.352  -4.181
   67    HB2  TYR  99           HB2      TYR  99  26.718  -3.500  -1.926
   68    HB3  TYR  99           HB3      TYR  99  25.263  -2.930  -2.695
   69    HD1  TYR  99           HD2      TYR  99  23.011  -3.742  -1.962
   70    HD2  TYR  99           HD1      TYR  99  26.637  -4.927   0.046
   71    HE1  TYR  99           HE2      TYR  99  21.709  -4.246   0.112
   72    HE2  TYR  99           HE1      TYR  99  25.337  -5.430   2.108
   73    HH   TYR  99           HH       TYR  99  23.262  -5.388   3.125
   74    H    VAL 100           H        VAL 100  28.280  -4.885  -2.604
   75    HA   VAL 100           HA       VAL 100  28.671  -7.858  -2.582
   76    HB   VAL 100           HB       VAL 100  30.506  -5.535  -3.314
   77   HG11  VAL 100          HG11      VAL 100  31.172  -8.503  -3.248
   78   HG12  VAL 100          HG12      VAL 100  32.150  -7.274  -4.068
   79   HG13  VAL 100          HG13      VAL 100  31.965  -7.206  -2.323
   80   HG21  VAL 100          HG21      VAL 100  30.515  -6.504  -5.562
   81   HG22  VAL 100          HG22      VAL 100  29.448  -7.810  -5.032
   82   HG23  VAL 100          HG23      VAL 100  28.861  -6.133  -5.082
   83    H    ASP 101           H        ASP 101  30.209  -8.686  -1.040
   84    HA   ASP 101           HA       ASP 101  31.067  -6.823   1.140
   85    HB2  ASP 101           HB2      ASP 101  29.137  -8.059   1.974
   86    HB3  ASP 101           HB3      ASP 101  29.915  -9.594   1.574
   87    H    GLU 102           H        GLU 102  31.736 -10.150  -0.264
   88    HA   GLU 102           HA       GLU 102  34.611  -9.452  -0.140
   89    HB2  GLU 102           HB2      GLU 102  33.974 -10.522   2.017
   90    HB3  GLU 102           HB3      GLU 102  33.354 -11.922   1.136
   91    HG2  GLU 102           HG2      GLU 102  35.615 -12.309   0.209
   92    HG3  GLU 102           HG3      GLU 102  36.220 -10.920   1.105
   93    H    ASN 103           H        ASN 103  32.430 -12.204  -1.110
   94    HA   ASN 103           HA       ASN 103  34.417 -12.863  -3.176
   95    HB2  ASN 103           HB2      ASN 103  32.234 -14.545  -1.899
   96    HB3  ASN 103           HB3      ASN 103  33.459 -15.127  -3.028
   97   HD21  ASN 103          HD22      ASN 103  32.799 -14.649   0.300
   98   HD22  ASN 103          HD21      ASN 103  34.465 -14.645   0.869
   99    H    GLY 104           H        GLY 104  31.705 -11.087  -3.275
  100    HA2  GLY 104           HA2      GLY 104  31.274 -10.737  -5.915
  101    HA3  GLY 104           HA3      GLY 104  30.411 -12.261  -5.670
  102    H    GLU 105           H        GLU 105  28.737 -10.529  -6.562
  103    HA   GLU 105           HA       GLU 105  27.482  -8.732  -4.731
  104    HB2  GLU 105           HB2      GLU 105  26.256 -10.306  -7.012
  105    HB3  GLU 105           HB3      GLU 105  25.450  -9.041  -6.057
  106    HG2  GLU 105           HG2      GLU 105  27.137  -7.390  -6.738
  107    HG3  GLU 105           HG3      GLU 105  27.984  -8.612  -7.692
  108    H    THR 106           H        THR 106  26.409  -9.045  -2.958
  109    HA   THR 106           HA       THR 106  25.761 -11.805  -2.171
  110    HB   THR 106           HB       THR 106  27.760 -10.834  -1.178
  111    HG1  THR 106           HG1      THR 106  27.278 -11.646   0.843
  112   HG21  THR 106          HG21      THR 106  25.899  -9.037   0.429
  113   HG22  THR 106          HG22      THR 106  27.636  -9.238   0.640
  114   HG23  THR 106          HG23      THR 106  27.017  -8.478  -0.829
  115    H    LYS 107           H        LYS 107  24.581  -8.453  -1.946
  116    HA   LYS 107           HA       LYS 107  21.925  -9.397  -0.985
  117    HB2  LYS 107           HB2      LYS 107  23.807  -7.545   0.530
  118    HB3  LYS 107           HB3      LYS 107  22.061  -7.515   0.791
  119    HG2  LYS 107           HG2      LYS 107  22.099  -9.920   1.399
  120    HG3  LYS 107           HG3      LYS 107  23.863  -9.923   1.238
  121    HD2  LYS 107           HD2      LYS 107  24.033  -8.181   3.000
  122    HD3  LYS 107           HD3      LYS 107  22.263  -8.193   3.172
  123    HE2  LYS 107           HE2      LYS 107  22.351 -10.618   3.765
  124    HE3  LYS 107           HE3      LYS 107  24.109 -10.590   3.614
  125    HZ1  LYS 107           HZ1      LYS 107  22.545  -8.998   5.591
  126    HZ2  LYS 107           HZ2      LYS 107  23.415 -10.334   5.931
  127    HZ3  LYS 107           HZ3      LYS 107  24.176  -8.973   5.456
  128    H    THR 108           H        THR 108  20.388  -7.545  -0.769
  129    HA   THR 108           HA       THR 108  20.728  -5.498  -2.904
  130    HB   THR 108           HB       THR 108  18.589  -6.052  -3.868
  131    HG1  THR 108           HG1      THR 108  17.497  -7.967  -3.135
  132   HG21  THR 108          HG21      THR 108  20.643  -7.367  -4.616
  133   HG22  THR 108          HG22      THR 108  20.042  -8.713  -3.629
  134   HG23  THR 108          HG23      THR 108  19.071  -8.094  -4.984
  135    H    TRP 109           H        TRP 109  18.999  -3.868  -2.927
  136    HA   TRP 109           HA       TRP 109  17.556  -3.406  -0.382
  137    HB2  TRP 109           HB2      TRP 109  19.812  -2.548   0.035
  138    HB3  TRP 109           HB3      TRP 109  19.778  -1.628  -1.455
  139    HD1  TRP 109           HD1      TRP 109  17.294  -1.727   1.549
  140    HE1  TRP 109           HE1      TRP 109  16.863   0.678   2.340
  141    HE3  TRP 109           HE3      TRP 109  20.545   0.757  -1.557
  142    HZ2  TRP 109           HZ2      TRP 109  17.894   3.312   1.802
  143    HZ3  TRP 109           HZ3      TRP 109  20.822   3.208  -1.354
  144    HH2  TRP 109           HH2      TRP 109  19.518   4.498   0.322
  145    H    THR 110           H        THR 110  16.036  -1.642  -0.491
  146    HA   THR 110           HA       THR 110  14.835  -1.358  -3.201
  147    HB   THR 110           HB       THR 110  12.779  -0.896  -1.860
  148    HG1  THR 110           HG1      THR 110  12.974  -1.321   0.411
  149   HG21  THR 110          HG21      THR 110  13.319  -3.231  -2.526
  150   HG22  THR 110          HG22      THR 110  14.182  -3.462  -0.987
  151   HG23  THR 110          HG23      THR 110  12.436  -3.146  -0.996
  152    H    GLY 111           H        GLY 111  16.273   0.625  -0.716
  153    HA2  GLY 111           HA2      GLY 111  16.752   2.968  -1.067
  154    HA3  GLY 111           HA3      GLY 111  15.265   3.137  -1.993
  155    H    GLN 112           H        GLN 112  14.131   1.281   0.418
  156    HA   GLN 112           HA       GLN 112  13.236   3.566   2.076
  157    HB2  GLN 112           HB2      GLN 112  12.487   0.616   1.977
  158    HB3  GLN 112           HB3      GLN 112  11.952   1.696   3.260
  159    HG2  GLN 112           HG2      GLN 112  10.180   1.608   1.692
  160    HG3  GLN 112           HG3      GLN 112  10.903   3.205   1.567
  161   HE21  GLN 112          HE22      GLN 112  11.515   3.894  -0.535
  162   HE22  GLN 112          HE21      GLN 112  11.553   2.802  -1.910
  163    H    GLY 113           H        GLY 113  13.550   3.737   4.312
  164    HA2  GLY 113           HA2      GLY 113  14.768   3.656   6.290
  165    HA3  GLY 113           HA3      GLY 113  15.400   2.077   5.828
  166    H    ARG 114           H        ARG 114  17.288   3.230   6.973
  167    HA   ARG 114           HA       ARG 114  18.868   5.161   5.511
  168    HB2  ARG 114           HB2      ARG 114  20.642   4.661   7.067
  169    HB3  ARG 114           HB3      ARG 114  19.113   4.834   7.925
  170    HG2  ARG 114           HG2      ARG 114  18.945   2.340   8.091
  171    HG3  ARG 114           HG3      ARG 114  20.501   2.194   7.245
  172    HD2  ARG 114           HD2      ARG 114  21.607   3.475   9.042
  173    HD3  ARG 114           HD3      ARG 114  20.080   3.646   9.899
  174    HE   ARG 114           HE       ARG 114  21.754   1.218   9.627
  175   HH11  ARG 114          HH11      ARG 114  18.676   2.430  10.821
  176   HH12  ARG 114          HH12      ARG 114  18.417   1.032  11.822
  177   HH21  ARG 114          HH21      ARG 114  21.359  -0.522  10.940
  178   HH22  ARG 114          HH22      ARG 114  19.906  -0.590  11.891
  179    H    THR 115           H        THR 115  20.773   4.907   4.326
  180    HA   THR 115           HA       THR 115  20.955   2.863   2.401
  181    HB   THR 115           HB       THR 115  23.220   4.602   3.430
  182    HG1  THR 115           HG1      THR 115  22.482   6.085   1.906
  183   HG21  THR 115          HG21      THR 115  24.016   4.471   1.072
  184   HG22  THR 115          HG22      THR 115  24.025   2.891   1.868
  185   HG23  THR 115          HG23      THR 115  22.734   3.298   0.712
  186    HA   PRO 116           HA       PRO 116  22.821  -0.603   4.673
  187    HB2  PRO 116           HB2      PRO 116  24.045  -1.067   1.940
  188    HB3  PRO 116           HB3      PRO 116  23.357  -2.264   3.079
  189    HG2  PRO 116           HG2      PRO 116  21.885  -1.391   0.985
  190    HG3  PRO 116           HG3      PRO 116  21.128  -1.545   2.601
  191    HD2  PRO 116           HD2      PRO 116  22.119   0.959   1.224
  192    HD3  PRO 116           HD3      PRO 116  20.648   0.700   2.210
  193    H    ALA 117           H        ALA 117  24.681  -0.814   5.836
  194    HA   ALA 117           HA       ALA 117  26.418   1.326   6.029
  195    HB1  ALA 117           HB1      ALA 117  25.958  -0.279   7.824
  196    HB2  ALA 117           HB2      ALA 117  26.862  -1.546   6.960
  197    HB3  ALA 117           HB3      ALA 117  27.705  -0.111   7.581
  198    H    VAL 118           H        VAL 118  27.208  -1.783   4.367
  199    HA   VAL 118           HA       VAL 118  29.834  -0.929   3.637
  200    HB   VAL 118           HB       VAL 118  29.122  -3.269   3.751
  201   HG11  VAL 118          HG11      VAL 118  26.929  -3.099   2.565
  202   HG12  VAL 118          HG12      VAL 118  27.807  -2.860   1.033
  203   HG13  VAL 118          HG13      VAL 118  27.984  -4.373   1.941
  204   HG21  VAL 118          HG21      VAL 118  31.198  -2.629   2.570
  205   HG22  VAL 118          HG22      VAL 118  30.456  -4.095   1.905
  206   HG23  VAL 118          HG23      VAL 118  30.300  -2.557   1.037
  207    H    ILE 119           H        ILE 119  26.731  -0.420   1.946
  208    HA   ILE 119           HA       ILE 119  27.912   0.695  -0.471
  209    HB   ILE 119           HB       ILE 119  25.168   1.131   0.769
  210   HG12  ILE 119          HG12      ILE 119  26.134  -0.606  -1.545
  211   HG13  ILE 119          HG13      ILE 119  25.542  -1.176   0.015
  212   HG21  ILE 119          HG21      ILE 119  25.805   3.081  -0.643
  213   HG22  ILE 119          HG22      ILE 119  26.184   1.973  -1.977
  214   HG23  ILE 119          HG23      ILE 119  24.524   2.163  -1.386
  215   HD11  ILE 119          HD11      ILE 119  23.304  -0.066  -0.543
  216   HD12  ILE 119          HD12      ILE 119  23.925   0.148  -2.197
  217   HD13  ILE 119          HD13      ILE 119  23.744  -1.471  -1.528
  218    H    LYS 120           H        LYS 120  26.715   2.161   2.593
  219    HA   LYS 120           HA       LYS 120  27.421   4.878   2.037
  220    HB2  LYS 120           HB2      LYS 120  26.016   4.385   3.898
  221    HB3  LYS 120           HB3      LYS 120  27.188   3.278   4.614
  222    HG2  LYS 120           HG2      LYS 120  28.698   5.087   5.180
  223    HG3  LYS 120           HG3      LYS 120  27.684   6.261   4.300
  224    HD2  LYS 120           HD2      LYS 120  25.831   5.849   5.900
  225    HD3  LYS 120           HD3      LYS 120  26.842   4.673   6.766
  226    HE2  LYS 120           HE2      LYS 120  28.513   6.457   7.237
  227    HE3  LYS 120           HE3      LYS 120  27.512   7.628   6.375
  228    HZ1  LYS 120           HZ1      LYS 120  25.754   7.256   8.044
  229    HZ2  LYS 120           HZ2      LYS 120  26.691   6.180   8.846
  230    HZ3  LYS 120           HZ3      LYS 120  27.125   7.752   8.770
  231    H    LYS 121           H        LYS 121  29.377   2.307   3.555
  232    HA   LYS 121           HA       LYS 121  31.669   3.972   3.920
  233    HB2  LYS 121           HB2      LYS 121  31.029   1.599   4.966
  234    HB3  LYS 121           HB3      LYS 121  31.965   0.976   3.602
  235    HG2  LYS 121           HG2      LYS 121  33.570   1.205   5.303
  236    HG3  LYS 121           HG3      LYS 121  33.789   2.695   4.369
  237    HD2  LYS 121           HD2      LYS 121  32.055   3.720   6.095
  238    HD3  LYS 121           HD3      LYS 121  32.422   2.294   7.057
  239    HE2  LYS 121           HE2      LYS 121  34.336   4.497   6.168
  240    HE3  LYS 121           HE3      LYS 121  33.773   4.160   7.802
  241    HZ1  LYS 121           HZ1      LYS 121  35.960   3.262   7.589
  242    HZ2  LYS 121           HZ2      LYS 121  34.977   1.955   7.577
  243    HZ3  LYS 121           HZ3      LYS 121  35.652   2.524   6.173
  244    H    ALA 122           H        ALA 122  30.876   1.749   1.230
  245    HA   ALA 122           HA       ALA 122  33.287   2.179  -0.228
  246    HB1  ALA 122           HB1      ALA 122  30.479   1.438  -1.166
  247    HB2  ALA 122           HB2      ALA 122  31.964   1.288  -2.140
  248    HB3  ALA 122           HB3      ALA 122  31.761   0.318  -0.668
  249    H    MET 123           H        MET 123  30.141   3.955  -0.352
  250    HA   MET 123           HA       MET 123  30.919   5.812  -2.367
  251    HB2  MET 123           HB2      MET 123  28.910   6.084  -0.108
  252    HB3  MET 123           HB3      MET 123  29.118   7.264  -1.407
  253    HG2  MET 123           HG2      MET 123  28.743   5.335  -3.050
  254    HG3  MET 123           HG3      MET 123  28.197   4.388  -1.690
  255    HE1  MET 123           HE1      MET 123  26.173   5.247  -0.063
  256    HE2  MET 123           HE2      MET 123  26.613   6.969  -0.044
  257    HE3  MET 123           HE3      MET 123  24.987   6.473  -0.567
  258    H    GLU 124           H        GLU 124  31.312   6.041   1.214
  259    HA   GLU 124           HA       GLU 124  32.585   8.607   1.141
  260    HB2  GLU 124           HB2      GLU 124  32.564   6.350   3.176
  261    HB3  GLU 124           HB3      GLU 124  33.405   7.871   3.458
  262    HG2  GLU 124           HG2      GLU 124  30.426   7.703   2.846
  263    HG3  GLU 124           HG3      GLU 124  31.104   7.723   4.467
  264    H    GLU 125           H        GLU 125  34.019   5.297   1.196
  265    HA   GLU 125           HA       GLU 125  36.735   6.314   1.350
  266    HB2  GLU 125           HB2      GLU 125  35.576   3.543   0.869
  267    HB3  GLU 125           HB3      GLU 125  37.310   3.876   0.963
  268    HG2  GLU 125           HG2      GLU 125  37.052   4.804   3.223
  269    HG3  GLU 125           HG3      GLU 125  35.325   4.472   3.194
  270    H    GLN 126           H        GLN 126  34.697   5.430  -1.401
  271    HA   GLN 126           HA       GLN 126  37.074   5.639  -3.226
  272    HB2  GLN 126           HB2      GLN 126  34.611   3.891  -3.580
  273    HB3  GLN 126           HB3      GLN 126  36.049   3.926  -4.589
  274    HG2  GLN 126           HG2      GLN 126  37.408   3.160  -2.617
  275    HG3  GLN 126           HG3      GLN 126  35.914   2.964  -1.695
  276   HE21  GLN 126          HE22      GLN 126  37.939   0.893  -2.528
  277   HE22  GLN 126          HE21      GLN 126  36.979  -0.286  -3.410
  278    H    GLY 127           H        GLY 127  34.464   7.476  -2.435
  279    HA2  GLY 127           HA2      GLY 127  33.528   9.293  -3.469
  280    HA3  GLY 127           HA3      GLY 127  34.542   9.003  -4.880
  281    H    LYS 128           H        LYS 128  32.799   6.204  -4.285
  282    HA   LYS 128           HA       LYS 128  31.170   6.332  -6.631
  283    HB2  LYS 128           HB2      LYS 128  31.183   4.477  -4.213
  284    HB3  LYS 128           HB3      LYS 128  30.098   4.248  -5.587
  285    HG2  LYS 128           HG2      LYS 128  31.953   4.040  -7.139
  286    HG3  LYS 128           HG3      LYS 128  33.127   4.414  -5.867
  287    HD2  LYS 128           HD2      LYS 128  32.566   2.373  -4.660
  288    HD3  LYS 128           HD3      LYS 128  31.284   1.982  -5.836
  289    HE2  LYS 128           HE2      LYS 128  32.889   1.737  -7.631
  290    HE3  LYS 128           HE3      LYS 128  34.201   2.384  -6.637
  291    HZ1  LYS 128           HZ1      LYS 128  34.087   0.439  -5.227
  292    HZ2  LYS 128           HZ2      LYS 128  32.798  -0.182  -6.055
  293    HZ3  LYS 128           HZ3      LYS 128  34.261  -0.064  -6.775
  294    H    GLN 129           H        GLN 129  28.871   6.029  -6.762
  295    HA   GLN 129           HA       GLN 129  27.254   7.634  -4.809
  296    HB2  GLN 129           HB2      GLN 129  27.158   7.793  -7.851
  297    HB3  GLN 129           HB3      GLN 129  26.176   8.729  -6.733
  298    HG2  GLN 129           HG2      GLN 129  29.196   8.956  -7.122
  299    HG3  GLN 129           HG3      GLN 129  27.983  10.075  -7.710
  300   HE21  GLN 129          HE22      GLN 129  30.319  10.022  -5.467
  301   HE22  GLN 129          HE21      GLN 129  29.527  10.969  -4.219
  302    H    LEU 130           H        LEU 130  24.761   7.284  -5.434
  303    HA   LEU 130           HA       LEU 130  24.245   4.545  -4.937
  304    HB2  LEU 130           HB2      LEU 130  22.423   6.811  -5.852
  305    HB3  LEU 130           HB3      LEU 130  21.841   5.196  -5.555
  306    HG   LEU 130           HG       LEU 130  21.286   6.448  -3.679
  307   HD11  LEU 130          HD11      LEU 130  22.280   5.250  -1.850
  308   HD12  LEU 130          HD12      LEU 130  22.136   4.142  -3.228
  309   HD13  LEU 130          HD13      LEU 130  23.718   4.845  -2.803
  310   HD21  LEU 130          HD21      LEU 130  22.913   8.298  -3.903
  311   HD22  LEU 130          HD22      LEU 130  22.793   7.673  -2.251
  312   HD23  LEU 130          HD23      LEU 130  24.186   7.244  -3.249
  313    H    GLU 131           H        GLU 131  24.365   6.231  -8.023
  314    HA   GLU 131           HA       GLU 131  23.194   4.168  -9.628
  315    HB2  GLU 131           HB2      GLU 131  24.165   5.274 -11.527
  316    HB3  GLU 131           HB3      GLU 131  23.464   6.455 -10.425
  317    HG2  GLU 131           HG2      GLU 131  25.738   6.976  -9.550
  318    HG3  GLU 131           HG3      GLU 131  26.436   5.806 -10.672
  319    H    ASP 132           H        ASP 132  26.377   4.239  -8.131
  320    HA   ASP 132           HA       ASP 132  27.552   2.237  -9.859
  321    HB2  ASP 132           HB2      ASP 132  28.304   3.191  -7.067
  322    HB3  ASP 132           HB3      ASP 132  29.229   2.033  -8.005
  323    H    PHE 133           H        PHE 133  25.138   2.070  -7.483
  324    HA   PHE 133           HA       PHE 133  25.467  -0.889  -7.118
  325    HB2  PHE 133           HB2      PHE 133  24.121   1.072  -5.225
  326    HB3  PHE 133           HB3      PHE 133  24.441  -0.636  -4.943
  327    HD1  PHE 133           HD1      PHE 133  25.895   2.747  -5.085
  328    HD2  PHE 133           HD2      PHE 133  26.742  -1.420  -4.405
  329    HE1  PHE 133           HE1      PHE 133  28.115   3.356  -4.181
  330    HE2  PHE 133           HE2      PHE 133  28.963  -0.807  -3.464
  331    HZ   PHE 133           HZ       PHE 133  29.664   1.578  -3.379
  332    H    LEU 134           H        LEU 134  23.402   1.645  -8.234
  333    HA   LEU 134           HA       LEU 134  20.828   0.567  -8.098
  334    HB2  LEU 134           HB2      LEU 134  21.559   2.894  -8.732
  335    HB3  LEU 134           HB3      LEU 134  22.223   2.246 -10.234
  336    HG   LEU 134           HG       LEU 134  19.836   1.560 -10.861
  337   HD11  LEU 134          HD11      LEU 134  18.918   1.759  -8.507
  338   HD12  LEU 134          HD12      LEU 134  19.175   3.499  -8.601
  339   HD13  LEU 134          HD13      LEU 134  18.027   2.707  -9.697
  340   HD21  LEU 134          HD21      LEU 134  20.598   4.477 -10.475
  341   HD22  LEU 134          HD22      LEU 134  20.912   3.457 -11.890
  342   HD23  LEU 134          HD23      LEU 134  19.248   3.910 -11.493
  343    H    ILE 135           H        ILE 135  19.632  -0.746  -9.213
  344    HA   ILE 135           HA       ILE 135  20.685  -2.042 -11.712
  345    HB   ILE 135           HB       ILE 135  19.758  -4.151 -11.097
  346   HG12  ILE 135          HG12      ILE 135  18.443  -2.608  -8.912
  347   HG13  ILE 135          HG13      ILE 135  17.809  -3.875  -9.935
  348   HG21  ILE 135          HG21      ILE 135  21.391  -3.113  -8.761
  349   HG22  ILE 135          HG22      ILE 135  21.293  -4.773  -9.392
  350   HG23  ILE 135          HG23      ILE 135  22.042  -3.509 -10.363
  351   HD11  ILE 135          HD11      ILE 135  19.589  -4.168  -7.508
  352   HD12  ILE 135          HD12      ILE 135  17.880  -4.593  -7.638
  353   HD13  ILE 135          HD13      ILE 135  19.082  -5.531  -8.554
  354    H    LYS 136           H        LYS 136  18.099  -0.090 -10.664
  355    HA   LYS 136           HA       LYS 136  16.675  -0.727 -13.213
  356    HB2  LYS 136           HB2      LYS 136  15.328  -0.375 -10.500
  357    HB3  LYS 136           HB3      LYS 136  14.493  -0.311 -12.062
  358    HG2  LYS 136           HG2      LYS 136  15.264  -2.628 -12.549
  359    HG3  LYS 136           HG3      LYS 136  15.999  -2.700 -10.935
  360    HD2  LYS 136           HD2      LYS 136  13.777  -2.248  -9.908
  361    HD3  LYS 136           HD3      LYS 136  13.028  -2.266 -11.511
  362    HE2  LYS 136           HE2      LYS 136  14.548  -4.600 -10.244
  363    HE3  LYS 136           HE3      LYS 136  12.801  -4.397 -10.182
  364    HZ1  LYS 136           HZ1      LYS 136  12.744  -4.528 -12.625
  365    HZ2  LYS 136           HZ2      LYS 136  14.365  -4.764 -12.695
  366    HZ3  LYS 136           HZ3      LYS 136  13.402  -5.878 -11.999
  367    H    GLU 137           H        GLU 137  15.832   1.663 -10.717
  368    HA   GLU 137           HA       GLU 137  16.938   3.913 -12.215
  369    HB2  GLU 137           HB2      GLU 137  14.885   3.340 -13.529
  370    HB3  GLU 137           HB3      GLU 137  13.915   3.517 -12.071
  371    HG2  GLU 137           HG2      GLU 137  13.738   5.477 -13.533
  372    HG3  GLU 137           HG3      GLU 137  14.424   5.912 -11.984
  373    H    LEU 138           H        LEU 138  16.894   5.860 -11.034
  374    HA   LEU 138           HA       LEU 138  16.752   5.559  -8.116
  375    HB2  LEU 138           HB2      LEU 138  17.376   7.923  -9.940
  376    HB3  LEU 138           HB3      LEU 138  17.513   7.967  -8.186
  377    HG   LEU 138           HG       LEU 138  19.111   6.069  -9.934
  378   HD11  LEU 138          HD11      LEU 138  21.006   7.600  -9.620
  379   HD12  LEU 138          HD12      LEU 138  19.681   8.386 -10.490
  380   HD13  LEU 138          HD13      LEU 138  19.945   8.755  -8.771
  381   HD21  LEU 138          HD21      LEU 138  20.562   5.815  -7.985
  382   HD22  LEU 138          HD22      LEU 138  19.603   6.997  -7.067
  383   HD23  LEU 138          HD23      LEU 138  18.898   5.436  -7.498
  384    H    GLU 139           H        GLU 139  15.369   6.559  -6.715
  385    HA   GLU 139           HA       GLU 139  13.180   8.325  -7.627
  386    HB2  GLU 139           HB2      GLU 139  12.708   5.671  -6.218
  387    HB3  GLU 139           HB3      GLU 139  11.535   6.982  -6.279
  388    HG2  GLU 139           HG2      GLU 139  11.502   6.872  -8.759
  389    HG3  GLU 139           HG3      GLU 139  12.633   5.514  -8.708
  Start of MODEL    5
    1    H1   ALA  91           H1       ALA  91   6.617  -9.534   5.198
    2    H2   ALA  91           H2       ALA  91   7.846  -8.491   5.478
    3    H3   ALA  91           H3       ALA  91   6.299  -7.960   5.520
    4    HA   ALA  91           HA       ALA  91   7.701  -8.980   3.132
    5    HB1  ALA  91           HB1      ALA  91   5.278  -9.509   3.076
    6    HB2  ALA  91           HB2      ALA  91   4.890  -7.789   3.325
    7    HB3  ALA  91           HB3      ALA  91   5.710  -8.320   1.843
    8    H    ALA  92           H        ALA  92   8.088  -7.355   1.440
    9    HA   ALA  92           HA       ALA  92   8.120  -4.508   2.214
   10    HB1  ALA  92           HB1      ALA  92  10.566  -4.333   1.823
   11    HB2  ALA  92           HB2      ALA  92  10.217  -5.423   3.177
   12    HB3  ALA  92           HB3      ALA  92  10.657  -6.089   1.586
   13    H    ARG  93           H        ARG  93   9.005  -3.155   0.386
   14    HA   ARG  93           HA       ARG  93   7.765  -3.814  -2.152
   15    HB2  ARG  93           HB2      ARG  93   9.756  -1.616  -1.378
   16    HB3  ARG  93           HB3      ARG  93   8.880  -1.668  -2.902
   17    HG2  ARG  93           HG2      ARG  93   7.621  -1.333  -0.144
   18    HG3  ARG  93           HG3      ARG  93   7.877  -0.076  -1.356
   19    HD2  ARG  93           HD2      ARG  93   6.361  -1.280  -2.920
   20    HD3  ARG  93           HD3      ARG  93   6.043  -2.487  -1.646
   21    HE   ARG  93           HE       ARG  93   5.526   0.069  -0.551
   22   HH11  ARG  93          HH11      ARG  93   4.094  -1.981  -3.010
   23   HH12  ARG  93          HH12      ARG  93   2.510  -1.291  -2.794
   24   HH21  ARG  93          HH21      ARG  93   3.473   0.900  -0.323
   25   HH22  ARG  93          HH22      ARG  93   2.172   0.297  -1.308
   26    HA   PRO  94           HA       PRO  94  11.028  -5.803  -4.487
   27    HB2  PRO  94           HB2      PRO  94  10.568  -3.641  -6.544
   28    HB3  PRO  94           HB3      PRO  94  10.711  -5.412  -6.786
   29    HG2  PRO  94           HG2      PRO  94   8.271  -4.243  -6.796
   30    HG3  PRO  94           HG3      PRO  94   8.519  -5.784  -5.908
   31    HD2  PRO  94           HD2      PRO  94   8.438  -2.969  -4.803
   32    HD3  PRO  94           HD3      PRO  94   7.657  -4.455  -4.180
   33    H    ALA  95           H        ALA  95  13.240  -5.599  -4.994
   34    HA   ALA  95           HA       ALA  95  14.701  -3.381  -3.843
   35    HB1  ALA  95           HB1      ALA  95  15.519  -5.705  -3.758
   36    HB2  ALA  95           HB2      ALA  95  15.627  -5.743  -5.536
   37    HB3  ALA  95           HB3      ALA  95  16.674  -4.654  -4.599
   38    H    LYS  96           H        LYS  96  16.318  -2.163  -4.928
   39    HA   LYS  96           HA       LYS  96  16.236  -1.896  -7.861
   40    HB2  LYS  96           HB2      LYS  96  14.764  -0.138  -7.062
   41    HB3  LYS  96           HB3      LYS  96  15.977   0.449  -5.922
   42    HG2  LYS  96           HG2      LYS  96  17.437   1.136  -7.741
   43    HG3  LYS  96           HG3      LYS  96  16.365   0.425  -8.946
   44    HD2  LYS  96           HD2      LYS  96  15.833   2.870  -7.211
   45    HD3  LYS  96           HD3      LYS  96  16.216   2.834  -8.938
   46    HE2  LYS  96           HE2      LYS  96  14.070   1.390  -9.212
   47    HE3  LYS  96           HE3      LYS  96  13.667   1.874  -7.554
   48    HZ1  LYS  96           HZ1      LYS  96  12.653   3.415  -9.101
   49    HZ2  LYS  96           HZ2      LYS  96  13.865   4.242  -8.381
   50    HZ3  LYS  96           HZ3      LYS  96  14.048   3.658  -9.915
   51    H    TYR  97           H        TYR  97  18.109  -2.046  -4.993
   52    HA   TYR  97           HA       TYR  97  20.586  -1.363  -6.519
   53    HB2  TYR  97           HB2      TYR  97  20.145  -0.898  -3.558
   54    HB3  TYR  97           HB3      TYR  97  21.479  -0.330  -4.540
   55    HD1  TYR  97           HD2      TYR  97  17.897   0.139  -3.683
   56    HD2  TYR  97           HD1      TYR  97  21.271   1.755  -5.815
   57    HE1  TYR  97           HE2      TYR  97  16.624   2.229  -4.123
   58    HE2  TYR  97           HE1      TYR  97  19.984   3.847  -6.244
   59    HH   TYR  97           HH       TYR  97  18.000   4.996  -5.918
   60    H    SER  98           H        SER  98  22.499  -2.529  -5.914
   61    HA   SER  98           HA       SER  98  22.214  -4.962  -4.214
   62    HB2  SER  98           HB2      SER  98  21.571  -5.561  -6.556
   63    HB3  SER  98           HB3      SER  98  23.171  -5.003  -7.095
   64    HG   SER  98           HG       SER  98  23.077  -7.299  -6.701
   65    H    TYR  99           H        TYR  99  24.153  -5.778  -3.430
   66    HA   TYR  99           HA       TYR  99  26.706  -4.525  -4.203
   67    HB2  TYR  99           HB2      TYR  99  27.269  -3.704  -2.032
   68    HB3  TYR  99           HB3      TYR  99  25.759  -2.993  -2.521
   69    HD1  TYR  99           HD1      TYR  99  23.585  -3.793  -1.472
   70    HD2  TYR  99           HD2      TYR  99  27.448  -5.076  -0.052
   71    HE1  TYR  99           HE1      TYR  99  22.595  -4.335   0.758
   72    HE2  TYR  99           HE2      TYR  99  26.461  -5.647   2.152
   73    HH   TYR  99           HH       TYR  99  24.568  -5.579   3.482
   74    H    VAL 100           H        VAL 100  28.537  -5.404  -2.745
   75    HA   VAL 100           HA       VAL 100  28.373  -8.377  -2.744
   76    HB   VAL 100           HB       VAL 100  30.662  -8.261  -3.587
   77   HG11  VAL 100          HG11      VAL 100  30.199  -7.607  -5.847
   78   HG12  VAL 100          HG12      VAL 100  28.735  -8.308  -5.148
   79   HG13  VAL 100          HG13      VAL 100  28.858  -6.555  -5.331
   80   HG21  VAL 100          HG21      VAL 100  30.355  -5.249  -3.822
   81   HG22  VAL 100          HG22      VAL 100  31.406  -6.094  -2.658
   82   HG23  VAL 100          HG23      VAL 100  31.705  -6.239  -4.395
   83    H    ASP 101           H        ASP 101  30.386  -9.353  -1.662
   84    HA   ASP 101           HA       ASP 101  31.380  -7.782   0.666
   85    HB2  ASP 101           HB2      ASP 101  29.538  -9.090   1.560
   86    HB3  ASP 101           HB3      ASP 101  30.203 -10.573   0.875
   87    H    GLU 102           H        GLU 102  31.820 -10.988  -1.038
   88    HA   GLU 102           HA       GLU 102  34.641 -10.254  -1.497
   89    HB2  GLU 102           HB2      GLU 102  34.679 -11.345   0.700
   90    HB3  GLU 102           HB3      GLU 102  33.764 -12.724   0.075
   91    HG2  GLU 102           HG2      GLU 102  35.577 -13.315  -1.420
   92    HG3  GLU 102           HG3      GLU 102  36.473 -11.851  -0.988
   93    H    ASN 103           H        ASN 103  32.523 -13.187  -1.768
   94    HA   ASN 103           HA       ASN 103  33.888 -14.025  -4.125
   95    HB2  ASN 103           HB2      ASN 103  32.899 -15.486  -2.353
   96    HB3  ASN 103           HB3      ASN 103  31.282 -15.025  -2.897
   97   HD21  ASN 103          HD22      ASN 103  30.415 -16.747  -4.018
   98   HD22  ASN 103          HD21      ASN 103  31.324 -17.735  -5.155
   99    H    GLY 104           H        GLY 104  31.130 -11.940  -3.801
  100    HA2  GLY 104           HA2      GLY 104  30.699 -11.185  -6.424
  101    HA3  GLY 104           HA3      GLY 104  29.765 -12.677  -6.259
  102    H    GLU 105           H        GLU 105  27.952 -11.189  -6.742
  103    HA   GLU 105           HA       GLU 105  26.879  -9.226  -5.030
  104    HB2  GLU 105           HB2      GLU 105  24.719  -9.789  -5.917
  105    HB3  GLU 105           HB3      GLU 105  25.945  -9.661  -7.178
  106    HG2  GLU 105           HG2      GLU 105  26.084 -12.179  -7.232
  107    HG3  GLU 105           HG3      GLU 105  24.753 -12.240  -6.071
  108    H    THR 106           H        THR 106  26.048  -9.158  -3.061
  109    HA   THR 106           HA       THR 106  25.763 -11.711  -1.635
  110    HB   THR 106           HB       THR 106  27.770 -10.249  -1.096
  111    HG1  THR 106           HG1      THR 106  27.258 -11.969   0.199
  112   HG21  THR 106          HG21      THR 106  27.544  -8.599   0.642
  113   HG22  THR 106          HG22      THR 106  26.540  -8.070  -0.703
  114   HG23  THR 106          HG23      THR 106  25.794  -8.816   0.728
  115    H    LYS 107           H        LYS 107  24.455  -8.387  -1.792
  116    HA   LYS 107           HA       LYS 107  21.821  -9.292  -0.789
  117    HB2  LYS 107           HB2      LYS 107  23.696  -7.440   0.737
  118    HB3  LYS 107           HB3      LYS 107  21.950  -7.284   0.910
  119    HG2  LYS 107           HG2      LYS 107  21.819  -9.681   1.602
  120    HG3  LYS 107           HG3      LYS 107  23.595  -9.752   1.576
  121    HD2  LYS 107           HD2      LYS 107  23.744  -8.031   3.307
  122    HD3  LYS 107           HD3      LYS 107  21.991  -7.793   3.266
  123    HE2  LYS 107           HE2      LYS 107  22.479  -9.113   5.192
  124    HE3  LYS 107           HE3      LYS 107  21.655 -10.146   4.023
  125    HZ1  LYS 107           HZ1      LYS 107  24.602 -10.107   4.490
  126    HZ2  LYS 107           HZ2      LYS 107  23.582 -11.249   5.047
  127    HZ3  LYS 107           HZ3      LYS 107  23.831 -11.110   3.445
  128    H    THR 108           H        THR 108  20.214  -7.605  -0.841
  129    HA   THR 108           HA       THR 108  20.704  -5.419  -2.809
  130    HB   THR 108           HB       THR 108  18.476  -5.907  -3.780
  131    HG1  THR 108           HG1      THR 108  17.551  -7.966  -3.274
  132   HG21  THR 108          HG21      THR 108  20.516  -6.861  -4.834
  133   HG22  THR 108          HG22      THR 108  20.293  -8.348  -3.884
  134   HG23  THR 108          HG23      THR 108  19.077  -7.855  -5.088
  135    H    TRP 109           H        TRP 109  18.949  -3.797  -2.882
  136    HA   TRP 109           HA       TRP 109  17.560  -3.320  -0.304
  137    HB2  TRP 109           HB2      TRP 109  19.826  -2.491   0.027
  138    HB3  TRP 109           HB3      TRP 109  19.753  -1.549  -1.452
  139    HD1  TRP 109           HD1      TRP 109  17.470  -1.715   1.699
  140    HE1  TRP 109           HE1      TRP 109  17.023   0.679   2.526
  141    HE3  TRP 109           HE3      TRP 109  20.311   0.910  -1.695
  142    HZ2  TRP 109           HZ2      TRP 109  17.918   3.327   1.945
  143    HZ3  TRP 109           HZ3      TRP 109  20.548   3.369  -1.460
  144    HH2  TRP 109           HH2      TRP 109  19.373   4.588   0.349
  145    H    THR 110           H        THR 110  16.105  -1.516  -0.343
  146    HA   THR 110           HA       THR 110  14.638  -1.333  -2.907
  147    HB   THR 110           HB       THR 110  12.788  -0.642  -1.377
  148    HG1  THR 110           HG1      THR 110  13.303  -0.810   0.893
  149   HG21  THR 110          HG21      THR 110  14.202  -3.096  -0.242
  150   HG22  THR 110          HG22      THR 110  12.464  -2.725  -0.215
  151   HG23  THR 110          HG23      THR 110  13.266  -3.108  -1.749
  152    H    GLY 111           H        GLY 111  16.589   0.740  -0.940
  153    HA2  GLY 111           HA2      GLY 111  17.069   3.031  -1.341
  154    HA3  GLY 111           HA3      GLY 111  15.601   3.208  -2.288
  155    H    GLN 112           H        GLN 112  15.084   1.534   0.706
  156    HA   GLN 112           HA       GLN 112  13.943   4.010   1.954
  157    HB2  GLN 112           HB2      GLN 112  12.840   1.178   2.018
  158    HB3  GLN 112           HB3      GLN 112  12.125   2.603   2.773
  159    HG2  GLN 112           HG2      GLN 112  11.860   3.642   0.507
  160    HG3  GLN 112           HG3      GLN 112  12.453   2.147  -0.224
  161   HE21  GLN 112          HE22      GLN 112   9.614   3.757   0.843
  162   HE22  GLN 112          HE21      GLN 112   8.564   2.349   0.824
  163    H    GLY 113           H        GLY 113  13.668   3.960   4.296
  164    HA2  GLY 113           HA2      GLY 113  14.398   3.565   6.477
  165    HA3  GLY 113           HA3      GLY 113  15.254   2.115   5.934
  166    H    ARG 114           H        ARG 114  17.439   2.243   5.628
  167    HA   ARG 114           HA       ARG 114  18.798   4.830   5.156
  168    HB2  ARG 114           HB2      ARG 114  19.539   2.953   7.461
  169    HB3  ARG 114           HB3      ARG 114  20.649   4.111   6.752
  170    HG2  ARG 114           HG2      ARG 114  19.938   5.337   8.512
  171    HG3  ARG 114           HG3      ARG 114  18.825   5.911   7.275
  172    HD2  ARG 114           HD2      ARG 114  17.103   4.265   8.202
  173    HD3  ARG 114           HD3      ARG 114  18.283   3.803   9.414
  174    HE   ARG 114           HE       ARG 114  17.844   5.725  10.604
  175   HH11  ARG 114          HH11      ARG 114  16.421   6.255   7.409
  176   HH12  ARG 114          HH12      ARG 114  15.620   7.705   7.940
  177   HH21  ARG 114          HH21      ARG 114  16.791   7.577  11.169
  178   HH22  ARG 114          HH22      ARG 114  15.825   8.432  10.004
  179    H    THR 115           H        THR 115  20.779   4.650   4.099
  180    HA   THR 115           HA       THR 115  21.057   2.653   2.172
  181    HB   THR 115           HB       THR 115  23.282   4.412   3.257
  182    HG1  THR 115           HG1      THR 115  22.510   5.926   1.759
  183   HG21  THR 115          HG21      THR 115  22.781   3.221   0.489
  184   HG22  THR 115          HG22      THR 115  24.066   4.383   0.890
  185   HG23  THR 115          HG23      THR 115  24.094   2.772   1.609
  186    HA   PRO 116           HA       PRO 116  22.957  -0.816   4.383
  187    HB2  PRO 116           HB2      PRO 116  24.143  -1.282   1.635
  188    HB3  PRO 116           HB3      PRO 116  23.441  -2.470   2.781
  189    HG2  PRO 116           HG2      PRO 116  21.980  -1.561   0.693
  190    HG3  PRO 116           HG3      PRO 116  21.224  -1.735   2.309
  191    HD2  PRO 116           HD2      PRO 116  22.207   0.780   0.960
  192    HD3  PRO 116           HD3      PRO 116  20.753   0.510   1.972
  193    H    ALA 117           H        ALA 117  24.901  -1.231   5.391
  194    HA   ALA 117           HA       ALA 117  26.685   0.861   5.704
  195    HB1  ALA 117           HB1      ALA 117  28.025  -0.731   7.027
  196    HB2  ALA 117           HB2      ALA 117  26.292  -0.918   7.349
  197    HB3  ALA 117           HB3      ALA 117  27.128  -2.095   6.316
  198    H    VAL 118           H        VAL 118  27.291  -2.057   3.664
  199    HA   VAL 118           HA       VAL 118  29.940  -1.312   2.914
  200    HB   VAL 118           HB       VAL 118  27.954  -3.008   1.358
  201   HG11  VAL 118          HG11      VAL 118  30.992  -2.819   1.141
  202   HG12  VAL 118          HG12      VAL 118  29.989  -4.049   0.350
  203   HG13  VAL 118          HG13      VAL 118  29.814  -2.360  -0.110
  204   HG21  VAL 118          HG21      VAL 118  29.161  -4.931   2.380
  205   HG22  VAL 118          HG22      VAL 118  30.119  -3.801   3.358
  206   HG23  VAL 118          HG23      VAL 118  28.367  -3.946   3.609
  207    H    ILE 119           H        ILE 119  26.812  -0.594   1.329
  208    HA   ILE 119           HA       ILE 119  27.889   0.802  -0.950
  209    HB   ILE 119           HB       ILE 119  25.179   1.008   0.437
  210   HG12  ILE 119          HG12      ILE 119  26.138  -0.479  -2.049
  211   HG13  ILE 119          HG13      ILE 119  25.641  -1.203  -0.524
  212   HG21  ILE 119          HG21      ILE 119  26.006   2.141  -2.267
  213   HG22  ILE 119          HG22      ILE 119  24.373   2.168  -1.562
  214   HG23  ILE 119          HG23      ILE 119  25.645   3.104  -0.820
  215   HD11  ILE 119          HD11      ILE 119  23.844  -1.494  -2.079
  216   HD12  ILE 119          HD12      ILE 119  23.316  -0.277  -0.900
  217   HD13  ILE 119          HD13      ILE 119  23.843   0.213  -2.528
  218    H    LYS 120           H        LYS 120  26.739   1.990   2.243
  219    HA   LYS 120           HA       LYS 120  27.369   4.758   1.892
  220    HB2  LYS 120           HB2      LYS 120  26.004   4.189   3.721
  221    HB3  LYS 120           HB3      LYS 120  27.079   2.912   4.285
  222    HG2  LYS 120           HG2      LYS 120  28.696   4.465   5.132
  223    HG3  LYS 120           HG3      LYS 120  27.884   5.841   4.347
  224    HD2  LYS 120           HD2      LYS 120  25.992   5.674   5.849
  225    HD3  LYS 120           HD3      LYS 120  26.539   4.118   6.470
  226    HE2  LYS 120           HE2      LYS 120  26.958   5.897   8.089
  227    HE3  LYS 120           HE3      LYS 120  28.455   5.127   7.574
  228    HZ1  LYS 120           HZ1      LYS 120  28.983   7.023   6.210
  229    HZ2  LYS 120           HZ2      LYS 120  27.497   7.716   6.444
  230    HZ3  LYS 120           HZ3      LYS 120  28.565   7.597   7.672
  231    H    LYS 121           H        LYS 121  29.392   2.125   3.227
  232    HA   LYS 121           HA       LYS 121  31.578   3.854   3.755
  233    HB2  LYS 121           HB2      LYS 121  31.076   1.496   4.751
  234    HB3  LYS 121           HB3      LYS 121  31.929   0.876   3.339
  235    HG2  LYS 121           HG2      LYS 121  33.537   1.031   5.103
  236    HG3  LYS 121           HG3      LYS 121  33.885   2.385   4.024
  237    HD2  LYS 121           HD2      LYS 121  32.424   3.823   5.633
  238    HD3  LYS 121           HD3      LYS 121  32.469   2.446   6.734
  239    HE2  LYS 121           HE2      LYS 121  34.894   2.591   6.911
  240    HE3  LYS 121           HE3      LYS 121  34.975   3.735   5.567
  241    HZ1  LYS 121           HZ1      LYS 121  33.702   5.335   6.936
  242    HZ2  LYS 121           HZ2      LYS 121  33.784   4.316   8.227
  243    HZ3  LYS 121           HZ3      LYS 121  35.156   4.955   7.598
  244    H    ALA 122           H        ALA 122  30.959   1.809   0.910
  245    HA   ALA 122           HA       ALA 122  33.359   2.454  -0.481
  246    HB1  ALA 122           HB1      ALA 122  32.092   1.706  -2.473
  247    HB2  ALA 122           HB2      ALA 122  31.864   0.607  -1.104
  248    HB3  ALA 122           HB3      ALA 122  30.582   1.759  -1.530
  249    H    MET 123           H        MET 123  30.164   4.131  -0.464
  250    HA   MET 123           HA       MET 123  30.844   6.176  -2.325
  251    HB2  MET 123           HB2      MET 123  28.824   6.080  -0.068
  252    HB3  MET 123           HB3      MET 123  28.991   7.459  -1.157
  253    HG2  MET 123           HG2      MET 123  28.487   6.084  -3.094
  254    HG3  MET 123           HG3      MET 123  28.495   4.618  -2.131
  255    HE1  MET 123           HE1      MET 123  26.648   7.997  -2.897
  256    HE2  MET 123           HE2      MET 123  25.161   7.857  -1.932
  257    HE3  MET 123           HE3      MET 123  26.721   8.110  -1.124
  258    H    GLU 124           H        GLU 124  31.159   6.277   1.300
  259    HA   GLU 124           HA       GLU 124  32.318   8.907   1.156
  260    HB2  GLU 124           HB2      GLU 124  32.536   8.839   3.513
  261    HB3  GLU 124           HB3      GLU 124  30.980   8.151   3.048
  262    HG2  GLU 124           HG2      GLU 124  32.000   5.866   3.331
  263    HG3  GLU 124           HG3      GLU 124  33.475   6.633   3.916
  264    H    GLU 125           H        GLU 125  33.859   5.671   1.323
  265    HA   GLU 125           HA       GLU 125  36.505   6.844   1.821
  266    HB2  GLU 125           HB2      GLU 125  35.611   4.002   1.203
  267    HB3  GLU 125           HB3      GLU 125  37.273   4.452   1.518
  268    HG2  GLU 125           HG2      GLU 125  34.967   4.784   3.479
  269    HG3  GLU 125           HG3      GLU 125  36.181   3.513   3.504
  270    H    GLN 126           H        GLN 126  34.775   5.797  -1.097
  271    HA   GLN 126           HA       GLN 126  37.298   6.140  -2.690
  272    HB2  GLN 126           HB2      GLN 126  34.862   4.466  -3.382
  273    HB3  GLN 126           HB3      GLN 126  36.399   4.542  -4.240
  274    HG2  GLN 126           HG2      GLN 126  37.559   3.582  -2.252
  275    HG3  GLN 126           HG3      GLN 126  36.001   3.425  -1.433
  276   HE21  GLN 126          HE21      GLN 126  37.283   1.088  -1.589
  277   HE22  GLN 126          HE22      GLN 126  36.631   0.096  -2.882
  278    H    GLY 127           H        GLY 127  34.563   7.905  -2.056
  279    HA2  GLY 127           HA2      GLY 127  33.576   9.686  -3.111
  280    HA3  GLY 127           HA3      GLY 127  34.796   9.579  -4.383
  281    H    LYS 128           H        LYS 128  32.947   6.701  -3.850
  282    HA   LYS 128           HA       LYS 128  31.705   6.731  -6.477
  283    HB2  LYS 128           HB2      LYS 128  31.593   4.902  -4.047
  284    HB3  LYS 128           HB3      LYS 128  30.434   4.689  -5.351
  285    HG2  LYS 128           HG2      LYS 128  32.231   4.448  -6.996
  286    HG3  LYS 128           HG3      LYS 128  33.455   4.670  -5.725
  287    HD2  LYS 128           HD2      LYS 128  32.811   2.605  -4.633
  288    HD3  LYS 128           HD3      LYS 128  31.333   2.491  -5.596
  289    HE2  LYS 128           HE2      LYS 128  32.857   0.879  -6.454
  290    HE3  LYS 128           HE3      LYS 128  32.633   2.147  -7.656
  291    HZ1  LYS 128           HZ1      LYS 128  34.978   1.957  -5.803
  292    HZ2  LYS 128           HZ2      LYS 128  34.992   1.489  -7.369
  293    HZ3  LYS 128           HZ3      LYS 128  34.804   3.065  -7.003
  294    H    GLN 129           H        GLN 129  29.392   6.257  -6.783
  295    HA   GLN 129           HA       GLN 129  27.575   7.876  -5.063
  296    HB2  GLN 129           HB2      GLN 129  28.290   9.175  -7.044
  297    HB3  GLN 129           HB3      GLN 129  27.772   7.870  -8.107
  298    HG2  GLN 129           HG2      GLN 129  26.195   9.748  -8.102
  299    HG3  GLN 129           HG3      GLN 129  25.423   8.283  -7.533
  300   HE21  GLN 129          HE22      GLN 129  26.261  11.589  -6.688
  301   HE22  GLN 129          HE21      GLN 129  25.573  11.520  -5.073
  302    H    LEU 130           H        LEU 130  25.324   7.184  -5.183
  303    HA   LEU 130           HA       LEU 130  25.102   4.426  -4.738
  304    HB2  LEU 130           HB2      LEU 130  23.741   6.206  -3.713
  305    HB3  LEU 130           HB3      LEU 130  22.980   6.533  -5.278
  306    HG   LEU 130           HG       LEU 130  21.935   4.312  -5.255
  307   HD11  LEU 130          HD11      LEU 130  23.571   3.036  -3.895
  308   HD12  LEU 130          HD12      LEU 130  23.127   4.000  -2.469
  309   HD13  LEU 130          HD13      LEU 130  21.945   2.912  -3.231
  310   HD21  LEU 130          HD21      LEU 130  20.763   6.250  -4.258
  311   HD22  LEU 130          HD22      LEU 130  20.320   4.735  -3.459
  312   HD23  LEU 130          HD23      LEU 130  21.457   5.852  -2.670
  313    H    GLU 131           H        GLU 131  24.586   6.163  -7.722
  314    HA   GLU 131           HA       GLU 131  23.149   4.162  -9.205
  315    HB2  GLU 131           HB2      GLU 131  25.100   6.307 -10.123
  316    HB3  GLU 131           HB3      GLU 131  24.118   5.320 -11.209
  317    HG2  GLU 131           HG2      GLU 131  22.051   6.157 -10.153
  318    HG3  GLU 131           HG3      GLU 131  23.000   7.175  -9.066
  319    H    ASP 132           H        ASP 132  26.532   4.145  -8.187
  320    HA   ASP 132           HA       ASP 132  27.390   2.166 -10.094
  321    HB2  ASP 132           HB2      ASP 132  28.888   3.640  -8.671
  322    HB3  ASP 132           HB3      ASP 132  28.492   2.595  -7.305
  323    H    PHE 133           H        PHE 133  25.265   2.019  -7.437
  324    HA   PHE 133           HA       PHE 133  25.404  -0.960  -7.199
  325    HB2  PHE 133           HB2      PHE 133  24.433   1.089  -5.172
  326    HB3  PHE 133           HB3      PHE 133  24.538  -0.642  -4.935
  327    HD1  PHE 133           HD1      PHE 133  26.761  -1.779  -4.724
  328    HD2  PHE 133           HD2      PHE 133  26.427   2.509  -5.031
  329    HE1  PHE 133           HE1      PHE 133  29.090  -1.531  -3.893
  330    HE2  PHE 133           HE2      PHE 133  28.755   2.749  -4.213
  331    HZ   PHE 133           HZ       PHE 133  30.094   0.726  -3.662
  332    H    LEU 134           H        LEU 134  23.362   1.770  -7.954
  333    HA   LEU 134           HA       LEU 134  20.776   0.505  -7.886
  334    HB2  LEU 134           HB2      LEU 134  21.459   2.994  -8.065
  335    HB3  LEU 134           HB3      LEU 134  21.742   2.680  -9.766
  336    HG   LEU 134           HG       LEU 134  19.096   2.476  -8.300
  337   HD11  LEU 134          HD11      LEU 134  18.486   4.447  -9.607
  338   HD12  LEU 134          HD12      LEU 134  19.953   4.777  -8.681
  339   HD13  LEU 134          HD13      LEU 134  20.064   4.429 -10.421
  340   HD21  LEU 134          HD21      LEU 134  18.907   0.880 -10.068
  341   HD22  LEU 134          HD22      LEU 134  18.104   2.343 -10.637
  342   HD23  LEU 134          HD23      LEU 134  19.734   1.960 -11.232
  343    H    ILE 135           H        ILE 135  20.138  -1.164  -9.077
  344    HA   ILE 135           HA       ILE 135  21.436  -1.712 -11.726
  345    HB   ILE 135           HB       ILE 135  21.217  -4.160 -11.181
  346   HG12  ILE 135          HG12      ILE 135  21.408  -4.834  -8.843
  347   HG13  ILE 135          HG13      ILE 135  21.034  -3.207  -8.284
  348   HG21  ILE 135          HG21      ILE 135  23.365  -4.173 -10.018
  349   HG22  ILE 135          HG22      ILE 135  23.331  -2.905 -11.248
  350   HG23  ILE 135          HG23      ILE 135  23.153  -2.481  -9.537
  351   HD11  ILE 135          HD11      ILE 135  19.149  -4.842  -8.136
  352   HD12  ILE 135          HD12      ILE 135  18.743  -3.427  -9.112
  353   HD13  ILE 135          HD13      ILE 135  19.148  -4.972  -9.906
  354    H    LYS 136           H        LYS 136  18.255  -1.484 -10.295
  355    HA   LYS 136           HA       LYS 136  16.978  -3.210 -12.202
  356    HB2  LYS 136           HB2      LYS 136  15.992  -2.489 -10.048
  357    HB3  LYS 136           HB3      LYS 136  15.757  -0.858 -10.707
  358    HG2  LYS 136           HG2      LYS 136  14.213  -1.731 -12.395
  359    HG3  LYS 136           HG3      LYS 136  14.550  -3.398 -11.889
  360    HD2  LYS 136           HD2      LYS 136  13.540  -2.926  -9.680
  361    HD3  LYS 136           HD3      LYS 136  13.237  -1.243 -10.172
  362    HE2  LYS 136           HE2      LYS 136  11.840  -2.072 -12.077
  363    HE3  LYS 136           HE3      LYS 136  12.127  -3.738 -11.560
  364    HZ1  LYS 136           HZ1      LYS 136  10.977  -3.212  -9.459
  365    HZ2  LYS 136           HZ2      LYS 136  10.701  -1.664  -9.952
  366    HZ3  LYS 136           HZ3      LYS 136   9.994  -2.914 -10.728
  367    H    GLU 137           H        GLU 137  17.927   0.148 -12.509
  368    HA   GLU 137           HA       GLU 137  16.504   0.354 -15.150
  369    HB2  GLU 137           HB2      GLU 137  17.167   2.522 -13.116
  370    HB3  GLU 137           HB3      GLU 137  16.331   2.762 -14.657
  371    HG2  GLU 137           HG2      GLU 137  14.523   1.198 -13.876
  372    HG3  GLU 137           HG3      GLU 137  15.310   1.139 -12.297
  373    H    LEU 138           H        LEU 138  19.548  -0.264 -14.292
  374    HA   LEU 138           HA       LEU 138  20.803   1.533 -16.318
  375    HB2  LEU 138           HB2      LEU 138  21.837   0.915 -13.522
  376    HB3  LEU 138           HB3      LEU 138  22.738   1.804 -14.747
  377    HG   LEU 138           HG       LEU 138  20.116   2.756 -13.521
  378   HD11  LEU 138          HD11      LEU 138  22.025   2.707 -11.939
  379   HD12  LEU 138          HD12      LEU 138  22.970   3.705 -13.050
  380   HD13  LEU 138          HD13      LEU 138  21.493   4.358 -12.305
  381   HD21  LEU 138          HD21      LEU 138  20.703   4.929 -14.536
  382   HD22  LEU 138          HD22      LEU 138  22.109   4.187 -15.336
  383   HD23  LEU 138          HD23      LEU 138  20.461   3.700 -15.783
  384    H    GLU 139           H        GLU 139  19.947  -1.252 -16.450
  385    HA   GLU 139           HA       GLU 139  22.410  -2.392 -17.624
  386    HB2  GLU 139           HB2      GLU 139  20.629  -3.970 -15.721
  387    HB3  GLU 139           HB3      GLU 139  21.856  -4.654 -16.787
  388    HG2  GLU 139           HG2      GLU 139  23.560  -3.155 -15.601
  389    HG3  GLU 139           HG3      GLU 139  22.312  -2.843 -14.386
  Start of MODEL    6
    1    H1   ALA  91           H1       ALA  91   5.444  -8.944  -8.113
    2    H2   ALA  91           H2       ALA  91   7.052  -8.642  -8.139
    3    H3   ALA  91           H3       ALA  91   6.484  -9.998  -7.420
    4    HA   ALA  91           HA       ALA  91   5.349  -8.725  -5.726
    5    HB1  ALA  91           HB1      ALA  91   7.646  -9.525  -5.247
    6    HB2  ALA  91           HB2      ALA  91   8.328  -8.032  -5.928
    7    HB3  ALA  91           HB3      ALA  91   7.328  -7.976  -4.459
    8    H    ALA  92           H        ALA  92   4.685  -6.736  -4.846
    9    HA   ALA  92           HA       ALA  92   4.308  -4.606  -6.752
   10    HB1  ALA  92           HB1      ALA  92   2.616  -5.337  -5.116
   11    HB2  ALA  92           HB2      ALA  92   3.656  -4.791  -3.780
   12    HB3  ALA  92           HB3      ALA  92   2.984  -3.615  -4.938
   13    H    ARG  93           H        ARG  93   6.732  -5.087  -4.287
   14    HA   ARG  93           HA       ARG  93   7.821  -2.312  -4.641
   15    HB2  ARG  93           HB2      ARG  93   7.401  -3.772  -2.002
   16    HB3  ARG  93           HB3      ARG  93   8.288  -2.255  -2.213
   17    HG2  ARG  93           HG2      ARG  93   6.203  -1.180  -3.089
   18    HG3  ARG  93           HG3      ARG  93   5.321  -2.676  -2.746
   19    HD2  ARG  93           HD2      ARG  93   5.945  -2.511  -0.357
   20    HD3  ARG  93           HD3      ARG  93   6.800  -1.000  -0.667
   21    HE   ARG  93           HE       ARG  93   3.889  -1.450  -0.537
   22   HH11  ARG  93          HH21      ARG  93   6.328   0.891  -1.497
   23   HH12  ARG  93          HH22      ARG  93   5.193   2.214  -1.458
   24   HH21  ARG  93          HH11      ARG  93   2.515   0.278  -0.495
   25   HH22  ARG  93          HH12      ARG  93   3.084   1.869  -0.900
   26    HA   PRO  94           HA       PRO  94  11.073  -5.617  -5.223
   27    HB2  PRO  94           HB2      PRO  94  12.023  -4.851  -7.675
   28    HB3  PRO  94           HB3      PRO  94  10.565  -5.871  -7.467
   29    HG2  PRO  94           HG2      PRO  94  10.685  -2.866  -7.878
   30    HG3  PRO  94           HG3      PRO  94   9.685  -4.065  -8.760
   31    HD2  PRO  94           HD2      PRO  94   8.707  -2.618  -6.673
   32    HD3  PRO  94           HD3      PRO  94   8.217  -4.315  -6.935
   33    H    ALA  95           H        ALA  95  13.425  -5.348  -5.365
   34    HA   ALA  95           HA       ALA  95  14.443  -3.115  -3.900
   35    HB1  ALA  95           HB1      ALA  95  15.878  -5.278  -5.500
   36    HB2  ALA  95           HB2      ALA  95  16.625  -4.203  -4.301
   37    HB3  ALA  95           HB3      ALA  95  15.401  -5.374  -3.788
   38    H    LYS  96           H        LYS  96  16.344  -1.842  -4.571
   39    HA   LYS  96           HA       LYS  96  16.109  -0.698  -7.301
   40    HB2  LYS  96           HB2      LYS  96  14.835   0.498  -5.487
   41    HB3  LYS  96           HB3      LYS  96  16.378   0.851  -4.699
   42    HG2  LYS  96           HG2      LYS  96  17.073   2.233  -6.612
   43    HG3  LYS  96           HG3      LYS  96  15.632   1.741  -7.525
   44    HD2  LYS  96           HD2      LYS  96  14.174   2.753  -5.769
   45    HD3  LYS  96           HD3      LYS  96  15.616   3.280  -4.881
   46    HE2  LYS  96           HE2      LYS  96  16.302   4.663  -6.817
   47    HE3  LYS  96           HE3      LYS  96  14.900   4.100  -7.731
   48    HZ1  LYS  96           HZ1      LYS  96  14.747   5.700  -5.215
   49    HZ2  LYS  96           HZ2      LYS  96  14.444   6.268  -6.715
   50    HZ3  LYS  96           HZ3      LYS  96  13.453   5.151  -6.060
   51    H    TYR  97           H        TYR  97  18.266  -1.551  -4.679
   52    HA   TYR  97           HA       TYR  97  20.577  -1.070  -6.488
   53    HB2  TYR  97           HB2      TYR  97  20.720  -0.519  -3.514
   54    HB3  TYR  97           HB3      TYR  97  21.865  -0.057  -4.757
   55    HD1  TYR  97           HD1      TYR  97  21.463   1.973  -6.143
   56    HD2  TYR  97           HD2      TYR  97  18.721   0.758  -3.044
   57    HE1  TYR  97           HE1      TYR  97  20.380   4.228  -6.208
   58    HE2  TYR  97           HE2      TYR  97  17.655   3.001  -3.101
   59    HH   TYR  97           HH       TYR  97  17.682   5.111  -4.019
   60    H    SER  98           H        SER  98  22.464  -2.433  -5.960
   61    HA   SER  98           HA       SER  98  22.130  -4.538  -3.926
   62    HB2  SER  98           HB2      SER  98  22.325  -6.396  -5.373
   63    HB3  SER  98           HB3      SER  98  21.059  -5.384  -6.088
   64    HG   SER  98           HG       SER  98  22.708  -4.554  -7.533
   65    H    TYR  99           H        TYR  99  24.073  -5.655  -3.370
   66    HA   TYR  99           HA       TYR  99  26.582  -4.624  -4.571
   67    HB2  TYR  99           HB2      TYR  99  27.521  -4.025  -2.417
   68    HB3  TYR  99           HB3      TYR  99  26.103  -3.091  -2.787
   69    HD1  TYR  99           HD2      TYR  99  23.977  -3.426  -1.549
   70    HD2  TYR  99           HD1      TYR  99  27.572  -5.571  -0.512
   71    HE1  TYR  99           HE2      TYR  99  23.089  -3.788   0.749
   72    HE2  TYR  99           HE1      TYR  99  26.679  -5.941   1.791
   73    HH   TYR  99           HH       TYR  99  23.510  -4.653   2.857
   74    H    VAL 100           H        VAL 100  28.525  -5.589  -3.592
   75    HA   VAL 100           HA       VAL 100  28.288  -8.561  -3.488
   76    HB   VAL 100           HB       VAL 100  28.644  -7.480  -5.763
   77   HG11  VAL 100          HG11      VAL 100  30.234  -5.687  -5.070
   78   HG12  VAL 100          HG12      VAL 100  31.469  -6.936  -4.772
   79   HG13  VAL 100          HG13      VAL 100  30.826  -6.681  -6.404
   80   HG21  VAL 100          HG21      VAL 100  29.143  -9.793  -5.471
   81   HG22  VAL 100          HG22      VAL 100  30.339  -9.056  -6.533
   82   HG23  VAL 100          HG23      VAL 100  30.776  -9.435  -4.858
   83    H    ASP 101           H        ASP 101  30.268  -9.655  -2.760
   84    HA   ASP 101           HA       ASP 101  32.332  -8.115  -1.359
   85    HB2  ASP 101           HB2      ASP 101  30.235  -8.506   0.199
   86    HB3  ASP 101           HB3      ASP 101  30.808 -10.163   0.261
   87    H    GLU 102           H        GLU 102  33.623 -10.180  -0.013
   88    HA   GLU 102           HA       GLU 102  34.959 -11.539  -2.169
   89    HB2  GLU 102           HB2      GLU 102  34.998 -12.009   0.842
   90    HB3  GLU 102           HB3      GLU 102  36.099 -12.777  -0.298
   91    HG2  GLU 102           HG2      GLU 102  35.883  -9.770   0.177
   92    HG3  GLU 102           HG3      GLU 102  37.105 -10.831   0.865
   93    H    ASN 103           H        ASN 103  32.283 -12.548  -0.102
   94    HA   ASN 103           HA       ASN 103  32.264 -15.305  -0.932
   95    HB2  ASN 103           HB2      ASN 103  30.025 -15.324   0.181
   96    HB3  ASN 103           HB3      ASN 103  31.320 -14.695   1.188
   97   HD21  ASN 103          HD22      ASN 103  28.629 -13.572  -0.973
   98   HD22  ASN 103          HD21      ASN 103  28.481 -12.025  -0.150
   99    H    GLY 104           H        GLY 104  31.560 -12.570  -2.787
  100    HA2  GLY 104           HA2      GLY 104  30.888 -12.813  -5.097
  101    HA3  GLY 104           HA3      GLY 104  29.792 -14.116  -4.649
  102    H    GLU 105           H        GLU 105  28.093 -12.982  -5.750
  103    HA   GLU 105           HA       GLU 105  26.994 -10.445  -5.149
  104    HB2  GLU 105           HB2      GLU 105  25.589 -13.059  -5.802
  105    HB3  GLU 105           HB3      GLU 105  24.812 -11.468  -5.736
  106    HG2  GLU 105           HG2      GLU 105  26.312 -10.645  -7.521
  107    HG3  GLU 105           HG3      GLU 105  27.095 -12.222  -7.613
  108    H    THR 106           H        THR 106  26.043  -9.579  -3.358
  109    HA   THR 106           HA       THR 106  25.868 -11.388  -1.027
  110    HB   THR 106           HB       THR 106  26.876  -8.570  -1.237
  111    HG1  THR 106           HG1      THR 106  28.218 -10.398  -1.739
  112   HG21  THR 106          HG21      THR 106  25.722  -8.553   0.869
  113   HG22  THR 106          HG22      THR 106  26.306 -10.196   1.273
  114   HG23  THR 106          HG23      THR 106  27.435  -8.822   1.198
  115    H    LYS 107           H        LYS 107  24.484  -8.103  -1.737
  116    HA   LYS 107           HA       LYS 107  21.825  -9.059  -0.759
  117    HB2  LYS 107           HB2      LYS 107  23.642  -7.133   0.735
  118    HB3  LYS 107           HB3      LYS 107  21.897  -7.065   0.936
  119    HG2  LYS 107           HG2      LYS 107  21.901  -9.472   1.651
  120    HG3  LYS 107           HG3      LYS 107  23.656  -9.468   1.547
  121    HD2  LYS 107           HD2      LYS 107  23.135  -9.176   3.839
  122    HD3  LYS 107           HD3      LYS 107  23.786  -7.668   3.231
  123    HE2  LYS 107           HE2      LYS 107  21.990  -7.081   4.664
  124    HE3  LYS 107           HE3      LYS 107  21.419  -6.774   3.029
  125    HZ1  LYS 107           HZ1      LYS 107  20.187  -8.907   3.142
  126    HZ2  LYS 107           HZ2      LYS 107  20.775  -9.202   4.642
  127    HZ3  LYS 107           HZ3      LYS 107  19.758  -7.956   4.393
  128    H    THR 108           H        THR 108  20.225  -7.307  -0.647
  129    HA   THR 108           HA       THR 108  20.498  -5.261  -2.806
  130    HB   THR 108           HB       THR 108  18.139  -5.730  -3.392
  131    HG1  THR 108           HG1      THR 108  17.236  -7.697  -2.605
  132   HG21  THR 108          HG21      THR 108  18.480  -7.808  -4.614
  133   HG22  THR 108          HG22      THR 108  19.952  -6.841  -4.682
  134   HG23  THR 108          HG23      THR 108  19.861  -8.234  -3.588
  135    H    TRP 109           H        TRP 109  18.985  -3.485  -2.682
  136    HA   TRP 109           HA       TRP 109  17.721  -2.881  -0.079
  137    HB2  TRP 109           HB2      TRP 109  20.109  -2.256   0.171
  138    HB3  TRP 109           HB3      TRP 109  20.012  -1.257  -1.270
  139    HD1  TRP 109           HD1      TRP 109  17.763  -1.369   1.910
  140    HE1  TRP 109           HE1      TRP 109  17.592   0.993   2.899
  141    HE3  TRP 109           HE3      TRP 109  20.923   1.098  -1.306
  142    HZ2  TRP 109           HZ2      TRP 109  18.855   3.547   2.512
  143    HZ3  TRP 109           HZ3      TRP 109  21.462   3.488  -0.917
  144    HH2  TRP 109           HH2      TRP 109  20.460   4.714   0.995
  145    H    THR 110           H        THR 110  16.331  -1.016  -0.173
  146    HA   THR 110           HA       THR 110  15.428  -0.325  -2.946
  147    HB   THR 110           HB       THR 110  13.703  -0.481  -0.464
  148    HG1  THR 110           HG1      THR 110  13.214  -2.544  -1.094
  149   HG21  THR 110          HG21      THR 110  12.566   0.701  -2.279
  150   HG22  THR 110          HG22      THR 110  13.077  -0.531  -3.451
  151   HG23  THR 110          HG23      THR 110  11.901  -0.927  -2.177
  152    H    GLY 111           H        GLY 111  16.789   1.149  -0.201
  153    HA2  GLY 111           HA2      GLY 111  17.444   3.465  -0.368
  154    HA3  GLY 111           HA3      GLY 111  15.887   3.864  -1.085
  155    H    GLN 112           H        GLN 112  14.670   1.971   1.109
  156    HA   GLN 112           HA       GLN 112  14.028   4.023   3.037
  157    HB2  GLN 112           HB2      GLN 112  12.485   2.260   2.189
  158    HB3  GLN 112           HB3      GLN 112  13.448   1.023   3.012
  159    HG2  GLN 112           HG2      GLN 112  12.882   2.019   5.198
  160    HG3  GLN 112           HG3      GLN 112  12.051   3.356   4.392
  161   HE21  GLN 112          HE22      GLN 112  10.037   2.849   5.499
  162   HE22  GLN 112          HE21      GLN 112   9.106   1.437   5.018
  163    H    GLY 113           H        GLY 113  14.605   4.172   5.220
  164    HA2  GLY 113           HA2      GLY 113  15.711   3.783   7.209
  165    HA3  GLY 113           HA3      GLY 113  16.135   2.177   6.635
  166    H    ARG 114           H        ARG 114  18.061   2.840   7.968
  167    HA   ARG 114           HA       ARG 114  20.018   4.727   7.082
  168    HB2  ARG 114           HB2      ARG 114  19.891   3.655   9.332
  169    HB3  ARG 114           HB3      ARG 114  20.399   2.120   8.624
  170    HG2  ARG 114           HG2      ARG 114  22.556   3.132   7.951
  171    HG3  ARG 114           HG3      ARG 114  22.050   4.697   8.600
  172    HD2  ARG 114           HD2      ARG 114  22.329   2.133  10.226
  173    HD3  ARG 114           HD3      ARG 114  23.578   3.385  10.094
  174    HE   ARG 114           HE       ARG 114  21.333   4.777  10.939
  175   HH11  ARG 114          HH11      ARG 114  23.203   2.138  12.302
  176   HH12  ARG 114          HH12      ARG 114  22.776   2.560  13.937
  177   HH21  ARG 114          HH21      ARG 114  20.810   5.244  13.050
  178   HH22  ARG 114          HH22      ARG 114  21.465   4.285  14.342
  179    H    THR 115           H        THR 115  21.582   4.665   5.574
  180    HA   THR 115           HA       THR 115  21.634   3.018   3.363
  181    HB   THR 115           HB       THR 115  24.015   4.479   4.558
  182    HG1  THR 115           HG1      THR 115  23.212   6.232   3.379
  183   HG21  THR 115          HG21      THR 115  23.312   3.751   1.676
  184   HG22  THR 115          HG22      THR 115  24.669   4.789   2.183
  185   HG23  THR 115          HG23      THR 115  24.653   3.087   2.640
  186    HA   PRO 116           HA       PRO 116  23.415  -0.841   4.929
  187    HB2  PRO 116           HB2      PRO 116  24.221  -1.212   2.044
  188    HB3  PRO 116           HB3      PRO 116  23.407  -2.361   3.146
  189    HG2  PRO 116           HG2      PRO 116  22.007  -1.013   1.244
  190    HG3  PRO 116           HG3      PRO 116  21.323  -1.283   2.877
  191    HD2  PRO 116           HD2      PRO 116  22.571   1.219   1.758
  192    HD3  PRO 116           HD3      PRO 116  21.150   1.020   2.836
  193    H    ALA 117           H        ALA 117  25.477  -1.681   5.451
  194    HA   ALA 117           HA       ALA 117  27.458   0.181   5.860
  195    HB1  ALA 117           HB1      ALA 117  27.184  -1.894   7.134
  196    HB2  ALA 117           HB2      ALA 117  27.756  -2.853   5.749
  197    HB3  ALA 117           HB3      ALA 117  28.859  -1.726   6.567
  198    H    VAL 118           H        VAL 118  27.589  -2.279   3.209
  199    HA   VAL 118           HA       VAL 118  30.121  -1.408   2.207
  200    HB   VAL 118           HB       VAL 118  27.854  -2.825   0.756
  201   HG11  VAL 118          HG11      VAL 118  30.786  -2.513  -0.041
  202   HG12  VAL 118          HG12      VAL 118  29.635  -3.628  -0.802
  203   HG13  VAL 118          HG13      VAL 118  29.368  -1.893  -0.931
  204   HG21  VAL 118          HG21      VAL 118  28.709  -4.111   2.686
  205   HG22  VAL 118          HG22      VAL 118  29.249  -4.858   1.183
  206   HG23  VAL 118          HG23      VAL 118  30.380  -3.872   2.129
  207    H    ILE 119           H        ILE 119  26.824  -0.387   1.359
  208    HA   ILE 119           HA       ILE 119  27.529   1.385  -0.804
  209    HB   ILE 119           HB       ILE 119  25.121   1.468   1.068
  210   HG12  ILE 119          HG12      ILE 119  25.235  -0.741   0.023
  211   HG13  ILE 119          HG13      ILE 119  23.868   0.196  -0.539
  212   HG21  ILE 119          HG21      ILE 119  23.993   2.604  -0.846
  213   HG22  ILE 119          HG22      ILE 119  25.308   3.553  -0.154
  214   HG23  ILE 119          HG23      ILE 119  25.557   2.695  -1.685
  215   HD11  ILE 119          HD11      ILE 119  24.898  -1.067  -2.360
  216   HD12  ILE 119          HD12      ILE 119  25.040   0.667  -2.664
  217   HD13  ILE 119          HD13      ILE 119  26.452  -0.257  -2.088
  218    H    LYS 120           H        LYS 120  26.994   1.944   2.682
  219    HA   LYS 120           HA       LYS 120  27.494   4.741   2.879
  220    HB2  LYS 120           HB2      LYS 120  26.525   3.481   4.698
  221    HB3  LYS 120           HB3      LYS 120  27.844   2.342   4.724
  222    HG2  LYS 120           HG2      LYS 120  28.044   3.640   6.654
  223    HG3  LYS 120           HG3      LYS 120  29.387   4.098   5.620
  224    HD2  LYS 120           HD2      LYS 120  28.217   6.182   4.986
  225    HD3  LYS 120           HD3      LYS 120  26.755   5.654   5.857
  226    HE2  LYS 120           HE2      LYS 120  28.076   5.593   7.988
  227    HE3  LYS 120           HE3      LYS 120  29.484   6.209   7.110
  228    HZ1  LYS 120           HZ1      LYS 120  28.292   8.020   8.196
  229    HZ2  LYS 120           HZ2      LYS 120  28.190   8.213   6.574
  230    HZ3  LYS 120           HZ3      LYS 120  26.897   7.662   7.423
  231    H    LYS 121           H        LYS 121  29.764   2.021   3.256
  232    HA   LYS 121           HA       LYS 121  32.083   3.625   3.644
  233    HB2  LYS 121           HB2      LYS 121  31.548   1.049   4.083
  234    HB3  LYS 121           HB3      LYS 121  32.213   0.823   2.475
  235    HG2  LYS 121           HG2      LYS 121  33.927   0.439   4.087
  236    HG3  LYS 121           HG3      LYS 121  34.335   1.971   3.301
  237    HD2  LYS 121           HD2      LYS 121  33.576   3.246   5.219
  238    HD3  LYS 121           HD3      LYS 121  32.780   1.838   5.935
  239    HE2  LYS 121           HE2      LYS 121  34.935   0.732   6.309
  240    HE3  LYS 121           HE3      LYS 121  35.790   2.002   5.429
  241    HZ1  LYS 121           HZ1      LYS 121  35.941   2.336   7.833
  242    HZ2  LYS 121           HZ2      LYS 121  35.158   3.586   7.119
  243    HZ3  LYS 121           HZ3      LYS 121  34.312   2.451   7.972
  244    H    ALA 122           H        ALA 122  30.831   2.111   0.656
  245    HA   ALA 122           HA       ALA 122  32.977   2.877  -1.029
  246    HB1  ALA 122           HB1      ALA 122  31.361   1.115  -1.566
  247    HB2  ALA 122           HB2      ALA 122  30.042   2.306  -1.652
  248    HB3  ALA 122           HB3      ALA 122  31.365   2.347  -2.839
  249    H    MET 123           H        MET 123  29.918   4.631  -0.261
  250    HA   MET 123           HA       MET 123  30.504   6.754  -2.111
  251    HB2  MET 123           HB2      MET 123  28.596   6.680   0.255
  252    HB3  MET 123           HB3      MET 123  28.737   8.020  -0.895
  253    HG2  MET 123           HG2      MET 123  28.351   6.231  -2.735
  254    HG3  MET 123           HG3      MET 123  27.752   5.211  -1.442
  255    HE1  MET 123           HE1      MET 123  25.667   5.823   0.069
  256    HE2  MET 123           HE2      MET 123  26.238   7.466   0.453
  257    HE3  MET 123           HE3      MET 123  24.602   7.218  -0.192
  258    H    GLU 124           H        GLU 124  31.062   6.513   1.447
  259    HA   GLU 124           HA       GLU 124  32.101   9.221   1.486
  260    HB2  GLU 124           HB2      GLU 124  31.864   7.085   3.630
  261    HB3  GLU 124           HB3      GLU 124  32.510   8.718   3.902
  262    HG2  GLU 124           HG2      GLU 124  30.380   9.693   3.022
  263    HG3  GLU 124           HG3      GLU 124  29.715   8.068   2.870
  264    H    GLU 125           H        GLU 125  33.674   6.015   1.560
  265    HA   GLU 125           HA       GLU 125  36.331   7.379   1.879
  266    HB2  GLU 125           HB2      GLU 125  35.380   4.613   2.649
  267    HB3  GLU 125           HB3      GLU 125  37.067   5.153   2.725
  268    HG2  GLU 125           HG2      GLU 125  36.389   7.033   4.227
  269    HG3  GLU 125           HG3      GLU 125  34.734   6.423   4.222
  270    H    GLN 126           H        GLN 126  34.552   5.640  -0.470
  271    HA   GLN 126           HA       GLN 126  37.036   5.595  -2.170
  272    HB2  GLN 126           HB2      GLN 126  34.638   3.741  -2.343
  273    HB3  GLN 126           HB3      GLN 126  35.968   3.775  -3.489
  274    HG2  GLN 126           HG2      GLN 126  36.331   3.144  -0.523
  275    HG3  GLN 126           HG3      GLN 126  36.074   1.943  -1.771
  276   HE21  GLN 126          HE22      GLN 126  38.414   4.443  -0.655
  277   HE22  GLN 126          HE21      GLN 126  39.769   3.711  -1.505
  278    H    GLY 127           H        GLY 127  34.272   7.361  -1.701
  279    HA2  GLY 127           HA2      GLY 127  33.576   9.213  -2.831
  280    HA3  GLY 127           HA3      GLY 127  34.857   8.943  -4.002
  281    H    LYS 128           H        LYS 128  32.641   6.297  -3.730
  282    HA   LYS 128           HA       LYS 128  31.580   6.833  -6.444
  283    HB2  LYS 128           HB2      LYS 128  31.240   4.464  -4.546
  284    HB3  LYS 128           HB3      LYS 128  30.505   4.572  -6.158
  285    HG2  LYS 128           HG2      LYS 128  32.846   5.054  -7.071
  286    HG3  LYS 128           HG3      LYS 128  33.471   4.515  -5.507
  287    HD2  LYS 128           HD2      LYS 128  31.781   2.897  -7.461
  288    HD3  LYS 128           HD3      LYS 128  33.531   2.772  -7.257
  289    HE2  LYS 128           HE2      LYS 128  33.218   2.011  -4.906
  290    HE3  LYS 128           HE3      LYS 128  31.454   2.121  -5.119
  291    HZ1  LYS 128           HZ1      LYS 128  32.249  -0.162  -5.497
  292    HZ2  LYS 128           HZ2      LYS 128  31.597   0.454  -6.876
  293    HZ3  LYS 128           HZ3      LYS 128  33.228   0.329  -6.709
  294    H    GLN 129           H        GLN 129  29.139   6.054  -6.670
  295    HA   GLN 129           HA       GLN 129  27.359   7.388  -4.690
  296    HB2  GLN 129           HB2      GLN 129  27.462   7.947  -7.688
  297    HB3  GLN 129           HB3      GLN 129  26.108   8.406  -6.668
  298    HG2  GLN 129           HG2      GLN 129  28.951   9.432  -6.275
  299    HG3  GLN 129           HG3      GLN 129  27.688  10.267  -7.159
  300   HE21  GLN 129          HE22      GLN 129  28.767   9.333  -3.898
  301   HE22  GLN 129          HE21      GLN 129  27.617  10.392  -3.072
  302    H    LEU 130           H        LEU 130  24.990   6.845  -5.249
  303    HA   LEU 130           HA       LEU 130  24.741   4.046  -5.005
  304    HB2  LEU 130           HB2      LEU 130  22.580   6.015  -5.835
  305    HB3  LEU 130           HB3      LEU 130  22.360   4.389  -5.181
  306    HG   LEU 130           HG       LEU 130  23.409   6.772  -3.680
  307   HD11  LEU 130          HD11      LEU 130  21.395   6.584  -2.360
  308   HD12  LEU 130          HD12      LEU 130  20.956   6.705  -4.074
  309   HD13  LEU 130          HD13      LEU 130  20.900   5.132  -3.248
  310   HD21  LEU 130          HD21      LEU 130  24.566   4.768  -2.850
  311   HD22  LEU 130          HD22      LEU 130  23.335   5.257  -1.680
  312   HD23  LEU 130          HD23      LEU 130  23.019   3.888  -2.773
  313    H    GLU 131           H        GLU 131  24.709   5.959  -7.927
  314    HA   GLU 131           HA       GLU 131  23.349   4.157  -9.670
  315    HB2  GLU 131           HB2      GLU 131  25.609   6.144 -10.210
  316    HB3  GLU 131           HB3      GLU 131  24.751   5.267 -11.479
  317    HG2  GLU 131           HG2      GLU 131  22.619   6.252 -10.773
  318    HG3  GLU 131           HG3      GLU 131  23.433   7.156  -9.489
  319    H    ASP 132           H        ASP 132  26.676   3.932  -8.387
  320    HA   ASP 132           HA       ASP 132  27.563   1.932 -10.252
  321    HB2  ASP 132           HB2      ASP 132  29.011   3.344  -8.722
  322    HB3  ASP 132           HB3      ASP 132  28.485   2.313  -7.385
  323    H    PHE 133           H        PHE 133  25.274   1.801  -7.753
  324    HA   PHE 133           HA       PHE 133  25.343  -1.176  -7.486
  325    HB2  PHE 133           HB2      PHE 133  24.378   0.939  -5.524
  326    HB3  PHE 133           HB3      PHE 133  24.436  -0.784  -5.240
  327    HD1  PHE 133           HD1      PHE 133  26.697  -1.962  -5.124
  328    HD2  PHE 133           HD2      PHE 133  26.319   2.327  -5.169
  329    HE1  PHE 133           HE1      PHE 133  28.964  -1.757  -4.143
  330    HE2  PHE 133           HE2      PHE 133  28.583   2.535  -4.175
  331    HZ   PHE 133           HZ       PHE 133  29.906   0.483  -3.650
  332    H    LEU 134           H        LEU 134  23.419   1.548  -8.400
  333    HA   LEU 134           HA       LEU 134  20.778   0.718  -8.093
  334    HB2  LEU 134           HB2      LEU 134  21.664   2.940  -8.684
  335    HB3  LEU 134           HB3      LEU 134  22.202   2.346 -10.246
  336    HG   LEU 134           HG       LEU 134  20.252   3.870 -10.195
  337   HD11  LEU 134          HD11      LEU 134  20.704   2.564 -12.182
  338   HD12  LEU 134          HD12      LEU 134  19.711   1.227 -11.583
  339   HD13  LEU 134          HD13      LEU 134  18.967   2.794 -11.942
  340   HD21  LEU 134          HD21      LEU 134  18.067   3.151  -9.608
  341   HD22  LEU 134          HD22      LEU 134  18.597   1.496  -9.307
  342   HD23  LEU 134          HD23      LEU 134  19.106   2.803  -8.220
  343    H    ILE 135           H        ILE 135  19.450  -0.558  -9.035
  344    HA   ILE 135           HA       ILE 135  20.250  -2.146 -11.461
  345    HB   ILE 135           HB       ILE 135  19.241  -4.096 -10.556
  346   HG12  ILE 135          HG12      ILE 135  17.998  -2.230  -8.572
  347   HG13  ILE 135          HG13      ILE 135  17.289  -3.550  -9.472
  348   HG21  ILE 135          HG21      ILE 135  21.560  -3.470  -9.859
  349   HG22  ILE 135          HG22      ILE 135  20.887  -2.899  -8.315
  350   HG23  ILE 135          HG23      ILE 135  20.725  -4.606  -8.792
  351   HD11  ILE 135          HD11      ILE 135  17.322  -4.078  -7.119
  352   HD12  ILE 135          HD12      ILE 135  18.471  -5.161  -7.939
  353   HD13  ILE 135          HD13      ILE 135  19.051  -3.748  -7.007
  354    H    LYS 136           H        LYS 136  17.876   0.079 -10.560
  355    HA   LYS 136           HA       LYS 136  15.919  -1.094 -12.498
  356    HB2  LYS 136           HB2      LYS 136  15.416  -1.595 -10.059
  357    HB3  LYS 136           HB3      LYS 136  15.179   0.122  -9.802
  358    HG2  LYS 136           HG2      LYS 136  13.039  -0.864 -10.094
  359    HG3  LYS 136           HG3      LYS 136  13.349   0.053 -11.572
  360    HD2  LYS 136           HD2      LYS 136  13.960  -2.043 -12.757
  361    HD3  LYS 136           HD3      LYS 136  13.790  -2.962 -11.247
  362    HE2  LYS 136           HE2      LYS 136  11.379  -2.327 -11.143
  363    HE3  LYS 136           HE3      LYS 136  11.557  -1.380 -12.625
  364    HZ1  LYS 136           HZ1      LYS 136  12.103  -3.446 -13.814
  365    HZ2  LYS 136           HZ2      LYS 136  11.957  -4.332 -12.449
  366    HZ3  LYS 136           HZ3      LYS 136  10.649  -3.595 -13.092
  367    H    GLU 137           H        GLU 137  15.823   1.948 -10.586
  368    HA   GLU 137           HA       GLU 137  15.993   3.613 -13.018
  369    HB2  GLU 137           HB2      GLU 137  13.659   2.723 -13.011
  370    HB3  GLU 137           HB3      GLU 137  13.421   3.357 -11.381
  371    HG2  GLU 137           HG2      GLU 137  13.681   5.659 -12.224
  372    HG3  GLU 137           HG3      GLU 137  14.094   5.051 -13.830
  373    H    LEU 138           H        LEU 138  16.570   5.742 -12.514
  374    HA   LEU 138           HA       LEU 138  16.338   6.721  -9.746
  375    HB2  LEU 138           HB2      LEU 138  18.572   5.381 -10.290
  376    HB3  LEU 138           HB3      LEU 138  19.033   6.847 -11.128
  377    HG   LEU 138           HG       LEU 138  18.660   8.092  -8.910
  378   HD11  LEU 138          HD11      LEU 138  18.680   6.713  -6.852
  379   HD12  LEU 138          HD12      LEU 138  17.189   6.511  -7.765
  380   HD13  LEU 138          HD13      LEU 138  18.449   5.252  -7.831
  381   HD21  LEU 138          HD21      LEU 138  20.690   5.815  -8.885
  382   HD22  LEU 138          HD22      LEU 138  20.903   7.417  -9.647
  383   HD23  LEU 138          HD23      LEU 138  20.747   7.290  -7.894
  384    H    GLU 139           H        GLU 139  15.066   7.460 -12.227
  385    HA   GLU 139           HA       GLU 139  15.733  10.359 -12.395
  386    HB2  GLU 139           HB2      GLU 139  15.491   8.499 -14.794
  387    HB3  GLU 139           HB3      GLU 139  15.448  10.255 -14.871
  388    HG2  GLU 139           HG2      GLU 139  17.739  10.354 -13.863
  389    HG3  GLU 139           HG3      GLU 139  17.809   8.587 -13.920
  Start of MODEL    7
    1    H1   ALA  91           H1       ALA  91   0.026  -3.272   0.104
    2    H2   ALA  91           H2       ALA  91  -0.761  -2.110  -0.739
    3    H3   ALA  91           H3       ALA  91  -0.154  -3.415  -1.517
    4    HA   ALA  91           HA       ALA  91   1.234  -1.514  -1.928
    5    HB1  ALA  91           HB1      ALA  91   0.686  -0.264   0.135
    6    HB2  ALA  91           HB2      ALA  91   1.596  -1.444   1.107
    7    HB3  ALA  91           HB3      ALA  91   2.436  -0.418  -0.072
    8    H    ALA  92           H        ALA  92   3.569  -1.655  -2.111
    9    HA   ALA  92           HA       ALA  92   4.945  -4.041  -1.044
   10    HB1  ALA  92           HB1      ALA  92   4.540  -3.556  -4.037
   11    HB2  ALA  92           HB2      ALA  92   5.554  -4.828  -3.325
   12    HB3  ALA  92           HB3      ALA  92   3.799  -4.862  -3.091
   13    H    ARG  93           H        ARG  93   7.257  -4.076  -1.751
   14    HA   ARG  93           HA       ARG  93   8.460  -1.497  -2.582
   15    HB2  ARG  93           HB2      ARG  93  10.013  -1.465  -0.642
   16    HB3  ARG  93           HB3      ARG  93   8.338  -1.073  -0.280
   17    HG2  ARG  93           HG2      ARG  93   7.961  -3.296   0.704
   18    HG3  ARG  93           HG3      ARG  93   9.620  -3.781   0.310
   19    HD2  ARG  93           HD2      ARG  93  10.493  -1.949   1.741
   20    HD3  ARG  93           HD3      ARG  93   8.830  -1.486   2.143
   21    HE   ARG  93           HE       ARG  93   9.160  -4.250   2.738
   22   HH11  ARG  93          HH11      ARG  93  10.314  -1.177   3.995
   23   HH12  ARG  93          HH12      ARG  93  10.549  -1.828   5.600
   24   HH21  ARG  93          HH21      ARG  93   9.470  -5.002   4.810
   25   HH22  ARG  93          HH22      ARG  93  10.068  -3.934   6.046
   26    HA   PRO  94           HA       PRO  94  10.535  -5.107  -4.642
   27    HB2  PRO  94           HB2      PRO  94  10.607  -2.914  -6.715
   28    HB3  PRO  94           HB3      PRO  94  10.380  -4.677  -6.943
   29    HG2  PRO  94           HG2      PRO  94   8.257  -3.002  -7.055
   30    HG3  PRO  94           HG3      PRO  94   8.121  -4.553  -6.164
   31    HD2  PRO  94           HD2      PRO  94   8.625  -1.784  -5.048
   32    HD3  PRO  94           HD3      PRO  94   7.499  -3.052  -4.479
   33    H    ALA  95           H        ALA  95  12.776  -5.300  -5.249
   34    HA   ALA  95           HA       ALA  95  14.650  -3.552  -3.942
   35    HB1  ALA  95           HB1      ALA  95  16.350  -4.925  -5.093
   36    HB2  ALA  95           HB2      ALA  95  15.100  -5.940  -4.337
   37    HB3  ALA  95           HB3      ALA  95  15.087  -5.669  -6.097
   38    H    LYS  96           H        LYS  96  16.195  -2.182  -4.803
   39    HA   LYS  96           HA       LYS  96  16.068  -1.347  -7.627
   40    HB2  LYS  96           HB2      LYS  96  14.624   0.117  -5.990
   41    HB3  LYS  96           HB3      LYS  96  16.174   0.760  -5.447
   42    HG2  LYS  96           HG2      LYS  96  16.650   1.314  -7.919
   43    HG3  LYS  96           HG3      LYS  96  14.991   0.853  -8.262
   44    HD2  LYS  96           HD2      LYS  96  15.860   3.067  -6.342
   45    HD3  LYS  96           HD3      LYS  96  15.335   3.297  -8.005
   46    HE2  LYS  96           HE2      LYS  96  13.123   2.189  -7.385
   47    HE3  LYS  96           HE3      LYS  96  13.647   2.205  -5.697
   48    HZ1  LYS  96           HZ1      LYS  96  13.321   4.612  -7.435
   49    HZ2  LYS  96           HZ2      LYS  96  12.287   4.164  -6.246
   50    HZ3  LYS  96           HZ3      LYS  96  13.798   4.661  -5.860
   51    H    TYR  97           H        TYR  97  17.979  -2.156  -4.943
   52    HA   TYR  97           HA       TYR  97  20.471  -1.259  -6.310
   53    HB2  TYR  97           HB2      TYR  97  19.701  -1.076  -3.367
   54    HB3  TYR  97           HB3      TYR  97  21.340  -0.867  -3.946
   55    HD1  TYR  97           HD2      TYR  97  17.994   0.678  -3.712
   56    HD2  TYR  97           HD1      TYR  97  22.062   1.138  -5.068
   57    HE1  TYR  97           HE2      TYR  97  17.646   3.131  -3.945
   58    HE2  TYR  97           HE1      TYR  97  21.704   3.572  -5.323
   59    HH   TYR  97           HH       TYR  97  18.604   5.167  -4.474
   60    H    SER  98           H        SER  98  22.328  -2.540  -5.821
   61    HA   SER  98           HA       SER  98  22.064  -4.989  -4.178
   62    HB2  SER  98           HB2      SER  98  21.380  -5.631  -6.499
   63    HB3  SER  98           HB3      SER  98  22.963  -5.076  -7.078
   64    HG   SER  98           HG       SER  98  22.928  -7.352  -6.653
   65    H    TYR  99           H        TYR  99  24.038  -5.772  -3.410
   66    HA   TYR  99           HA       TYR  99  26.520  -4.493  -4.364
   67    HB2  TYR  99           HB2      TYR  99  27.310  -3.864  -2.184
   68    HB3  TYR  99           HB3      TYR  99  25.809  -3.056  -2.547
   69    HD1  TYR  99           HD2      TYR  99  23.680  -3.742  -1.412
   70    HD2  TYR  99           HD1      TYR  99  27.522  -5.327  -0.265
   71    HE1  TYR  99           HE2      TYR  99  22.812  -4.180   0.890
   72    HE2  TYR  99           HE1      TYR  99  26.647  -5.806   2.012
   73    HH   TYR  99           HH       TYR  99  24.853  -5.623   3.461
   74    H    VAL 100           H        VAL 100  28.465  -5.376  -3.549
   75    HA   VAL 100           HA       VAL 100  28.431  -8.364  -3.425
   76    HB   VAL 100           HB       VAL 100  30.147  -6.498  -5.134
   77   HG11  VAL 100          HG11      VAL 100  30.864  -8.485  -6.358
   78   HG12  VAL 100          HG12      VAL 100  31.322  -8.629  -4.667
   79   HG13  VAL 100          HG13      VAL 100  29.911  -9.521  -5.287
   80   HG21  VAL 100          HG21      VAL 100  27.799  -8.248  -5.982
   81   HG22  VAL 100          HG22      VAL 100  27.878  -6.479  -6.051
   82   HG23  VAL 100          HG23      VAL 100  28.919  -7.438  -7.090
   83    H    ASP 101           H        ASP 101  30.348  -9.324  -2.542
   84    HA   ASP 101           HA       ASP 101  32.361  -7.613  -1.229
   85    HB2  ASP 101           HB2      ASP 101  30.346  -8.124   0.350
   86    HB3  ASP 101           HB3      ASP 101  30.977  -9.765   0.395
   87    H    GLU 102           H        GLU 102  33.797  -9.598   0.111
   88    HA   GLU 102           HA       GLU 102  35.444 -10.563  -1.953
   89    HB2  GLU 102           HB2      GLU 102  35.990 -10.145   0.479
   90    HB3  GLU 102           HB3      GLU 102  35.173 -11.667   0.876
   91    HG2  GLU 102           HG2      GLU 102  36.801 -12.913  -0.511
   92    HG3  GLU 102           HG3      GLU 102  37.553 -11.398  -1.020
   93    H    ASN 103           H        ASN 103  32.862 -12.279  -0.209
   94    HA   ASN 103           HA       ASN 103  33.406 -14.854  -1.366
   95    HB2  ASN 103           HB2      ASN 103  32.441 -14.360   0.913
   96    HB3  ASN 103           HB3      ASN 103  30.957 -13.813   0.122
   97   HD21  ASN 103          HD22      ASN 103  29.572 -15.388   0.891
   98   HD22  ASN 103          HD21      ASN 103  29.787 -17.104   0.572
   99    H    GLY 104           H        GLY 104  31.818 -12.125  -2.693
  100    HA2  GLY 104           HA2      GLY 104  31.136 -12.455  -5.100
  101    HA3  GLY 104           HA3      GLY 104  30.099 -13.763  -4.535
  102    H    GLU 105           H        GLU 105  28.448 -12.493  -5.666
  103    HA   GLU 105           HA       GLU 105  27.302 -10.076  -4.816
  104    HB2  GLU 105           HB2      GLU 105  25.748 -12.588  -5.558
  105    HB3  GLU 105           HB3      GLU 105  25.191 -10.917  -5.576
  106    HG2  GLU 105           HG2      GLU 105  25.643 -11.118  -7.787
  107    HG3  GLU 105           HG3      GLU 105  27.239 -10.593  -7.273
  108    H    THR 106           H        THR 106  26.263  -9.360  -3.017
  109    HA   THR 106           HA       THR 106  26.155 -11.273  -0.762
  110    HB   THR 106           HB       THR 106  26.945  -8.377  -0.935
  111    HG1  THR 106           HG1      THR 106  28.400 -10.233  -1.289
  112   HG21  THR 106          HG21      THR 106  27.372  -8.524   1.534
  113   HG22  THR 106          HG22      THR 106  25.669  -8.394   1.094
  114   HG23  THR 106          HG23      THR 106  26.343  -9.975   1.580
  115    H    LYS 107           H        LYS 107  24.515  -8.134  -1.587
  116    HA   LYS 107           HA       LYS 107  21.902  -9.296  -0.777
  117    HB2  LYS 107           HB2      LYS 107  23.366  -7.123   0.769
  118    HB3  LYS 107           HB3      LYS 107  21.634  -7.286   0.885
  119    HG2  LYS 107           HG2      LYS 107  23.666  -9.371   1.758
  120    HG3  LYS 107           HG3      LYS 107  22.811  -8.261   2.799
  121    HD2  LYS 107           HD2      LYS 107  21.458 -10.432   1.135
  122    HD3  LYS 107           HD3      LYS 107  21.905 -10.564   2.832
  123    HE2  LYS 107           HE2      LYS 107  20.442  -8.608   3.373
  124    HE3  LYS 107           HE3      LYS 107  19.925  -8.541   1.685
  125    HZ1  LYS 107           HZ1      LYS 107  19.024 -10.810   1.948
  126    HZ2  LYS 107           HZ2      LYS 107  19.496 -10.856   3.514
  127    HZ3  LYS 107           HZ3      LYS 107  18.344  -9.804   3.037
  128    H    THR 108           H        THR 108  20.112  -7.836  -1.022
  129    HA   THR 108           HA       THR 108  20.514  -5.582  -2.935
  130    HB   THR 108           HB       THR 108  18.246  -6.075  -3.776
  131    HG1  THR 108           HG1      THR 108  17.333  -8.106  -3.204
  132   HG21  THR 108          HG21      THR 108  20.080  -8.503  -3.939
  133   HG22  THR 108          HG22      THR 108  18.797  -8.054  -5.090
  134   HG23  THR 108          HG23      THR 108  20.238  -7.033  -4.928
  135    H    TRP 109           H        TRP 109  18.850  -3.916  -2.869
  136    HA   TRP 109           HA       TRP 109  17.464  -3.486  -0.290
  137    HB2  TRP 109           HB2      TRP 109  19.677  -2.724   0.226
  138    HB3  TRP 109           HB3      TRP 109  19.831  -1.867  -1.289
  139    HD1  TRP 109           HD1      TRP 109  17.299  -1.601   1.668
  140    HE1  TRP 109           HE1      TRP 109  17.060   0.875   2.316
  141    HE3  TRP 109           HE3      TRP 109  20.668   0.458  -1.620
  142    HZ2  TRP 109           HZ2      TRP 109  18.302   3.374   1.651
  143    HZ3  TRP 109           HZ3      TRP 109  21.156   2.886  -1.545
  144    HH2  TRP 109           HH2      TRP 109  19.993   4.351   0.089
  145    H    THR 110           H        THR 110  16.025  -1.632  -0.338
  146    HA   THR 110           HA       THR 110  14.697  -1.406  -2.977
  147    HB   THR 110           HB       THR 110  12.787  -0.662  -1.592
  148    HG1  THR 110           HG1      THR 110  13.214  -0.790   0.755
  149   HG21  THR 110          HG21      THR 110  13.224  -3.142  -1.794
  150   HG22  THR 110          HG22      THR 110  14.105  -3.071  -0.259
  151   HG23  THR 110          HG23      THR 110  12.381  -2.676  -0.306
  152    H    GLY 111           H        GLY 111  16.538   0.602  -0.823
  153    HA2  GLY 111           HA2      GLY 111  17.230   2.860  -1.327
  154    HA3  GLY 111           HA3      GLY 111  15.742   3.114  -2.241
  155    H    GLN 112           H        GLN 112  14.534   1.497   0.322
  156    HA   GLN 112           HA       GLN 112  13.654   3.912   1.713
  157    HB2  GLN 112           HB2      GLN 112  12.207   1.935   1.063
  158    HB3  GLN 112           HB3      GLN 112  13.068   0.974   2.282
  159    HG2  GLN 112           HG2      GLN 112  12.256   2.480   4.060
  160    HG3  GLN 112           HG3      GLN 112  11.528   3.542   2.846
  161   HE21  GLN 112          HE22      GLN 112   9.297   3.319   3.202
  162   HE22  GLN 112          HE21      GLN 112   8.491   1.759   3.275
  163    H    GLY 113           H        GLY 113  14.113   4.485   3.852
  164    HA2  GLY 113           HA2      GLY 113  15.166   4.526   5.915
  165    HA3  GLY 113           HA3      GLY 113  15.582   2.826   5.720
  166    H    ARG 114           H        ARG 114  17.548   3.681   6.859
  167    HA   ARG 114           HA       ARG 114  19.486   5.336   5.566
  168    HB2  ARG 114           HB2      ARG 114  21.057   4.539   7.216
  169    HB3  ARG 114           HB3      ARG 114  19.500   4.881   7.967
  170    HG2  ARG 114           HG2      ARG 114  18.989   2.420   7.963
  171    HG3  ARG 114           HG3      ARG 114  20.604   2.115   7.285
  172    HD2  ARG 114           HD2      ARG 114  21.638   3.173   9.263
  173    HD3  ARG 114           HD3      ARG 114  20.025   3.482   9.941
  174    HE   ARG 114           HE       ARG 114  20.251   0.697   9.349
  175   HH11  ARG 114          HH11      ARG 114  21.557   2.970  11.676
  176   HH12  ARG 114          HH12      ARG 114  21.795   1.740  12.887
  177   HH21  ARG 114          HH21      ARG 114  20.603  -0.831  10.931
  178   HH22  ARG 114          HH22      ARG 114  21.274  -0.360  12.465
  179    H    THR 115           H        THR 115  21.306   4.936   4.384
  180    HA   THR 115           HA       THR 115  21.279   2.954   2.391
  181    HB   THR 115           HB       THR 115  23.680   4.526   3.376
  182    HG1  THR 115           HG1      THR 115  22.962   6.103   1.945
  183   HG21  THR 115          HG21      THR 115  24.278   2.828   1.696
  184   HG22  THR 115          HG22      THR 115  22.974   3.397   0.625
  185   HG23  THR 115          HG23      THR 115  24.364   4.446   0.987
  186    HA   PRO 116           HA       PRO 116  23.039  -0.671   4.512
  187    HB2  PRO 116           HB2      PRO 116  24.004  -1.241   1.697
  188    HB3  PRO 116           HB3      PRO 116  23.263  -2.362   2.883
  189    HG2  PRO 116           HG2      PRO 116  21.778  -1.334   0.872
  190    HG3  PRO 116           HG3      PRO 116  21.099  -1.424   2.527
  191    HD2  PRO 116           HD2      PRO 116  22.270   0.980   1.112
  192    HD3  PRO 116           HD3      PRO 116  20.821   0.856   2.153
  193    H    ALA 117           H        ALA 117  25.058  -1.289   5.319
  194    HA   ALA 117           HA       ALA 117  26.926   0.721   5.586
  195    HB1  ALA 117           HB1      ALA 117  26.589  -1.116   7.173
  196    HB2  ALA 117           HB2      ALA 117  27.318  -2.270   6.037
  197    HB3  ALA 117           HB3      ALA 117  28.301  -0.973   6.744
  198    H    VAL 118           H        VAL 118  27.398  -2.153   3.429
  199    HA   VAL 118           HA       VAL 118  30.003  -1.376   2.561
  200    HB   VAL 118           HB       VAL 118  27.913  -3.017   1.085
  201   HG11  VAL 118          HG11      VAL 118  29.855  -4.029  -0.116
  202   HG12  VAL 118          HG12      VAL 118  29.653  -2.328  -0.512
  203   HG13  VAL 118          HG13      VAL 118  30.926  -2.824   0.632
  204   HG21  VAL 118          HG21      VAL 118  29.195  -4.972   1.962
  205   HG22  VAL 118          HG22      VAL 118  30.225  -3.865   2.891
  206   HG23  VAL 118          HG23      VAL 118  28.494  -4.013   3.264
  207    H    ILE 119           H        ILE 119  26.805  -0.569   1.217
  208    HA   ILE 119           HA       ILE 119  27.773   0.926  -1.057
  209    HB   ILE 119           HB       ILE 119  25.119   1.080   0.437
  210   HG12  ILE 119          HG12      ILE 119  25.983  -0.439  -2.056
  211   HG13  ILE 119          HG13      ILE 119  25.533  -1.144  -0.513
  212   HG21  ILE 119          HG21      ILE 119  25.581   3.160  -0.887
  213   HG22  ILE 119          HG22      ILE 119  25.812   2.148  -2.332
  214   HG23  ILE 119          HG23      ILE 119  24.232   2.246  -1.525
  215   HD11  ILE 119          HD11      ILE 119  23.702  -1.444  -2.025
  216   HD12  ILE 119          HD12      ILE 119  23.208  -0.244  -0.817
  217   HD13  ILE 119          HD13      ILE 119  23.670   0.268  -2.459
  218    H    LYS 120           H        LYS 120  26.736   1.972   2.248
  219    HA   LYS 120           HA       LYS 120  27.266   4.743   1.807
  220    HB2  LYS 120           HB2      LYS 120  26.458   5.040   3.876
  221    HB3  LYS 120           HB3      LYS 120  25.935   3.392   3.668
  222    HG2  LYS 120           HG2      LYS 120  26.725   3.261   5.779
  223    HG3  LYS 120           HG3      LYS 120  28.206   2.796   4.960
  224    HD2  LYS 120           HD2      LYS 120  29.018   5.163   5.139
  225    HD3  LYS 120           HD3      LYS 120  27.490   5.602   5.932
  226    HE2  LYS 120           HE2      LYS 120  27.971   3.959   7.755
  227    HE3  LYS 120           HE3      LYS 120  29.529   3.586   6.991
  228    HZ1  LYS 120           HZ1      LYS 120  30.116   5.974   7.258
  229    HZ2  LYS 120           HZ2      LYS 120  28.726   6.238   8.081
  230    HZ3  LYS 120           HZ3      LYS 120  29.857   5.243   8.710
  231    H    LYS 121           H        LYS 121  29.394   2.226   3.099
  232    HA   LYS 121           HA       LYS 121  31.666   3.914   3.599
  233    HB2  LYS 121           HB2      LYS 121  31.320   0.935   3.144
  234    HB3  LYS 121           HB3      LYS 121  32.906   1.666   3.424
  235    HG2  LYS 121           HG2      LYS 121  32.290   2.494   5.587
  236    HG3  LYS 121           HG3      LYS 121  30.576   2.206   5.303
  237    HD2  LYS 121           HD2      LYS 121  31.463   0.565   6.856
  238    HD3  LYS 121           HD3      LYS 121  30.845  -0.173   5.394
  239    HE2  LYS 121           HE2      LYS 121  32.881  -1.306   6.055
  240    HE3  LYS 121           HE3      LYS 121  33.159  -0.470   4.524
  241    HZ1  LYS 121           HZ1      LYS 121  34.374   1.258   5.705
  242    HZ2  LYS 121           HZ2      LYS 121  33.998   0.609   7.178
  243    HZ3  LYS 121           HZ3      LYS 121  34.985  -0.186   6.151
  244    H    ALA 122           H        ALA 122  30.694   2.136   0.617
  245    HA   ALA 122           HA       ALA 122  33.007   2.850  -0.867
  246    HB1  ALA 122           HB1      ALA 122  30.174   2.396  -1.872
  247    HB2  ALA 122           HB2      ALA 122  31.679   2.288  -2.812
  248    HB3  ALA 122           HB3      ALA 122  31.364   1.122  -1.519
  249    H    MET 123           H        MET 123  30.027   4.743  -0.214
  250    HA   MET 123           HA       MET 123  30.653   6.891  -1.989
  251    HB2  MET 123           HB2      MET 123  29.128   7.173   0.626
  252    HB3  MET 123           HB3      MET 123  29.100   8.253  -0.764
  253    HG2  MET 123           HG2      MET 123  28.003   5.445  -0.588
  254    HG3  MET 123           HG3      MET 123  27.084   6.928  -0.754
  255    HE1  MET 123           HE1      MET 123  26.125   4.813  -2.549
  256    HE2  MET 123           HE2      MET 123  26.989   4.461  -4.062
  257    HE3  MET 123           HE3      MET 123  27.648   3.896  -2.514
  258    H    GLU 124           H        GLU 124  31.376   6.572   1.558
  259    HA   GLU 124           HA       GLU 124  32.850   9.065   1.421
  260    HB2  GLU 124           HB2      GLU 124  32.898   9.110   3.720
  261    HB3  GLU 124           HB3      GLU 124  31.318   8.464   3.287
  262    HG2  GLU 124           HG2      GLU 124  32.131   6.169   3.816
  263    HG3  GLU 124           HG3      GLU 124  33.713   6.835   4.248
  264    H    GLU 125           H        GLU 125  33.883   5.699   1.401
  265    HA   GLU 125           HA       GLU 125  36.719   6.504   1.889
  266    HB2  GLU 125           HB2      GLU 125  35.518   3.716   1.830
  267    HB3  GLU 125           HB3      GLU 125  37.150   4.176   2.299
  268    HG2  GLU 125           HG2      GLU 125  36.112   5.576   4.171
  269    HG3  GLU 125           HG3      GLU 125  34.572   4.798   3.771
  270    H    GLN 126           H        GLN 126  34.681   5.513  -0.759
  271    HA   GLN 126           HA       GLN 126  37.102   5.149  -2.486
  272    HB2  GLN 126           HB2      GLN 126  34.499   3.598  -2.693
  273    HB3  GLN 126           HB3      GLN 126  35.900   3.447  -3.751
  274    HG2  GLN 126           HG2      GLN 126  37.277   2.702  -1.808
  275    HG3  GLN 126           HG3      GLN 126  35.838   2.741  -0.786
  276   HE21  GLN 126          HE21      GLN 126  37.732   0.528  -2.226
  277   HE22  GLN 126          HE22      GLN 126  36.503  -0.648  -2.679
  278    H    GLY 127           H        GLY 127  34.656   7.281  -1.939
  279    HA2  GLY 127           HA2      GLY 127  33.925   9.092  -3.128
  280    HA3  GLY 127           HA3      GLY 127  35.151   8.714  -4.336
  281    H    LYS 128           H        LYS 128  32.668   6.327  -3.674
  282    HA   LYS 128           HA       LYS 128  31.665   6.403  -6.408
  283    HB2  LYS 128           HB2      LYS 128  30.770   4.917  -3.887
  284    HB3  LYS 128           HB3      LYS 128  29.998   4.678  -5.438
  285    HG2  LYS 128           HG2      LYS 128  32.906   4.057  -4.809
  286    HG3  LYS 128           HG3      LYS 128  31.573   2.916  -5.019
  287    HD2  LYS 128           HD2      LYS 128  31.301   3.915  -7.398
  288    HD3  LYS 128           HD3      LYS 128  32.910   4.620  -7.152
  289    HE2  LYS 128           HE2      LYS 128  33.854   2.383  -6.713
  290    HE3  LYS 128           HE3      LYS 128  32.235   1.665  -6.843
  291    HZ1  LYS 128           HZ1      LYS 128  33.523   1.431  -8.912
  292    HZ2  LYS 128           HZ2      LYS 128  32.136   2.263  -9.149
  293    HZ3  LYS 128           HZ3      LYS 128  33.583   3.060  -9.095
  294    H    GLN 129           H        GLN 129  29.264   6.206  -6.739
  295    HA   GLN 129           HA       GLN 129  27.593   8.154  -5.246
  296    HB2  GLN 129           HB2      GLN 129  27.817   7.961  -8.288
  297    HB3  GLN 129           HB3      GLN 129  26.579   8.875  -7.415
  298    HG2  GLN 129           HG2      GLN 129  28.368  10.259  -6.360
  299    HG3  GLN 129           HG3      GLN 129  29.580   9.429  -7.334
  300   HE21  GLN 129          HE22      GLN 129  28.176  12.332  -7.237
  301   HE22  GLN 129          HE21      GLN 129  27.996  12.638  -8.960
  302    H    LEU 130           H        LEU 130  25.239   7.649  -5.599
  303    HA   LEU 130           HA       LEU 130  24.770   4.960  -4.885
  304    HB2  LEU 130           HB2      LEU 130  22.996   7.278  -5.703
  305    HB3  LEU 130           HB3      LEU 130  22.282   5.716  -5.460
  306    HG   LEU 130           HG       LEU 130  22.027   7.131  -3.511
  307   HD11  LEU 130          HD11      LEU 130  22.078   4.717  -3.161
  308   HD12  LEU 130          HD12      LEU 130  23.835   4.756  -2.906
  309   HD13  LEU 130          HD13      LEU 130  22.743   5.576  -1.771
  310   HD21  LEU 130          HD21      LEU 130  25.038   6.998  -3.123
  311   HD22  LEU 130          HD22      LEU 130  24.115   8.434  -3.639
  312   HD23  LEU 130          HD23      LEU 130  23.848   7.732  -2.035
  313    H    GLU 131           H        GLU 131  24.638   6.403  -8.072
  314    HA   GLU 131           HA       GLU 131  23.239   4.318  -9.446
  315    HB2  GLU 131           HB2      GLU 131  25.308   6.323 -10.430
  316    HB3  GLU 131           HB3      GLU 131  24.407   5.227 -11.488
  317    HG2  GLU 131           HG2      GLU 131  22.270   6.181 -10.675
  318    HG3  GLU 131           HG3      GLU 131  23.151   7.315  -9.655
  319    H    ASP 132           H        ASP 132  26.527   4.283  -8.199
  320    HA   ASP 132           HA       ASP 132  27.527   2.223  -9.929
  321    HB2  ASP 132           HB2      ASP 132  28.856   3.756  -8.360
  322    HB3  ASP 132           HB3      ASP 132  28.389   2.672  -7.058
  323    H    PHE 133           H        PHE 133  25.271   2.147  -7.306
  324    HA   PHE 133           HA       PHE 133  25.356  -0.848  -7.114
  325    HB2  PHE 133           HB2      PHE 133  24.583   1.211  -5.019
  326    HB3  PHE 133           HB3      PHE 133  24.511  -0.534  -4.819
  327    HD1  PHE 133           HD1      PHE 133  26.581  -1.888  -4.631
  328    HD2  PHE 133           HD2      PHE 133  26.724   2.400  -4.972
  329    HE1  PHE 133           HE1      PHE 133  28.925  -1.905  -3.804
  330    HE2  PHE 133           HE2      PHE 133  29.078   2.384  -4.165
  331    HZ   PHE 133           HZ       PHE 133  30.172   0.224  -3.567
  332    H    LEU 134           H        LEU 134  23.371   1.883  -7.878
  333    HA   LEU 134           HA       LEU 134  20.749   0.761  -7.590
  334    HB2  LEU 134           HB2      LEU 134  21.539   3.203  -7.962
  335    HB3  LEU 134           HB3      LEU 134  21.871   2.725  -9.627
  336    HG   LEU 134           HG       LEU 134  19.376   2.191  -9.841
  337   HD11  LEU 134          HD11      LEU 134  19.243   3.896  -7.327
  338   HD12  LEU 134          HD12      LEU 134  17.876   3.328  -8.295
  339   HD13  LEU 134          HD13      LEU 134  18.863   2.165  -7.374
  340   HD21  LEU 134          HD21      LEU 134  20.210   5.060  -9.203
  341   HD22  LEU 134          HD22      LEU 134  20.490   4.238 -10.747
  342   HD23  LEU 134          HD23      LEU 134  18.835   4.563 -10.212
  343    H    ILE 135           H        ILE 135  19.558  -0.500  -8.884
  344    HA   ILE 135           HA       ILE 135  20.704  -1.459 -11.500
  345    HB   ILE 135           HB       ILE 135  20.096  -3.696 -11.011
  346   HG12  ILE 135          HG12      ILE 135  18.540  -2.510  -8.744
  347   HG13  ILE 135          HG13      ILE 135  18.084  -3.738  -9.909
  348   HG21  ILE 135          HG21      ILE 135  22.259  -2.800 -10.146
  349   HG22  ILE 135          HG22      ILE 135  21.512  -2.637  -8.544
  350   HG23  ILE 135          HG23      ILE 135  21.668  -4.232  -9.303
  351   HD11  ILE 135          HD11      ILE 135  18.232  -4.680  -7.678
  352   HD12  ILE 135          HD12      ILE 135  19.537  -5.371  -8.677
  353   HD13  ILE 135          HD13      ILE 135  19.883  -4.077  -7.493
  354    H    LYS 136           H        LYS 136  17.776  -0.178 -10.151
  355    HA   LYS 136           HA       LYS 136  16.275  -1.113 -12.573
  356    HB2  LYS 136           HB2      LYS 136  16.005  -2.348 -10.223
  357    HB3  LYS 136           HB3      LYS 136  14.886  -1.018  -9.900
  358    HG2  LYS 136           HG2      LYS 136  13.618  -1.632 -11.973
  359    HG3  LYS 136           HG3      LYS 136  14.800  -2.906 -12.307
  360    HD2  LYS 136           HD2      LYS 136  14.172  -4.047 -10.196
  361    HD3  LYS 136           HD3      LYS 136  12.975  -2.772  -9.866
  362    HE2  LYS 136           HE2      LYS 136  11.808  -3.311 -11.992
  363    HE3  LYS 136           HE3      LYS 136  13.008  -4.553 -12.351
  364    HZ1  LYS 136           HZ1      LYS 136  11.148  -4.617 -10.024
  365    HZ2  LYS 136           HZ2      LYS 136  11.015  -5.529 -11.374
  366    HZ3  LYS 136           HZ3      LYS 136  12.271  -5.765 -10.356
  367    H    GLU 137           H        GLU 137  17.389   1.618 -11.763
  368    HA   GLU 137           HA       GLU 137  15.050   3.087 -12.833
  369    HB2  GLU 137           HB2      GLU 137  15.047   3.177 -10.283
  370    HB3  GLU 137           HB3      GLU 137  16.495   4.170 -10.388
  371    HG2  GLU 137           HG2      GLU 137  15.147   5.792 -11.836
  372    HG3  GLU 137           HG3      GLU 137  13.745   4.765 -11.577
  373    H    LEU 138           H        LEU 138  17.058   2.323 -14.379
  374    HA   LEU 138           HA       LEU 138  18.662   4.797 -14.877
  375    HB2  LEU 138           HB2      LEU 138  19.690   1.976 -15.358
  376    HB3  LEU 138           HB3      LEU 138  20.546   3.497 -15.552
  377    HG   LEU 138           HG       LEU 138  19.894   3.690 -12.897
  378   HD11  LEU 138          HD11      LEU 138  20.324   1.547 -11.824
  379   HD12  LEU 138          HD12      LEU 138  18.939   1.352 -12.916
  380   HD13  LEU 138          HD13      LEU 138  20.533   0.748 -13.389
  381   HD21  LEU 138          HD21      LEU 138  22.131   4.035 -13.831
  382   HD22  LEU 138          HD22      LEU 138  22.196   2.974 -12.415
  383   HD23  LEU 138          HD23      LEU 138  22.334   2.286 -14.052
  384    H    GLU 139           H        GLU 139  16.092   3.667 -16.016
  385    HA   GLU 139           HA       GLU 139  16.436   2.909 -18.764
  386    HB2  GLU 139           HB2      GLU 139  14.381   2.547 -17.423
  387    HB3  GLU 139           HB3      GLU 139  14.081   4.290 -17.421
  388    HG2  GLU 139           HG2      GLU 139  13.876   4.262 -19.889
  389    HG3  GLU 139           HG3      GLU 139  14.271   2.543 -19.916
  Start of MODEL    8
    1    H1   ALA  91           H1       ALA  91   3.409 -14.725  -3.011
    2    H2   ALA  91           H2       ALA  91   3.924 -14.128  -4.445
    3    H3   ALA  91           H3       ALA  91   4.677 -15.421  -3.783
    4    HA   ALA  91           HA       ALA  91   4.637 -12.696  -2.659
    5    HB1  ALA  91           HB1      ALA  91   6.244 -13.528  -0.974
    6    HB2  ALA  91           HB2      ALA  91   4.716 -14.416  -0.873
    7    HB3  ALA  91           HB3      ALA  91   6.129 -15.166  -1.644
    8    H    ALA  92           H        ALA  92   6.670 -11.548  -2.718
    9    HA   ALA  92           HA       ALA  92   8.798 -12.481  -4.542
   10    HB1  ALA  92           HB1      ALA  92   8.575 -10.470  -5.980
   11    HB2  ALA  92           HB2      ALA  92   7.106 -11.453  -6.043
   12    HB3  ALA  92           HB3      ALA  92   7.132  -9.970  -5.069
   13    H    ARG  93           H        ARG  93  10.584 -10.871  -4.652
   14    HA   ARG  93           HA       ARG  93  10.909  -9.110  -2.253
   15    HB2  ARG  93           HB2      ARG  93  12.850 -11.287  -3.119
   16    HB3  ARG  93           HB3      ARG  93  13.185 -10.035  -1.911
   17    HG2  ARG  93           HG2      ARG  93  11.260 -10.867  -0.542
   18    HG3  ARG  93           HG3      ARG  93  11.053 -12.204  -1.682
   19    HD2  ARG  93           HD2      ARG  93  13.573 -11.619  -0.079
   20    HD3  ARG  93           HD3      ARG  93  12.368 -12.824   0.354
   21    HE   ARG  93           HE       ARG  93  14.403 -12.991  -1.772
   22   HH11  ARG  93          HH11      ARG  93  11.492 -14.518  -0.544
   23   HH12  ARG  93          HH12      ARG  93  11.822 -16.017  -1.367
   24   HH21  ARG  93          HH21      ARG  93  14.765 -14.922  -2.787
   25   HH22  ARG  93          HH22      ARG  93  13.637 -16.231  -2.604
   26    HA   PRO  94           HA       PRO  94  12.322  -7.174  -6.285
   27    HB2  PRO  94           HB2      PRO  94  10.825  -4.879  -6.212
   28    HB3  PRO  94           HB3      PRO  94  10.207  -6.438  -6.847
   29    HG2  PRO  94           HG2      PRO  94   9.824  -5.279  -4.065
   30    HG3  PRO  94           HG3      PRO  94   8.577  -5.940  -5.170
   31    HD2  PRO  94           HD2      PRO  94   9.674  -7.444  -3.186
   32    HD3  PRO  94           HD3      PRO  94   9.273  -8.157  -4.780
   33    H    ALA  95           H        ALA  95  13.634  -5.286  -6.580
   34    HA   ALA  95           HA       ALA  95  14.443  -3.654  -4.264
   35    HB1  ALA  95           HB1      ALA  95  16.797  -4.424  -4.399
   36    HB2  ALA  95           HB2      ALA  95  15.714  -5.750  -3.965
   37    HB3  ALA  95           HB3      ALA  95  16.338  -5.632  -5.620
   38    H    LYS  96           H        LYS  96  16.275  -2.179  -4.885
   39    HA   LYS  96           HA       LYS  96  16.217  -1.326  -7.733
   40    HB2  LYS  96           HB2      LYS  96  14.689   0.009  -6.329
   41    HB3  LYS  96           HB3      LYS  96  16.035   0.466  -5.280
   42    HG2  LYS  96           HG2      LYS  96  17.053   1.783  -7.035
   43    HG3  LYS  96           HG3      LYS  96  16.018   1.051  -8.271
   44    HD2  LYS  96           HD2      LYS  96  15.276   3.325  -7.798
   45    HD3  LYS  96           HD3      LYS  96  14.039   2.165  -7.322
   46    HE2  LYS  96           HE2      LYS  96  14.883   2.363  -4.939
   47    HE3  LYS  96           HE3      LYS  96  16.010   3.610  -5.489
   48    HZ1  LYS  96           HZ1      LYS  96  13.983   4.592  -4.588
   49    HZ2  LYS  96           HZ2      LYS  96  14.077   4.959  -6.176
   50    HZ3  LYS  96           HZ3      LYS  96  13.037   3.796  -5.654
   51    H    TYR  97           H        TYR  97  18.188  -1.891  -4.912
   52    HA   TYR  97           HA       TYR  97  20.588  -1.326  -6.585
   53    HB2  TYR  97           HB2      TYR  97  20.512  -0.758  -3.616
   54    HB3  TYR  97           HB3      TYR  97  21.734  -0.281  -4.769
   55    HD1  TYR  97           HD1      TYR  97  18.344   0.404  -3.446
   56    HD2  TYR  97           HD2      TYR  97  21.505   1.821  -6.025
   57    HE1  TYR  97           HE1      TYR  97  17.245   2.630  -3.584
   58    HE2  TYR  97           HE2      TYR  97  20.387   4.045  -6.158
   59    HH   TYR  97           HH       TYR  97  18.581   5.347  -5.466
   60    H    SER  98           H        SER  98  22.490  -2.563  -5.949
   61    HA   SER  98           HA       SER  98  22.128  -4.914  -4.162
   62    HB2  SER  98           HB2      SER  98  21.394  -5.559  -6.468
   63    HB3  SER  98           HB3      SER  98  22.998  -5.090  -7.071
   64    HG   SER  98           HG       SER  98  22.874  -7.351  -6.615
   65    H    TYR  99           H        TYR  99  24.065  -5.753  -3.383
   66    HA   TYR  99           HA       TYR  99  26.610  -4.523  -4.253
   67    HB2  TYR  99           HB2      TYR  99  27.285  -3.884  -2.025
   68    HB3  TYR  99           HB3      TYR  99  25.845  -3.040  -2.537
   69    HD1  TYR  99           HD2      TYR  99  23.610  -3.597  -1.556
   70    HD2  TYR  99           HD1      TYR  99  27.274  -5.311  -0.064
   71    HE1  TYR  99           HE2      TYR  99  22.530  -3.970   0.659
   72    HE2  TYR  99           HE1      TYR  99  26.187  -5.695   2.152
   73    HH   TYR  99           HH       TYR  99  22.807  -4.736   2.831
   74    H    VAL 100           H        VAL 100  28.519  -5.377  -3.244
   75    HA   VAL 100           HA       VAL 100  28.436  -8.363  -3.309
   76    HB   VAL 100           HB       VAL 100  30.202  -6.288  -4.644
   77   HG11  VAL 100          HG11      VAL 100  31.823  -7.929  -3.876
   78   HG12  VAL 100          HG12      VAL 100  30.835  -9.259  -4.508
   79   HG13  VAL 100          HG13      VAL 100  31.582  -8.092  -5.611
   80   HG21  VAL 100          HG21      VAL 100  28.733  -8.693  -5.790
   81   HG22  VAL 100          HG22      VAL 100  28.095  -7.035  -5.805
   82   HG23  VAL 100          HG23      VAL 100  29.567  -7.419  -6.702
   83    H    ASP 101           H        ASP 101  30.012  -9.492  -2.236
   84    HA   ASP 101           HA       ASP 101  31.977  -8.206  -0.493
   85    HB2  ASP 101           HB2      ASP 101  29.730  -8.438   0.801
   86    HB3  ASP 101           HB3      ASP 101  30.038 -10.174   0.759
   87    H    GLU 102           H        GLU 102  32.715 -10.671   0.895
   88    HA   GLU 102           HA       GLU 102  34.292 -11.957  -1.126
   89    HB2  GLU 102           HB2      GLU 102  33.563 -12.836   1.702
   90    HB3  GLU 102           HB3      GLU 102  34.774 -13.617   0.681
   91    HG2  GLU 102           HG2      GLU 102  36.013 -11.442   0.528
   92    HG3  GLU 102           HG3      GLU 102  34.864 -10.737   1.666
   93    H    ASN 103           H        ASN 103  31.003 -12.582  -0.160
   94    HA   ASN 103           HA       ASN 103  30.782 -15.266  -1.174
   95    HB2  ASN 103           HB2      ASN 103  28.490 -13.287  -1.069
   96    HB3  ASN 103           HB3      ASN 103  28.454 -15.014  -0.793
   97   HD21  ASN 103          HD22      ASN 103  28.415 -11.985   0.682
   98   HD22  ASN 103          HD21      ASN 103  28.756 -12.534   2.324
   99    H    GLY 104           H        GLY 104  31.122 -12.254  -2.793
  100    HA2  GLY 104           HA2      GLY 104  31.069 -11.838  -5.150
  101    HA3  GLY 104           HA3      GLY 104  29.996 -13.237  -5.389
  102    H    GLU 105           H        GLU 105  28.125 -12.156  -6.240
  103    HA   GLU 105           HA       GLU 105  26.924  -9.792  -5.178
  104    HB2  GLU 105           HB2      GLU 105  25.585 -12.226  -6.412
  105    HB3  GLU 105           HB3      GLU 105  24.797 -10.684  -6.012
  106    HG2  GLU 105           HG2      GLU 105  26.295  -9.488  -7.562
  107    HG3  GLU 105           HG3      GLU 105  27.123 -10.995  -7.965
  108    H    THR 106           H        THR 106  25.993  -9.370  -3.293
  109    HA   THR 106           HA       THR 106  25.741 -11.614  -1.369
  110    HB   THR 106           HB       THR 106  27.056  -8.942  -1.182
  111    HG1  THR 106           HG1      THR 106  28.195 -10.833  -1.713
  112   HG21  THR 106          HG21      THR 106  26.093 -10.549   1.200
  113   HG22  THR 106          HG22      THR 106  27.417  -9.350   1.243
  114   HG23  THR 106          HG23      THR 106  25.791  -8.821   0.830
  115    H    LYS 107           H        LYS 107  24.488  -8.228  -1.708
  116    HA   LYS 107           HA       LYS 107  21.833  -9.123  -0.690
  117    HB2  LYS 107           HB2      LYS 107  23.765  -7.315   0.788
  118    HB3  LYS 107           HB3      LYS 107  22.026  -7.104   0.994
  119    HG2  LYS 107           HG2      LYS 107  21.826  -9.471   1.727
  120    HG3  LYS 107           HG3      LYS 107  23.587  -9.644   1.615
  121    HD2  LYS 107           HD2      LYS 107  23.890  -7.855   3.288
  122    HD3  LYS 107           HD3      LYS 107  22.125  -7.663   3.411
  123    HE2  LYS 107           HE2      LYS 107  21.923 -10.033   4.146
  124    HE3  LYS 107           HE3      LYS 107  23.682 -10.215   4.039
  125    HZ1  LYS 107           HZ1      LYS 107  22.273  -8.334   5.879
  126    HZ2  LYS 107           HZ2      LYS 107  22.978  -9.741   6.316
  127    HZ3  LYS 107           HZ3      LYS 107  23.900  -8.507   5.778
  128    H    THR 108           H        THR 108  20.242  -7.391  -0.653
  129    HA   THR 108           HA       THR 108  20.641  -5.304  -2.746
  130    HB   THR 108           HB       THR 108  18.411  -5.870  -3.633
  131    HG1  THR 108           HG1      THR 108  17.513  -7.906  -3.000
  132   HG21  THR 108          HG21      THR 108  20.440  -6.869  -4.678
  133   HG22  THR 108          HG22      THR 108  20.230  -8.313  -3.665
  134   HG23  THR 108          HG23      THR 108  18.997  -7.870  -4.869
  135    H    TRP 109           H        TRP 109  18.931  -3.683  -2.833
  136    HA   TRP 109           HA       TRP 109  17.545  -3.099  -0.271
  137    HB2  TRP 109           HB2      TRP 109  19.878  -2.324  -0.023
  138    HB3  TRP 109           HB3      TRP 109  19.755  -1.420  -1.517
  139    HD1  TRP 109           HD1      TRP 109  17.474  -1.422   1.641
  140    HE1  TRP 109           HE1      TRP 109  17.248   0.985   2.502
  141    HE3  TRP 109           HE3      TRP 109  20.585   0.952  -1.693
  142    HZ2  TRP 109           HZ2      TRP 109  18.405   3.554   1.954
  143    HZ3  TRP 109           HZ3      TRP 109  21.040   3.370  -1.453
  144    HH2  TRP 109           HH2      TRP 109  19.975   4.684   0.365
  145    H    THR 110           H        THR 110  16.047  -1.340  -0.398
  146    HA   THR 110           HA       THR 110  14.901  -0.909  -3.119
  147    HB   THR 110           HB       THR 110  12.848  -0.360  -1.815
  148    HG1  THR 110           HG1      THR 110  12.982  -0.828   0.469
  149   HG21  THR 110          HG21      THR 110  14.078  -3.008  -0.916
  150   HG22  THR 110          HG22      THR 110  12.353  -2.585  -0.939
  151   HG23  THR 110          HG23      THR 110  13.242  -2.728  -2.462
  152    H    GLY 111           H        GLY 111  16.523   0.880  -0.625
  153    HA2  GLY 111           HA2      GLY 111  17.100   3.230  -0.890
  154    HA3  GLY 111           HA3      GLY 111  15.560   3.508  -1.689
  155    H    GLN 112           H        GLN 112  14.486   1.544   0.658
  156    HA   GLN 112           HA       GLN 112  13.541   3.679   2.353
  157    HB2  GLN 112           HB2      GLN 112  12.214   1.685   1.717
  158    HB3  GLN 112           HB3      GLN 112  13.363   0.643   2.560
  159    HG2  GLN 112           HG2      GLN 112  11.361   0.944   3.885
  160    HG3  GLN 112           HG3      GLN 112  12.739   1.642   4.718
  161   HE21  GLN 112          HE22      GLN 112   9.578   2.320   3.337
  162   HE22  GLN 112          HE21      GLN 112   9.583   4.031   3.738
  163    H    GLY 113           H        GLY 113  14.065   4.149   4.493
  164    HA2  GLY 113           HA2      GLY 113  15.330   4.289   6.430
  165    HA3  GLY 113           HA3      GLY 113  15.894   2.646   6.135
  166    H    ARG 114           H        ARG 114  17.867   3.582   7.124
  167    HA   ARG 114           HA       ARG 114  19.551   5.470   5.683
  168    HB2  ARG 114           HB2      ARG 114  20.195   3.408   7.845
  169    HB3  ARG 114           HB3      ARG 114  21.350   4.589   7.205
  170    HG2  ARG 114           HG2      ARG 114  19.878   6.450   7.940
  171    HG3  ARG 114           HG3      ARG 114  18.745   5.280   8.640
  172    HD2  ARG 114           HD2      ARG 114  20.536   4.448  10.155
  173    HD3  ARG 114           HD3      ARG 114  21.667   5.593   9.436
  174    HE   ARG 114           HE       ARG 114  20.650   7.382  10.541
  175   HH11  ARG 114          HH11      ARG 114  18.756   4.503  11.241
  176   HH12  ARG 114          HH12      ARG 114  17.874   5.297  12.515
  177   HH21  ARG 114          HH21      ARG 114  19.498   8.313  12.180
  178   HH22  ARG 114          HH22      ARG 114  18.292   7.395  13.033
  179    H    THR 115           H        THR 115  21.393   5.114   4.472
  180    HA   THR 115           HA       THR 115  21.388   3.167   2.492
  181    HB   THR 115           HB       THR 115  23.814   4.670   3.530
  182    HG1  THR 115           HG1      THR 115  23.130   6.281   2.105
  183   HG21  THR 115          HG21      THR 115  23.120   3.606   0.750
  184   HG22  THR 115          HG22      THR 115  24.530   4.612   1.155
  185   HG23  THR 115          HG23      THR 115  24.401   2.989   1.823
  186    HA   PRO 116           HA       PRO 116  23.019  -0.570   4.482
  187    HB2  PRO 116           HB2      PRO 116  24.060  -1.037   1.672
  188    HB3  PRO 116           HB3      PRO 116  23.262  -2.191   2.788
  189    HG2  PRO 116           HG2      PRO 116  21.861  -1.042   0.783
  190    HG3  PRO 116           HG3      PRO 116  21.127  -1.196   2.418
  191    HD2  PRO 116           HD2      PRO 116  22.376   1.239   1.140
  192    HD3  PRO 116           HD3      PRO 116  20.910   1.103   2.159
  193    H    ALA 117           H        ALA 117  24.989  -1.274   5.341
  194    HA   ALA 117           HA       ALA 117  26.934   0.648   5.735
  195    HB1  ALA 117           HB1      ALA 117  28.212  -1.150   6.851
  196    HB2  ALA 117           HB2      ALA 117  26.483  -1.234   7.241
  197    HB3  ALA 117           HB3      ALA 117  27.185  -2.374   6.069
  198    H    VAL 118           H        VAL 118  27.295  -2.135   3.460
  199    HA   VAL 118           HA       VAL 118  29.950  -1.456   2.666
  200    HB   VAL 118           HB       VAL 118  27.802  -2.936   1.092
  201   HG11  VAL 118          HG11      VAL 118  29.611  -2.269  -0.439
  202   HG12  VAL 118          HG12      VAL 118  30.828  -2.896   0.699
  203   HG13  VAL 118          HG13      VAL 118  29.705  -3.998  -0.115
  204   HG21  VAL 118          HG21      VAL 118  28.291  -4.042   3.243
  205   HG22  VAL 118          HG22      VAL 118  28.973  -4.978   1.916
  206   HG23  VAL 118          HG23      VAL 118  30.031  -3.957   2.908
  207    H    ILE 119           H        ILE 119  26.812  -0.445   1.323
  208    HA   ILE 119           HA       ILE 119  27.901   1.064  -0.899
  209    HB   ILE 119           HB       ILE 119  25.202   1.245   0.497
  210   HG12  ILE 119          HG12      ILE 119  26.135  -0.221  -2.006
  211   HG13  ILE 119          HG13      ILE 119  25.604  -0.961  -0.504
  212   HG21  ILE 119          HG21      ILE 119  24.436   2.473  -1.482
  213   HG22  ILE 119          HG22      ILE 119  25.746   3.356  -0.732
  214   HG23  ILE 119          HG23      ILE 119  26.065   2.405  -2.193
  215   HD11  ILE 119          HD11      ILE 119  23.872   0.533  -2.501
  216   HD12  ILE 119          HD12      ILE 119  23.838  -1.183  -2.084
  217   HD13  ILE 119          HD13      ILE 119  23.313   0.022  -0.889
  218    H    LYS 120           H        LYS 120  26.826   2.049   2.416
  219    HA   LYS 120           HA       LYS 120  27.440   4.815   2.050
  220    HB2  LYS 120           HB2      LYS 120  26.710   5.110   4.137
  221    HB3  LYS 120           HB3      LYS 120  26.104   3.473   3.946
  222    HG2  LYS 120           HG2      LYS 120  28.115   2.629   5.206
  223    HG3  LYS 120           HG3      LYS 120  28.651   4.302   5.410
  224    HD2  LYS 120           HD2      LYS 120  26.538   4.829   6.601
  225    HD3  LYS 120           HD3      LYS 120  26.026   3.133   6.441
  226    HE2  LYS 120           HE2      LYS 120  28.029   2.407   7.728
  227    HE3  LYS 120           HE3      LYS 120  28.572   4.086   7.847
  228    HZ1  LYS 120           HZ1      LYS 120  26.558   4.590   9.140
  229    HZ2  LYS 120           HZ2      LYS 120  26.048   3.037   9.042
  230    HZ3  LYS 120           HZ3      LYS 120  27.406   3.407   9.866
  231    H    LYS 121           H        LYS 121  29.496   2.187   3.289
  232    HA   LYS 121           HA       LYS 121  31.784   3.839   3.839
  233    HB2  LYS 121           HB2      LYS 121  31.438   0.857   3.360
  234    HB3  LYS 121           HB3      LYS 121  33.001   1.600   3.747
  235    HG2  LYS 121           HG2      LYS 121  32.211   2.444   5.864
  236    HG3  LYS 121           HG3      LYS 121  30.538   2.064   5.480
  237    HD2  LYS 121           HD2      LYS 121  31.331   0.469   7.059
  238    HD3  LYS 121           HD3      LYS 121  31.027  -0.347   5.524
  239    HE2  LYS 121           HE2      LYS 121  33.462  -0.310   4.998
  240    HE3  LYS 121           HE3      LYS 121  33.782   0.611   6.473
  241    HZ1  LYS 121           HZ1      LYS 121  32.697  -2.169   6.411
  242    HZ2  LYS 121           HZ2      LYS 121  34.229  -1.759   6.798
  243    HZ3  LYS 121           HZ3      LYS 121  33.004  -1.312   7.772
  244    H    ALA 122           H        ALA 122  30.866   2.039   0.850
  245    HA   ALA 122           HA       ALA 122  33.176   2.804  -0.634
  246    HB1  ALA 122           HB1      ALA 122  31.631   1.001  -1.289
  247    HB2  ALA 122           HB2      ALA 122  30.340   2.191  -1.569
  248    HB3  ALA 122           HB3      ALA 122  31.802   2.201  -2.582
  249    H    MET 123           H        MET 123  29.996   4.479  -0.255
  250    HA   MET 123           HA       MET 123  30.564   6.702  -1.932
  251    HB2  MET 123           HB2      MET 123  28.838   6.509   0.559
  252    HB3  MET 123           HB3      MET 123  28.888   7.913  -0.503
  253    HG2  MET 123           HG2      MET 123  28.021   6.639  -2.369
  254    HG3  MET 123           HG3      MET 123  28.166   5.130  -1.487
  255    HE1  MET 123           HE1      MET 123  26.167   8.415  -2.048
  256    HE2  MET 123           HE2      MET 123  24.956   8.393  -0.749
  257    HE3  MET 123           HE3      MET 123  26.661   8.707  -0.362
  258    H    GLU 124           H        GLU 124  31.238   6.303   1.587
  259    HA   GLU 124           HA       GLU 124  32.471   8.872   1.879
  260    HB2  GLU 124           HB2      GLU 124  32.482   6.346   3.564
  261    HB3  GLU 124           HB3      GLU 124  33.311   7.814   4.063
  262    HG2  GLU 124           HG2      GLU 124  30.330   7.709   3.429
  263    HG3  GLU 124           HG3      GLU 124  31.009   7.515   5.040
  264    H    GLU 125           H        GLU 125  33.942   5.643   1.300
  265    HA   GLU 125           HA       GLU 125  36.653   6.822   1.571
  266    HB2  GLU 125           HB2      GLU 125  35.741   3.929   1.408
  267    HB3  GLU 125           HB3      GLU 125  37.393   4.490   1.675
  268    HG2  GLU 125           HG2      GLU 125  36.621   5.698   3.741
  269    HG3  GLU 125           HG3      GLU 125  35.039   4.945   3.556
  270    H    GLN 126           H        GLN 126  34.625   5.771  -1.058
  271    HA   GLN 126           HA       GLN 126  36.975   5.997  -2.918
  272    HB2  GLN 126           HB2      GLN 126  34.454   4.350  -3.332
  273    HB3  GLN 126           HB3      GLN 126  35.833   4.484  -4.429
  274    HG2  GLN 126           HG2      GLN 126  37.295   3.486  -2.661
  275    HG3  GLN 126           HG3      GLN 126  35.873   3.222  -1.649
  276   HE21  GLN 126          HE22      GLN 126  37.665   1.134  -2.633
  277   HE22  GLN 126          HE21      GLN 126  36.676   0.105  -3.661
  278    H    GLY 127           H        GLY 127  34.450   7.809  -1.858
  279    HA2  GLY 127           HA2      GLY 127  33.397   9.675  -2.664
  280    HA3  GLY 127           HA3      GLY 127  34.479   9.630  -4.055
  281    H    LYS 128           H        LYS 128  32.535   6.812  -3.538
  282    HA   LYS 128           HA       LYS 128  31.294   7.051  -6.139
  283    HB2  LYS 128           HB2      LYS 128  31.205   5.014  -3.880
  284    HB3  LYS 128           HB3      LYS 128  30.138   4.846  -5.274
  285    HG2  LYS 128           HG2      LYS 128  32.064   4.937  -6.812
  286    HG3  LYS 128           HG3      LYS 128  33.175   5.028  -5.431
  287    HD2  LYS 128           HD2      LYS 128  32.527   2.824  -4.671
  288    HD3  LYS 128           HD3      LYS 128  31.167   2.764  -5.807
  289    HE2  LYS 128           HE2      LYS 128  32.787   2.898  -7.709
  290    HE3  LYS 128           HE3      LYS 128  34.131   2.819  -6.548
  291    HZ1  LYS 128           HZ1      LYS 128  32.027   0.749  -6.935
  292    HZ2  LYS 128           HZ2      LYS 128  33.577   0.613  -7.450
  293    HZ3  LYS 128           HZ3      LYS 128  33.267   0.632  -5.840
  294    H    GLN 129           H        GLN 129  29.037   6.452  -6.505
  295    HA   GLN 129           HA       GLN 129  27.046   7.759  -4.729
  296    HB2  GLN 129           HB2      GLN 129  26.004   8.690  -6.708
  297    HB3  GLN 129           HB3      GLN 129  27.701   9.197  -6.582
  298    HG2  GLN 129           HG2      GLN 129  28.326   7.531  -8.316
  299    HG3  GLN 129           HG3      GLN 129  26.638   7.065  -8.486
  300   HE21  GLN 129          HE22      GLN 129  28.094   7.958 -10.714
  301   HE22  GLN 129          HE21      GLN 129  27.455   9.526 -11.179
  302    H    LEU 130           H        LEU 130  24.763   6.987  -5.246
  303    HA   LEU 130           HA       LEU 130  24.680   4.171  -4.910
  304    HB2  LEU 130           HB2      LEU 130  22.399   5.984  -5.784
  305    HB3  LEU 130           HB3      LEU 130  22.272   4.357  -5.098
  306    HG   LEU 130           HG       LEU 130  23.154   6.840  -3.638
  307   HD11  LEU 130          HD11      LEU 130  20.732   6.649  -4.034
  308   HD12  LEU 130          HD12      LEU 130  20.736   5.032  -3.290
  309   HD13  LEU 130          HD13      LEU 130  21.130   6.460  -2.311
  310   HD21  LEU 130          HD21      LEU 130  23.170   5.360  -1.608
  311   HD22  LEU 130          HD22      LEU 130  22.978   3.952  -2.675
  312   HD23  LEU 130          HD23      LEU 130  24.441   4.954  -2.765
  313    H    GLU 131           H        GLU 131  24.520   5.997  -7.889
  314    HA   GLU 131           HA       GLU 131  23.378   3.980  -9.560
  315    HB2  GLU 131           HB2      GLU 131  25.415   6.128 -10.273
  316    HB3  GLU 131           HB3      GLU 131  24.561   5.111 -11.434
  317    HG2  GLU 131           HG2      GLU 131  22.380   5.965 -10.531
  318    HG3  GLU 131           HG3      GLU 131  23.281   7.095  -9.520
  319    H    ASP 132           H        ASP 132  26.613   4.068  -8.126
  320    HA   ASP 132           HA       ASP 132  27.742   2.079  -9.881
  321    HB2  ASP 132           HB2      ASP 132  29.037   3.570  -8.286
  322    HB3  ASP 132           HB3      ASP 132  28.484   2.529  -6.976
  323    H    PHE 133           H        PHE 133  25.309   1.874  -7.495
  324    HA   PHE 133           HA       PHE 133  25.513  -1.100  -7.203
  325    HB2  PHE 133           HB2      PHE 133  24.407   0.984  -5.283
  326    HB3  PHE 133           HB3      PHE 133  24.464  -0.749  -5.006
  327    HD1  PHE 133           HD1      PHE 133  26.677  -1.925  -4.730
  328    HD2  PHE 133           HD2      PHE 133  26.383   2.374  -4.931
  329    HE1  PHE 133           HE1      PHE 133  28.940  -1.722  -3.732
  330    HE2  PHE 133           HE2      PHE 133  28.637   2.573  -3.923
  331    HZ   PHE 133           HZ       PHE 133  29.923   0.515  -3.332
  332    H    LEU 134           H        LEU 134  23.463   1.544  -8.196
  333    HA   LEU 134           HA       LEU 134  20.874   0.532  -8.094
  334    HB2  LEU 134           HB2      LEU 134  21.627   2.810  -8.783
  335    HB3  LEU 134           HB3      LEU 134  22.322   2.117 -10.255
  336    HG   LEU 134           HG       LEU 134  19.944   1.402 -10.894
  337   HD11  LEU 134          HD11      LEU 134  19.025   1.734  -8.530
  338   HD12  LEU 134          HD12      LEU 134  19.180   3.466  -8.792
  339   HD13  LEU 134          HD13      LEU 134  18.099   2.503  -9.816
  340   HD21  LEU 134          HD21      LEU 134  20.556   4.365 -10.617
  341   HD22  LEU 134          HD22      LEU 134  21.096   3.299 -11.932
  342   HD23  LEU 134          HD23      LEU 134  19.377   3.637 -11.727
  343    H    ILE 135           H        ILE 135  19.650  -0.828  -9.207
  344    HA   ILE 135           HA       ILE 135  20.821  -2.349 -11.517
  345    HB   ILE 135           HB       ILE 135  19.835  -4.357 -10.773
  346   HG12  ILE 135          HG12      ILE 135  18.215  -2.613  -8.977
  347   HG13  ILE 135          HG13      ILE 135  17.778  -4.039  -9.885
  348   HG21  ILE 135          HG21      ILE 135  21.177  -3.108  -8.358
  349   HG22  ILE 135          HG22      ILE 135  21.154  -4.815  -8.850
  350   HG23  ILE 135          HG23      ILE 135  22.023  -3.634  -9.827
  351   HD11  ILE 135          HD11      ILE 135  19.255  -3.985  -7.235
  352   HD12  ILE 135          HD12      ILE 135  17.576  -4.468  -7.512
  353   HD13  ILE 135          HD13      ILE 135  18.891  -5.462  -8.166
  354    H    LYS 136           H        LYS 136  18.306  -0.195 -10.951
  355    HA   LYS 136           HA       LYS 136  16.889  -1.169 -13.409
  356    HB2  LYS 136           HB2      LYS 136  15.552  -0.297 -10.812
  357    HB3  LYS 136           HB3      LYS 136  14.725  -0.446 -12.371
  358    HG2  LYS 136           HG2      LYS 136  15.352  -2.850 -12.466
  359    HG3  LYS 136           HG3      LYS 136  16.099  -2.698 -10.862
  360    HD2  LYS 136           HD2      LYS 136  13.931  -1.977  -9.910
  361    HD3  LYS 136           HD3      LYS 136  13.154  -2.186 -11.483
  362    HE2  LYS 136           HE2      LYS 136  14.551  -4.405  -9.903
  363    HE3  LYS 136           HE3      LYS 136  12.819  -4.075  -9.844
  364    HZ1  LYS 136           HZ1      LYS 136  14.298  -4.908 -12.296
  365    HZ2  LYS 136           HZ2      LYS 136  13.283  -5.841 -11.428
  366    HZ3  LYS 136           HZ3      LYS 136  12.696  -4.563 -12.244
  367    H    GLU 137           H        GLU 137  16.150   1.604 -11.333
  368    HA   GLU 137           HA       GLU 137  17.339   3.591 -13.147
  369    HB2  GLU 137           HB2      GLU 137  15.209   2.940 -14.281
  370    HB3  GLU 137           HB3      GLU 137  14.301   3.358 -12.824
  371    HG2  GLU 137           HG2      GLU 137  14.941   5.700 -13.037
  372    HG3  GLU 137           HG3      GLU 137  16.067   5.325 -14.343
  373    H    LEU 138           H        LEU 138  17.516   5.637 -12.067
  374    HA   LEU 138           HA       LEU 138  17.445   5.408  -9.175
  375    HB2  LEU 138           HB2      LEU 138  19.298   6.399 -10.739
  376    HB3  LEU 138           HB3      LEU 138  18.288   7.836 -10.778
  377    HG   LEU 138           HG       LEU 138  18.470   7.870  -8.199
  378   HD11  LEU 138          HD11      LEU 138  19.158   5.538  -7.805
  379   HD12  LEU 138          HD12      LEU 138  20.651   5.799  -8.738
  380   HD13  LEU 138          HD13      LEU 138  20.384   6.664  -7.214
  381   HD21  LEU 138          HD21      LEU 138  20.758   8.803  -8.236
  382   HD22  LEU 138          HD22      LEU 138  21.014   8.087  -9.845
  383   HD23  LEU 138          HD23      LEU 138  19.795   9.356  -9.618
  384    H    GLU 139           H        GLU 139  14.858   5.374 -10.072
  385    HA   GLU 139           HA       GLU 139  13.420   7.874  -9.919
  386    HB2  GLU 139           HB2      GLU 139  11.434   6.516  -9.740
  387    HB3  GLU 139           HB3      GLU 139  12.472   5.940 -11.037
  388    HG2  GLU 139           HG2      GLU 139  13.249   4.071  -9.606
  389    HG3  GLU 139           HG3      GLU 139  12.240   4.654  -8.282
  Start of MODEL    9
    1    H1   ALA  91           H1       ALA  91   9.247 -14.260  -9.327
    2    H2   ALA  91           H2       ALA  91  10.153 -15.442  -8.644
    3    H3   ALA  91           H3       ALA  91   8.560 -15.321  -8.292
    4    HA   ALA  91           HA       ALA  91   9.871 -14.493  -6.457
    5    HB1  ALA  91           HB1      ALA  91  11.276 -12.493  -6.735
    6    HB2  ALA  91           HB2      ALA  91  11.851 -13.800  -7.771
    7    HB3  ALA  91           HB3      ALA  91  10.922 -12.454  -8.475
    8    H    ALA  92           H        ALA  92   9.157 -12.722  -5.114
    9    HA   ALA  92           HA       ALA  92   6.813 -11.173  -6.149
   10    HB1  ALA  92           HB1      ALA  92   5.514 -11.991  -4.230
   11    HB2  ALA  92           HB2      ALA  92   6.095 -13.351  -5.200
   12    HB3  ALA  92           HB3      ALA  92   6.907 -12.946  -3.669
   13    H    ARG  93           H        ARG  93   9.674 -10.456  -5.178
   14    HA   ARG  93           HA       ARG  93   8.895  -8.193  -3.412
   15    HB2  ARG  93           HB2      ARG  93   9.521 -10.143  -1.979
   16    HB3  ARG  93           HB3      ARG  93  11.139 -10.107  -2.676
   17    HG2  ARG  93           HG2      ARG  93  11.449  -7.785  -1.801
   18    HG3  ARG  93           HG3      ARG  93   9.788  -7.812  -1.171
   19    HD2  ARG  93           HD2      ARG  93  10.374  -9.743   0.273
   20    HD3  ARG  93           HD3      ARG  93  12.049  -9.669  -0.323
   21    HE   ARG  93           HE       ARG  93  11.395  -7.098   0.655
   22   HH11  ARG  93          HH11      ARG  93  11.814 -10.295   2.036
   23   HH12  ARG  93          HH12      ARG  93  12.273  -9.664   3.594
   24   HH21  ARG  93          HH21      ARG  93  11.956  -6.357   2.688
   25   HH22  ARG  93          HH22      ARG  93  12.350  -7.492   3.946
   26    HA   PRO  94           HA       PRO  94  11.552  -6.831  -6.955
   27    HB2  PRO  94           HB2      PRO  94  10.019  -4.337  -6.207
   28    HB3  PRO  94           HB3      PRO  94  10.478  -4.934  -7.834
   29    HG2  PRO  94           HG2      PRO  94   7.956  -5.284  -6.923
   30    HG3  PRO  94           HG3      PRO  94   8.797  -6.637  -7.755
   31    HD2  PRO  94           HD2      PRO  94   8.450  -6.189  -4.778
   32    HD3  PRO  94           HD3      PRO  94   8.230  -7.686  -5.733
   33    H    ALA  95           H        ALA  95  13.192  -5.176  -7.130
   34    HA   ALA  95           HA       ALA  95  14.012  -3.622  -4.767
   35    HB1  ALA  95           HB1      ALA  95  15.053  -5.850  -4.409
   36    HB2  ALA  95           HB2      ALA  95  15.780  -5.777  -6.030
   37    HB3  ALA  95           HB3      ALA  95  16.287  -4.634  -4.775
   38    H    LYS  96           H        LYS  96  16.106  -2.344  -5.372
   39    HA   LYS  96           HA       LYS  96  16.249  -1.739  -8.264
   40    HB2  LYS  96           HB2      LYS  96  14.722  -0.131  -6.888
   41    HB3  LYS  96           HB3      LYS  96  16.234   0.516  -6.251
   42    HG2  LYS  96           HG2      LYS  96  16.904   0.783  -8.793
   43    HG3  LYS  96           HG3      LYS  96  15.189   0.534  -9.101
   44    HD2  LYS  96           HD2      LYS  96  16.488   2.745  -7.474
   45    HD3  LYS  96           HD3      LYS  96  15.718   2.906  -9.053
   46    HE2  LYS  96           HE2      LYS  96  13.514   2.348  -8.063
   47    HE3  LYS  96           HE3      LYS  96  14.261   2.106  -6.477
   48    HZ1  LYS  96           HZ1      LYS  96  14.219   4.701  -7.948
   49    HZ2  LYS  96           HZ2      LYS  96  13.276   4.327  -6.674
   50    HZ3  LYS  96           HZ3      LYS  96  14.891   4.468  -6.469
   51    H    TYR  97           H        TYR  97  17.976  -2.111  -5.303
   52    HA   TYR  97           HA       TYR  97  20.521  -1.382  -6.686
   53    HB2  TYR  97           HB2      TYR  97  20.019  -1.010  -3.736
   54    HB3  TYR  97           HB3      TYR  97  21.328  -0.351  -4.692
   55    HD1  TYR  97           HD2      TYR  97  20.979   1.697  -6.052
   56    HD2  TYR  97           HD1      TYR  97  17.833   0.039  -3.619
   57    HE1  TYR  97           HE2      TYR  97  19.633   3.771  -6.366
   58    HE2  TYR  97           HE1      TYR  97  16.523   2.148  -3.888
   59    HH   TYR  97           HH       TYR  97  17.708   4.927  -5.804
   60    H    SER  98           H        SER  98  22.454  -2.507  -5.749
   61    HA   SER  98           HA       SER  98  22.003  -4.662  -3.820
   62    HB2  SER  98           HB2      SER  98  22.909  -6.449  -5.188
   63    HB3  SER  98           HB3      SER  98  21.497  -5.766  -6.002
   64    HG   SER  98           HG       SER  98  23.353  -6.122  -7.401
   65    H    TYR  99           H        TYR  99  24.011  -5.687  -3.055
   66    HA   TYR  99           HA       TYR  99  26.511  -4.391  -3.894
   67    HB2  TYR  99           HB2      TYR  99  27.212  -3.643  -1.756
   68    HB3  TYR  99           HB3      TYR  99  25.674  -2.928  -2.123
   69    HD1  TYR  99           HD2      TYR  99  23.574  -3.758  -0.982
   70    HD2  TYR  99           HD1      TYR  99  27.519  -5.045   0.192
   71    HE1  TYR  99           HE2      TYR  99  22.718  -4.311   1.290
   72    HE2  TYR  99           HE1      TYR  99  26.669  -5.583   2.467
   73    HH   TYR  99           HH       TYR  99  23.288  -4.982   3.463
   74    H    VAL 100           H        VAL 100  28.382  -5.263  -2.552
   75    HA   VAL 100           HA       VAL 100  28.352  -8.229  -2.861
   76    HB   VAL 100           HB       VAL 100  29.393  -6.632  -4.589
   77   HG11  VAL 100          HG11      VAL 100  31.634  -5.834  -4.232
   78   HG12  VAL 100          HG12      VAL 100  30.595  -5.150  -2.971
   79   HG13  VAL 100          HG13      VAL 100  31.680  -6.504  -2.591
   80   HG21  VAL 100          HG21      VAL 100  31.312  -8.091  -5.046
   81   HG22  VAL 100          HG22      VAL 100  31.069  -8.891  -3.478
   82   HG23  VAL 100          HG23      VAL 100  29.807  -8.950  -4.735
   83    H    ASP 101           H        ASP 101  29.922  -9.477  -1.726
   84    HA   ASP 101           HA       ASP 101  31.552  -8.308   0.391
   85    HB2  ASP 101           HB2      ASP 101  29.203  -8.823   1.361
   86    HB3  ASP 101           HB3      ASP 101  29.640 -10.519   1.174
   87    H    GLU 102           H        GLU 102  32.329 -10.809   1.594
   88    HA   GLU 102           HA       GLU 102  34.402 -11.582  -0.143
   89    HB2  GLU 102           HB2      GLU 102  34.223 -11.716   2.391
   90    HB3  GLU 102           HB3      GLU 102  33.172 -13.114   2.179
   91    HG2  GLU 102           HG2      GLU 102  35.351 -13.899   2.712
   92    HG3  GLU 102           HG3      GLU 102  35.051 -14.311   1.030
   93    H    ASN 103           H        ASN 103  31.222 -13.126   0.353
   94    HA   ASN 103           HA       ASN 103  31.770 -15.532  -1.092
   95    HB2  ASN 103           HB2      ASN 103  29.428 -15.958  -0.808
   96    HB3  ASN 103           HB3      ASN 103  29.948 -15.129   0.652
   97   HD21  ASN 103          HD22      ASN 103  27.910 -14.960  -2.191
   98   HD22  ASN 103          HD21      ASN 103  27.240 -13.365  -1.886
   99    H    GLY 104           H        GLY 104  31.184 -12.348  -2.245
  100    HA2  GLY 104           HA2      GLY 104  31.286 -11.938  -4.719
  101    HA3  GLY 104           HA3      GLY 104  30.088 -13.238  -4.896
  102    H    GLU 105           H        GLU 105  28.487 -11.752  -5.782
  103    HA   GLU 105           HA       GLU 105  27.482  -9.447  -4.475
  104    HB2  GLU 105           HB2      GLU 105  25.391  -9.832  -5.611
  105    HB3  GLU 105           HB3      GLU 105  26.779 -10.000  -6.688
  106    HG2  GLU 105           HG2      GLU 105  26.574 -12.508  -6.486
  107    HG3  GLU 105           HG3      GLU 105  25.110 -12.276  -5.529
  108    H    THR 106           H        THR 106  26.344  -9.078  -2.607
  109    HA   THR 106           HA       THR 106  25.925 -11.477  -0.977
  110    HB   THR 106           HB       THR 106  27.623  -9.958  -0.217
  111    HG1  THR 106           HG1      THR 106  26.983 -10.275   1.912
  112   HG21  THR 106          HG21      THR 106  25.331  -8.121   0.609
  113   HG22  THR 106          HG22      THR 106  27.007  -8.011   1.164
  114   HG23  THR 106          HG23      THR 106  26.644  -7.727  -0.524
  115    H    LYS 107           H        LYS 107  24.251  -8.367  -1.755
  116    HA   LYS 107           HA       LYS 107  21.741  -9.774  -1.774
  117    HB2  LYS 107           HB2      LYS 107  20.541  -8.809   0.055
  118    HB3  LYS 107           HB3      LYS 107  21.957  -9.587   0.707
  119    HG2  LYS 107           HG2      LYS 107  23.101  -7.386   0.891
  120    HG3  LYS 107           HG3      LYS 107  21.657  -6.579   0.273
  121    HD2  LYS 107           HD2      LYS 107  21.780  -8.272   2.808
  122    HD3  LYS 107           HD3      LYS 107  21.841  -6.508   2.754
  123    HE2  LYS 107           HE2      LYS 107  19.582  -6.449   1.698
  124    HE3  LYS 107           HE3      LYS 107  19.494  -8.209   1.789
  125    HZ1  LYS 107           HZ1      LYS 107  19.716  -6.400   4.150
  126    HZ2  LYS 107           HZ2      LYS 107  18.364  -7.181   3.679
  127    HZ3  LYS 107           HZ3      LYS 107  19.644  -8.032   4.228
  128    H    THR 108           H        THR 108  19.810  -8.342  -1.977
  129    HA   THR 108           HA       THR 108  20.329  -5.921  -3.632
  130    HB   THR 108           HB       THR 108  17.924  -6.209  -4.278
  131    HG1  THR 108           HG1      THR 108  17.016  -8.280  -3.802
  132   HG21  THR 108          HG21      THR 108  18.264  -8.128  -5.773
  133   HG22  THR 108          HG22      THR 108  19.692  -7.092  -5.739
  134   HG23  THR 108          HG23      THR 108  19.693  -8.630  -4.845
  135    H    TRP 109           H        TRP 109  18.729  -4.139  -3.392
  136    HA   TRP 109           HA       TRP 109  17.448  -3.808  -0.752
  137    HB2  TRP 109           HB2      TRP 109  19.762  -3.094  -0.386
  138    HB3  TRP 109           HB3      TRP 109  19.698  -2.032  -1.775
  139    HD1  TRP 109           HD1      TRP 109  17.467  -2.389   1.401
  140    HE1  TRP 109           HE1      TRP 109  17.112  -0.059   2.439
  141    HE3  TRP 109           HE3      TRP 109  20.364   0.419  -1.790
  142    HZ2  TRP 109           HZ2      TRP 109  18.096   2.595   2.075
  143    HZ3  TRP 109           HZ3      TRP 109  20.664   2.848  -1.363
  144    HH2  TRP 109           HH2      TRP 109  19.553   3.946   0.549
  145    H    THR 110           H        THR 110  16.063  -1.932  -0.641
  146    HA   THR 110           HA       THR 110  14.733  -1.412  -3.272
  147    HB   THR 110           HB       THR 110  12.713  -1.043  -1.907
  148    HG1  THR 110           HG1      THR 110  14.066  -1.994   0.379
  149   HG21  THR 110          HG21      THR 110  13.165  -3.358  -2.620
  150   HG22  THR 110          HG22      THR 110  14.091  -3.654  -1.139
  151   HG23  THR 110          HG23      THR 110  12.351  -3.301  -1.050
  152    H    GLY 111           H        GLY 111  16.513   0.309  -0.892
  153    HA2  GLY 111           HA2      GLY 111  16.977   2.648  -0.977
  154    HA3  GLY 111           HA3      GLY 111  15.442   2.947  -1.780
  155    H    GLN 112           H        GLN 112  14.461   0.850   0.529
  156    HA   GLN 112           HA       GLN 112  13.445   2.931   2.310
  157    HB2  GLN 112           HB2      GLN 112  13.259  -0.108   2.370
  158    HB3  GLN 112           HB3      GLN 112  12.409   0.976   3.474
  159    HG2  GLN 112           HG2      GLN 112  11.170   2.000   1.630
  160    HG3  GLN 112           HG3      GLN 112  12.058   1.041   0.438
  161   HE21  GLN 112          HE22      GLN 112  11.819  -1.352   0.547
  162   HE22  GLN 112          HE21      GLN 112  10.265  -1.996   1.101
  163    H    GLY 113           H        GLY 113  13.979   3.324   4.447
  164    HA2  GLY 113           HA2      GLY 113  15.215   3.312   6.423
  165    HA3  GLY 113           HA3      GLY 113  15.928   1.775   5.963
  166    H    ARG 114           H        ARG 114  17.801   2.908   7.027
  167    HA   ARG 114           HA       ARG 114  19.252   5.021   5.615
  168    HB2  ARG 114           HB2      ARG 114  20.285   2.986   7.645
  169    HB3  ARG 114           HB3      ARG 114  21.094   4.461   7.144
  170    HG2  ARG 114           HG2      ARG 114  18.531   4.228   8.774
  171    HG3  ARG 114           HG3      ARG 114  20.096   4.790   9.333
  172    HD2  ARG 114           HD2      ARG 114  18.296   6.204   7.324
  173    HD3  ARG 114           HD3      ARG 114  18.508   6.636   9.025
  174    HE   ARG 114           HE       ARG 114  21.088   6.708   8.018
  175   HH11  ARG 114          HH11      ARG 114  18.135   8.439   7.264
  176   HH12  ARG 114          HH12      ARG 114  18.994   9.844   6.701
  177   HH21  ARG 114          HH21      ARG 114  22.122   8.533   7.267
  178   HH22  ARG 114          HH22      ARG 114  21.196   9.891   6.715
  179    H    THR 115           H        THR 115  21.146   4.859   4.406
  180    HA   THR 115           HA       THR 115  21.302   2.958   2.380
  181    HB   THR 115           HB       THR 115  23.597   4.623   3.470
  182    HG1  THR 115           HG1      THR 115  22.818   6.176   2.029
  183   HG21  THR 115          HG21      THR 115  24.367   3.009   1.788
  184   HG22  THR 115          HG22      THR 115  23.055   3.499   0.682
  185   HG23  THR 115          HG23      THR 115  24.357   4.632   1.105
  186    HA   PRO 116           HA       PRO 116  23.101  -0.678   4.344
  187    HB2  PRO 116           HB2      PRO 116  24.179  -1.094   1.547
  188    HB3  PRO 116           HB3      PRO 116  23.444  -2.283   2.673
  189    HG2  PRO 116           HG2      PRO 116  21.960  -1.222   0.669
  190    HG3  PRO 116           HG3      PRO 116  21.260  -1.396   2.308
  191    HD2  PRO 116           HD2      PRO 116  22.380   1.093   1.004
  192    HD3  PRO 116           HD3      PRO 116  20.929   0.889   2.030
  193    H    ALA 117           H        ALA 117  25.063  -1.307   5.221
  194    HA   ALA 117           HA       ALA 117  26.909   0.676   5.700
  195    HB1  ALA 117           HB1      ALA 117  27.288  -2.338   5.988
  196    HB2  ALA 117           HB2      ALA 117  28.228  -1.085   6.826
  197    HB3  ALA 117           HB3      ALA 117  26.494  -1.255   7.153
  198    H    VAL 118           H        VAL 118  27.465  -2.034   3.362
  199    HA   VAL 118           HA       VAL 118  30.115  -1.178   2.690
  200    HB   VAL 118           HB       VAL 118  28.170  -2.827   1.035
  201   HG11  VAL 118          HG11      VAL 118  30.201  -3.771  -0.044
  202   HG12  VAL 118          HG12      VAL 118  30.011  -2.052  -0.395
  203   HG13  VAL 118          HG13      VAL 118  31.202  -2.583   0.818
  204   HG21  VAL 118          HG21      VAL 118  30.357  -3.678   2.989
  205   HG22  VAL 118          HG22      VAL 118  28.607  -3.882   3.228
  206   HG23  VAL 118          HG23      VAL 118  29.429  -4.778   1.951
  207    H    ILE 119           H        ILE 119  26.958  -0.377   1.237
  208    HA   ILE 119           HA       ILE 119  27.993   1.174  -0.974
  209    HB   ILE 119           HB       ILE 119  25.308   1.295   0.459
  210   HG12  ILE 119          HG12      ILE 119  26.227  -0.142  -2.071
  211   HG13  ILE 119          HG13      ILE 119  25.744  -0.894  -0.555
  212   HG21  ILE 119          HG21      ILE 119  25.782   3.419  -0.741
  213   HG22  ILE 119          HG22      ILE 119  26.126   2.502  -2.221
  214   HG23  ILE 119          HG23      ILE 119  24.494   2.521  -1.512
  215   HD11  ILE 119          HD11      ILE 119  23.422   0.042  -0.884
  216   HD12  ILE 119          HD12      ILE 119  23.930   0.563  -2.508
  217   HD13  ILE 119          HD13      ILE 119  23.939  -1.153  -2.085
  218    H    LYS 120           H        LYS 120  26.964   2.058   2.339
  219    HA   LYS 120           HA       LYS 120  27.620   4.844   2.243
  220    HB2  LYS 120           HB2      LYS 120  26.232   3.926   3.972
  221    HB3  LYS 120           HB3      LYS 120  27.459   2.781   4.475
  222    HG2  LYS 120           HG2      LYS 120  27.194   4.564   6.077
  223    HG3  LYS 120           HG3      LYS 120  28.835   4.507   5.433
  224    HD2  LYS 120           HD2      LYS 120  28.515   6.521   4.165
  225    HD3  LYS 120           HD3      LYS 120  26.759   6.400   4.268
  226    HE2  LYS 120           HE2      LYS 120  27.628   8.210   5.667
  227    HE3  LYS 120           HE3      LYS 120  26.753   7.005   6.609
  228    HZ1  LYS 120           HZ1      LYS 120  29.741   7.085   6.406
  229    HZ2  LYS 120           HZ2      LYS 120  28.882   7.743   7.636
  230    HZ3  LYS 120           HZ3      LYS 120  28.855   6.131   7.405
  231    H    LYS 121           H        LYS 121  29.675   2.035   3.143
  232    HA   LYS 121           HA       LYS 121  32.018   3.561   3.683
  233    HB2  LYS 121           HB2      LYS 121  31.344   0.815   3.754
  234    HB3  LYS 121           HB3      LYS 121  32.618   0.913   2.550
  235    HG2  LYS 121           HG2      LYS 121  33.694   0.548   4.636
  236    HG3  LYS 121           HG3      LYS 121  33.974   2.250   4.237
  237    HD2  LYS 121           HD2      LYS 121  32.034   2.856   5.787
  238    HD3  LYS 121           HD3      LYS 121  31.867   1.137   6.157
  239    HE2  LYS 121           HE2      LYS 121  33.068   2.130   7.953
  240    HE3  LYS 121           HE3      LYS 121  34.212   1.134   7.052
  241    HZ1  LYS 121           HZ1      LYS 121  35.122   3.126   6.041
  242    HZ2  LYS 121           HZ2      LYS 121  33.952   4.090   6.696
  243    HZ3  LYS 121           HZ3      LYS 121  35.073   3.374   7.652
  244    H    ALA 122           H        ALA 122  30.916   2.142   0.608
  245    HA   ALA 122           HA       ALA 122  33.131   3.031  -0.959
  246    HB1  ALA 122           HB1      ALA 122  31.530   1.296  -1.649
  247    HB2  ALA 122           HB2      ALA 122  30.237   2.511  -1.764
  248    HB3  ALA 122           HB3      ALA 122  31.633   2.595  -2.854
  249    H    MET 123           H        MET 123  30.058   4.716  -0.118
  250    HA   MET 123           HA       MET 123  30.494   7.041  -1.698
  251    HB2  MET 123           HB2      MET 123  28.995   6.640   0.910
  252    HB3  MET 123           HB3      MET 123  29.002   8.161   0.024
  253    HG2  MET 123           HG2      MET 123  27.946   7.200  -1.880
  254    HG3  MET 123           HG3      MET 123  28.151   5.555  -1.281
  255    HE1  MET 123           HE1      MET 123  24.255   6.185  -1.335
  256    HE2  MET 123           HE2      MET 123  25.388   7.078  -2.377
  257    HE3  MET 123           HE3      MET 123  25.619   5.339  -2.101
  258    H    GLU 124           H        GLU 124  31.778   6.261   1.559
  259    HA   GLU 124           HA       GLU 124  33.034   8.906   1.691
  260    HB2  GLU 124           HB2      GLU 124  33.396   8.484   4.016
  261    HB3  GLU 124           HB3      GLU 124  31.726   8.129   3.560
  262    HG2  GLU 124           HG2      GLU 124  32.318   5.696   3.477
  263    HG3  GLU 124           HG3      GLU 124  33.945   6.096   3.996
  264    H    GLU 125           H        GLU 125  34.221   5.579   1.242
  265    HA   GLU 125           HA       GLU 125  37.035   6.614   1.307
  266    HB2  GLU 125           HB2      GLU 125  35.871   3.828   1.592
  267    HB3  GLU 125           HB3      GLU 125  37.594   4.146   1.359
  268    HG2  GLU 125           HG2      GLU 125  37.629   5.589   3.368
  269    HG3  GLU 125           HG3      GLU 125  35.920   5.251   3.639
  270    H    GLN 126           H        GLN 126  34.700   5.494  -1.037
  271    HA   GLN 126           HA       GLN 126  36.879   5.538  -3.107
  272    HB2  GLN 126           HB2      GLN 126  34.203   4.110  -3.276
  273    HB3  GLN 126           HB3      GLN 126  35.461   4.154  -4.511
  274    HG2  GLN 126           HG2      GLN 126  37.028   3.018  -2.926
  275    HG3  GLN 126           HG3      GLN 126  35.711   2.877  -1.753
  276   HE21  GLN 126          HE22      GLN 126  36.861   0.536  -2.396
  277   HE22  GLN 126          HE21      GLN 126  35.838  -0.371  -3.503
  278    H    GLY 127           H        GLY 127  34.535   7.493  -1.832
  279    HA2  GLY 127           HA2      GLY 127  33.511   9.423  -2.516
  280    HA3  GLY 127           HA3      GLY 127  34.600   9.426  -3.909
  281    H    LYS 128           H        LYS 128  32.457   6.694  -3.510
  282    HA   LYS 128           HA       LYS 128  31.324   7.139  -6.156
  283    HB2  LYS 128           HB2      LYS 128  31.097   4.955  -4.049
  284    HB3  LYS 128           HB3      LYS 128  30.040   4.950  -5.461
  285    HG2  LYS 128           HG2      LYS 128  31.991   5.063  -6.971
  286    HG3  LYS 128           HG3      LYS 128  33.086   4.979  -5.576
  287    HD2  LYS 128           HD2      LYS 128  32.297   2.763  -5.003
  288    HD3  LYS 128           HD3      LYS 128  30.964   2.872  -6.169
  289    HE2  LYS 128           HE2      LYS 128  32.614   3.023  -8.025
  290    HE3  LYS 128           HE3      LYS 128  33.945   2.855  -6.854
  291    HZ1  LYS 128           HZ1      LYS 128  33.361   0.716  -7.868
  292    HZ2  LYS 128           HZ2      LYS 128  33.019   0.660  -6.266
  293    HZ3  LYS 128           HZ3      LYS 128  31.799   0.860  -7.375
  294    H    GLN 129           H        GLN 129  29.082   6.723  -6.654
  295    HA   GLN 129           HA       GLN 129  27.116   8.055  -4.829
  296    HB2  GLN 129           HB2      GLN 129  27.379   8.229  -7.872
  297    HB3  GLN 129           HB3      GLN 129  25.949   8.730  -6.978
  298    HG2  GLN 129           HG2      GLN 129  27.198  10.698  -7.453
  299    HG3  GLN 129           HG3      GLN 129  27.271  10.397  -5.721
  300   HE21  GLN 129          HE21      GLN 129  29.309  11.060  -4.998
  301   HE22  GLN 129          HE22      GLN 129  30.803  10.542  -5.763
  302    H    LEU 130           H        LEU 130  24.876   7.285  -5.186
  303    HA   LEU 130           HA       LEU 130  24.827   4.503  -4.753
  304    HB2  LEU 130           HB2      LEU 130  23.290   6.225  -3.796
  305    HB3  LEU 130           HB3      LEU 130  22.560   6.433  -5.393
  306    HG   LEU 130           HG       LEU 130  21.669   4.152  -5.318
  307   HD11  LEU 130          HD11      LEU 130  21.807   2.746  -3.322
  308   HD12  LEU 130          HD12      LEU 130  23.417   3.011  -3.970
  309   HD13  LEU 130          HD13      LEU 130  22.885   3.931  -2.538
  310   HD21  LEU 130          HD21      LEU 130  21.114   5.686  -2.741
  311   HD22  LEU 130          HD22      LEU 130  20.340   5.970  -4.315
  312   HD23  LEU 130          HD23      LEU 130  20.073   4.440  -3.459
  313    H    GLU 131           H        GLU 131  24.368   6.234  -7.751
  314    HA   GLU 131           HA       GLU 131  23.046   4.191  -9.279
  315    HB2  GLU 131           HB2      GLU 131  24.960   6.400 -10.129
  316    HB3  GLU 131           HB3      GLU 131  24.065   5.371 -11.252
  317    HG2  GLU 131           HG2      GLU 131  21.926   6.137 -10.340
  318    HG3  GLU 131           HG3      GLU 131  22.751   7.149  -9.154
  319    H    ASP 132           H        ASP 132  26.420   4.293  -8.186
  320    HA   ASP 132           HA       ASP 132  27.369   2.322 -10.069
  321    HB2  ASP 132           HB2      ASP 132  28.827   3.795  -8.615
  322    HB3  ASP 132           HB3      ASP 132  28.392   2.766  -7.245
  323    H    PHE 133           H        PHE 133  25.224   2.128  -7.411
  324    HA   PHE 133           HA       PHE 133  25.426  -0.845  -7.161
  325    HB2  PHE 133           HB2      PHE 133  24.459   1.249  -5.182
  326    HB3  PHE 133           HB3      PHE 133  24.495  -0.477  -4.903
  327    HD1  PHE 133           HD1      PHE 133  26.694  -1.705  -4.773
  328    HD2  PHE 133           HD2      PHE 133  26.483   2.598  -4.947
  329    HE1  PHE 133           HE1      PHE 133  29.031  -1.555  -3.947
  330    HE2  PHE 133           HE2      PHE 133  28.813   2.745  -4.112
  331    HZ   PHE 133           HZ       PHE 133  30.096   0.659  -3.631
  332    H    LEU 134           H        LEU 134  23.374   1.758  -8.126
  333    HA   LEU 134           HA       LEU 134  20.806   0.443  -8.000
  334    HB2  LEU 134           HB2      LEU 134  21.429   2.927  -8.259
  335    HB3  LEU 134           HB3      LEU 134  21.711   2.573  -9.965
  336    HG   LEU 134           HG       LEU 134  19.072   2.225  -8.472
  337   HD11  LEU 134          HD11      LEU 134  18.360   4.225  -9.683
  338   HD12  LEU 134          HD12      LEU 134  19.806   4.595  -8.735
  339   HD13  LEU 134          HD13      LEU 134  19.933   4.344 -10.489
  340   HD21  LEU 134          HD21      LEU 134  18.104   2.167 -10.818
  341   HD22  LEU 134          HD22      LEU 134  19.754   1.918 -11.418
  342   HD23  LEU 134          HD23      LEU 134  18.991   0.729 -10.328
  343    H    ILE 135           H        ILE 135  20.120  -1.183  -9.187
  344    HA   ILE 135           HA       ILE 135  21.552  -1.960 -11.703
  345    HB   ILE 135           HB       ILE 135  21.198  -4.358 -10.996
  346   HG12  ILE 135          HG12      ILE 135  21.175  -4.850  -8.598
  347   HG13  ILE 135          HG13      ILE 135  20.839  -3.171  -8.211
  348   HG21  ILE 135          HG21      ILE 135  23.069  -2.638  -9.326
  349   HG22  ILE 135          HG22      ILE 135  23.252  -4.364  -9.684
  350   HG23  ILE 135          HG23      ILE 135  23.363  -3.185 -10.992
  351   HD11  ILE 135          HD11      ILE 135  18.993  -4.995  -9.816
  352   HD12  ILE 135          HD12      ILE 135  18.853  -4.680  -8.076
  353   HD13  ILE 135          HD13      ILE 135  18.609  -3.361  -9.224
  354    H    LYS 136           H        LYS 136  18.369  -1.316 -10.578
  355    HA   LYS 136           HA       LYS 136  16.981  -3.163 -12.300
  356    HB2  LYS 136           HB2      LYS 136  15.946  -2.071 -10.356
  357    HB3  LYS 136           HB3      LYS 136  16.031  -0.494 -11.164
  358    HG2  LYS 136           HG2      LYS 136  14.509  -1.343 -12.944
  359    HG3  LYS 136           HG3      LYS 136  14.481  -2.934 -12.156
  360    HD2  LYS 136           HD2      LYS 136  13.448  -1.899 -10.141
  361    HD3  LYS 136           HD3      LYS 136  13.471  -0.313 -10.956
  362    HE2  LYS 136           HE2      LYS 136  12.061  -1.262 -12.785
  363    HE3  LYS 136           HE3      LYS 136  12.022  -2.815 -11.949
  364    HZ1  LYS 136           HZ1      LYS 136  10.898  -0.262 -10.886
  365    HZ2  LYS 136           HZ2      LYS 136  10.027  -1.505 -11.476
  366    HZ3  LYS 136           HZ3      LYS 136  10.871  -1.694 -10.087
  367    H    GLU 137           H        GLU 137  17.739   0.292 -12.799
  368    HA   GLU 137           HA       GLU 137  17.807  -0.013 -15.731
  369    HB2  GLU 137           HB2      GLU 137  15.369   0.180 -15.127
  370    HB3  GLU 137           HB3      GLU 137  15.702   1.747 -14.385
  371    HG2  GLU 137           HG2      GLU 137  16.485   2.599 -16.602
  372    HG3  GLU 137           HG3      GLU 137  16.145   1.023 -17.315
  373    H    LEU 138           H        LEU 138  19.264   1.407 -16.554
  374    HA   LEU 138           HA       LEU 138  19.746   4.042 -15.268
  375    HB2  LEU 138           HB2      LEU 138  21.833   1.940 -15.976
  376    HB3  LEU 138           HB3      LEU 138  22.241   3.621 -15.680
  377    HG   LEU 138           HG       LEU 138  20.990   1.808 -13.580
  378   HD11  LEU 138          HD11      LEU 138  23.845   2.810 -13.970
  379   HD12  LEU 138          HD12      LEU 138  23.247   1.882 -12.582
  380   HD13  LEU 138          HD13      LEU 138  23.280   1.137 -14.184
  381   HD21  LEU 138          HD21      LEU 138  21.713   3.630 -12.036
  382   HD22  LEU 138          HD22      LEU 138  22.139   4.633 -13.429
  383   HD23  LEU 138          HD23      LEU 138  20.448   4.163 -13.146
  384    H    GLU 139           H        GLU 139  18.325   3.118 -17.698
  385    HA   GLU 139           HA       GLU 139  19.801   3.869 -20.079
  386    HB2  GLU 139           HB2      GLU 139  16.812   3.622 -19.568
  387    HB3  GLU 139           HB3      GLU 139  17.552   3.945 -21.140
  388    HG2  GLU 139           HG2      GLU 139  18.861   1.799 -20.909
  389    HG3  GLU 139           HG3      GLU 139  17.926   1.436 -19.453
  Start of MODEL   10
    1    H1   ALA  91           H1       ALA  91   9.912  -5.842   5.223
    2    H2   ALA  91           H2       ALA  91  10.292  -7.256   5.958
    3    H3   ALA  91           H3       ALA  91  11.435  -6.102   5.766
    4    HA   ALA  91           HA       ALA  91  11.794  -7.863   4.184
    5    HB1  ALA  91           HB1      ALA  91  10.104  -8.354   2.453
    6    HB2  ALA  91           HB2      ALA  91   9.459  -8.666   4.070
    7    HB3  ALA  91           HB3      ALA  91   8.980  -7.195   3.189
    8    H    ALA  92           H        ALA  92  12.527  -7.491   1.969
    9    HA   ALA  92           HA       ALA  92  12.595  -4.616   1.123
   10    HB1  ALA  92           HB1      ALA  92  14.543  -5.194   2.544
   11    HB2  ALA  92           HB2      ALA  92  14.954  -6.524   1.437
   12    HB3  ALA  92           HB3      ALA  92  15.029  -4.836   0.878
   13    H    ARG  93           H        ARG  93  11.233  -7.172   0.016
   14    HA   ARG  93           HA       ARG  93  12.484  -8.045  -2.325
   15    HB2  ARG  93           HB2      ARG  93  10.563  -9.108  -1.199
   16    HB3  ARG  93           HB3      ARG  93   9.486  -7.869  -1.849
   17    HG2  ARG  93           HG2      ARG  93  10.014  -8.605  -4.153
   18    HG3  ARG  93           HG3      ARG  93  11.179  -9.785  -3.515
   19    HD2  ARG  93           HD2      ARG  93   9.340 -10.927  -2.304
   20    HD3  ARG  93           HD3      ARG  93   8.182  -9.743  -2.949
   21    HE   ARG  93           HE       ARG  93   9.588 -10.917  -5.135
   22   HH11  ARG  93          HH11      ARG  93   7.186 -11.913  -2.779
   23   HH12  ARG  93          HH12      ARG  93   6.531 -13.141  -3.828
   24   HH21  ARG  93          HH21      ARG  93   8.687 -12.479  -6.434
   25   HH22  ARG  93          HH22      ARG  93   7.368 -13.448  -5.845
   26    HA   PRO  94           HA       PRO  94  10.588  -4.453  -4.942
   27    HB2  PRO  94           HB2      PRO  94  10.546  -2.302  -2.808
   28    HB3  PRO  94           HB3      PRO  94   9.447  -2.525  -4.205
   29    HG2  PRO  94           HG2      PRO  94   8.651  -3.218  -1.725
   30    HG3  PRO  94           HG3      PRO  94   8.326  -4.334  -3.095
   31    HD2  PRO  94           HD2      PRO  94  10.639  -4.428  -1.122
   32    HD3  PRO  94           HD3      PRO  94   9.522  -5.740  -1.586
   33    H    ALA  95           H        ALA  95  13.235  -5.276  -4.357
   34    HA   ALA  95           HA       ALA  95  15.063  -3.188  -3.757
   35    HB1  ALA  95           HB1      ALA  95  16.769  -4.746  -4.631
   36    HB2  ALA  95           HB2      ALA  95  15.633  -5.550  -3.525
   37    HB3  ALA  95           HB3      ALA  95  15.489  -5.780  -5.289
   38    H    LYS  96           H        LYS  96  16.477  -2.032  -4.987
   39    HA   LYS  96           HA       LYS  96  16.392  -2.112  -7.923
   40    HB2  LYS  96           HB2      LYS  96  14.881  -0.328  -7.467
   41    HB3  LYS  96           HB3      LYS  96  15.932   0.376  -6.236
   42    HG2  LYS  96           HG2      LYS  96  17.452   1.228  -7.825
   43    HG3  LYS  96           HG3      LYS  96  16.875   0.160  -9.104
   44    HD2  LYS  96           HD2      LYS  96  16.250   2.487  -9.493
   45    HD3  LYS  96           HD3      LYS  96  14.879   1.373  -9.407
   46    HE2  LYS  96           HE2      LYS  96  14.357   2.120  -7.121
   47    HE3  LYS  96           HE3      LYS  96  15.750   3.217  -7.129
   48    HZ1  LYS  96           HZ1      LYS  96  14.706   4.506  -8.860
   49    HZ2  LYS  96           HZ2      LYS  96  13.552   3.382  -9.144
   50    HZ3  LYS  96           HZ3      LYS  96  13.536   4.261  -7.742
   51    H    TYR  97           H        TYR  97  18.262  -2.099  -5.108
   52    HA   TYR  97           HA       TYR  97  20.724  -1.433  -6.662
   53    HB2  TYR  97           HB2      TYR  97  20.189  -0.848  -3.732
   54    HB3  TYR  97           HB3      TYR  97  21.616  -0.394  -4.651
   55    HD1  TYR  97           HD1      TYR  97  18.007   0.281  -4.107
   56    HD2  TYR  97           HD2      TYR  97  21.611   1.603  -6.066
   57    HE1  TYR  97           HE1      TYR  97  16.853   2.370  -4.819
   58    HE2  TYR  97           HE2      TYR  97  20.456   3.702  -6.747
   59    HH   TYR  97           HH       TYR  97  18.489   4.930  -6.699
   60    H    SER  98           H        SER  98  22.593  -2.670  -6.149
   61    HA   SER  98           HA       SER  98  22.330  -5.005  -4.313
   62    HB2  SER  98           HB2      SER  98  21.579  -5.697  -6.600
   63    HB3  SER  98           HB3      SER  98  23.157  -5.175  -7.232
   64    HG   SER  98           HG       SER  98  23.343  -7.304  -6.865
   65    H    TYR  99           H        TYR  99  24.233  -5.718  -3.478
   66    HA   TYR  99           HA       TYR  99  26.806  -4.612  -4.445
   67    HB2  TYR  99           HB2      TYR  99  27.455  -3.766  -2.275
   68    HB3  TYR  99           HB3      TYR  99  26.012  -2.973  -2.837
   69    HD1  TYR  99           HD2      TYR  99  23.803  -3.423  -1.774
   70    HD2  TYR  99           HD1      TYR  99  27.438  -5.179  -0.264
   71    HE1  TYR  99           HE2      TYR  99  22.718  -3.751   0.448
   72    HE2  TYR  99           HE1      TYR  99  26.349  -5.535   1.945
   73    HH   TYR  99           HH       TYR  99  22.977  -4.528   2.619
   74    H    VAL 100           H        VAL 100  28.658  -5.440  -3.140
   75    HA   VAL 100           HA       VAL 100  28.481  -8.383  -2.668
   76    HB   VAL 100           HB       VAL 100  29.034  -8.250  -4.923
   77   HG11  VAL 100          HG11      VAL 100  29.479  -5.898  -5.281
   78   HG12  VAL 100          HG12      VAL 100  30.986  -5.992  -4.339
   79   HG13  VAL 100          HG13      VAL 100  30.834  -6.828  -5.900
   80   HG21  VAL 100          HG21      VAL 100  31.241  -9.097  -5.194
   81   HG22  VAL 100          HG22      VAL 100  31.829  -8.293  -3.726
   82   HG23  VAL 100          HG23      VAL 100  30.700  -9.651  -3.605
   83    H    ASP 101           H        ASP 101  30.198  -9.289  -1.472
   84    HA   ASP 101           HA       ASP 101  31.911  -7.345   0.045
   85    HB2  ASP 101           HB2      ASP 101  30.118  -8.236   1.443
   86    HB3  ASP 101           HB3      ASP 101  30.617  -9.891   1.071
   87    H    GLU 102           H        GLU 102  31.802 -10.870  -0.869
   88    HA   GLU 102           HA       GLU 102  34.544 -10.549  -1.973
   89    HB2  GLU 102           HB2      GLU 102  33.822 -12.650   0.111
   90    HB3  GLU 102           HB3      GLU 102  35.229 -12.744  -0.941
   91    HG2  GLU 102           HG2      GLU 102  36.016 -10.540  -0.007
   92    HG3  GLU 102           HG3      GLU 102  34.709 -10.633   1.182
   93    H    ASN 103           H        ASN 103  32.139 -13.208  -1.423
   94    HA   ASN 103           HA       ASN 103  33.082 -14.649  -3.673
   95    HB2  ASN 103           HB2      ASN 103  32.023 -15.606  -1.636
   96    HB3  ASN 103           HB3      ASN 103  30.469 -14.902  -2.110
   97   HD21  ASN 103          HD22      ASN 103  32.986 -17.258  -3.149
   98   HD22  ASN 103          HD21      ASN 103  31.855 -18.241  -4.068
   99    H    GLY 104           H        GLY 104  30.602 -12.197  -3.530
  100    HA2  GLY 104           HA2      GLY 104  30.169 -11.643  -6.193
  101    HA3  GLY 104           HA3      GLY 104  29.113 -13.030  -5.893
  102    H    GLU 105           H        GLU 105  27.570 -11.157  -6.558
  103    HA   GLU 105           HA       GLU 105  26.759  -9.061  -4.868
  104    HB2  GLU 105           HB2      GLU 105  25.108 -10.887  -6.643
  105    HB3  GLU 105           HB3      GLU 105  24.467  -9.469  -5.800
  106    HG2  GLU 105           HG2      GLU 105  26.092  -8.014  -6.963
  107    HG3  GLU 105           HG3      GLU 105  26.748  -9.408  -7.823
  108    H    THR 106           H        THR 106  26.582  -9.205  -2.761
  109    HA   THR 106           HA       THR 106  25.820 -11.699  -1.487
  110    HB   THR 106           HB       THR 106  27.843 -10.524  -0.804
  111    HG1  THR 106           HG1      THR 106  27.493 -10.939   1.367
  112   HG21  THR 106          HG21      THR 106  26.041  -8.512   0.617
  113   HG22  THR 106          HG22      THR 106  27.799  -8.639   0.720
  114   HG23  THR 106          HG23      THR 106  27.040  -8.144  -0.796
  115    H    LYS 107           H        LYS 107  24.567  -8.382  -1.756
  116    HA   LYS 107           HA       LYS 107  21.938  -9.163  -0.622
  117    HB2  LYS 107           HB2      LYS 107  23.808  -7.077   0.576
  118    HB3  LYS 107           HB3      LYS 107  22.086  -7.076   0.916
  119    HG2  LYS 107           HG2      LYS 107  24.026  -9.286   1.691
  120    HG3  LYS 107           HG3      LYS 107  23.390  -8.029   2.737
  121    HD2  LYS 107           HD2      LYS 107  21.084  -8.882   2.419
  122    HD3  LYS 107           HD3      LYS 107  21.704 -10.175   1.371
  123    HE2  LYS 107           HE2      LYS 107  23.131 -11.001   3.234
  124    HE3  LYS 107           HE3      LYS 107  22.507  -9.723   4.282
  125    HZ1  LYS 107           HZ1      LYS 107  20.276 -10.713   4.036
  126    HZ2  LYS 107           HZ2      LYS 107  20.865 -11.898   3.070
  127    HZ3  LYS 107           HZ3      LYS 107  21.317 -11.815   4.637
  128    H    THR 108           H        THR 108  20.305  -7.596  -0.903
  129    HA   THR 108           HA       THR 108  20.814  -5.418  -2.876
  130    HB   THR 108           HB       THR 108  18.606  -5.904  -3.861
  131    HG1  THR 108           HG1      THR 108  17.617  -7.912  -3.291
  132   HG21  THR 108          HG21      THR 108  20.642  -6.965  -4.821
  133   HG22  THR 108          HG22      THR 108  20.338  -8.405  -3.824
  134   HG23  THR 108          HG23      THR 108  19.173  -7.912  -5.084
  135    H    TRP 109           H        TRP 109  19.109  -3.764  -2.946
  136    HA   TRP 109           HA       TRP 109  17.689  -3.246  -0.388
  137    HB2  TRP 109           HB2      TRP 109  19.971  -2.472  -0.017
  138    HB3  TRP 109           HB3      TRP 109  19.963  -1.579  -1.526
  139    HD1  TRP 109           HD1      TRP 109  17.443  -1.464   1.459
  140    HE1  TRP 109           HE1      TRP 109  17.196   0.975   2.214
  141    HE3  TRP 109           HE3      TRP 109  20.945   0.720  -1.604
  142    HZ2  TRP 109           HZ2      TRP 109  18.495   3.479   1.748
  143    HZ3  TRP 109           HZ3      TRP 109  21.480   3.126  -1.342
  144    HH2  TRP 109           HH2      TRP 109  20.273   4.519   0.325
  145    H    THR 110           H        THR 110  16.201  -1.511  -0.468
  146    HA   THR 110           HA       THR 110  14.789  -1.162  -3.018
  147    HB   THR 110           HB       THR 110  13.150  -0.017  -1.494
  148    HG1  THR 110           HG1      THR 110  13.734  -0.225   0.790
  149   HG21  THR 110          HG21      THR 110  14.102  -2.652  -0.288
  150   HG22  THR 110          HG22      THR 110  12.477  -1.938  -0.189
  151   HG23  THR 110          HG23      THR 110  13.088  -2.533  -1.741
  152    H    GLY 111           H        GLY 111  17.044   0.721  -1.134
  153    HA2  GLY 111           HA2      GLY 111  17.902   2.865  -1.625
  154    HA3  GLY 111           HA3      GLY 111  16.586   3.170  -2.755
  155    H    GLN 112           H        GLN 112  15.513   1.866   0.269
  156    HA   GLN 112           HA       GLN 112  14.683   4.575   1.246
  157    HB2  GLN 112           HB2      GLN 112  13.113   1.966   1.309
  158    HB3  GLN 112           HB3      GLN 112  12.588   3.515   1.973
  159    HG2  GLN 112           HG2      GLN 112  12.644   4.514  -0.310
  160    HG3  GLN 112           HG3      GLN 112  13.110   2.947  -0.983
  161   HE21  GLN 112          HE22      GLN 112  10.401   4.905  -0.088
  162   HE22  GLN 112          HE21      GLN 112   9.194   3.638  -0.258
  163    H    GLY 113           H        GLY 113  14.331   4.789   3.531
  164    HA2  GLY 113           HA2      GLY 113  14.980   4.535   5.758
  165    HA3  GLY 113           HA3      GLY 113  15.418   2.857   5.441
  166    H    ARG 114           H        ARG 114  17.222   3.586   6.949
  167    HA   ARG 114           HA       ARG 114  19.300   5.355   6.104
  168    HB2  ARG 114           HB2      ARG 114  20.674   4.348   7.816
  169    HB3  ARG 114           HB3      ARG 114  19.041   4.613   8.414
  170    HG2  ARG 114           HG2      ARG 114  18.546   2.168   8.071
  171    HG3  ARG 114           HG3      ARG 114  20.229   1.937   7.552
  172    HD2  ARG 114           HD2      ARG 114  21.022   2.768   9.738
  173    HD3  ARG 114           HD3      ARG 114  19.342   2.998  10.261
  174    HE   ARG 114           HE       ARG 114  19.641   0.303   9.402
  175   HH11  ARG 114          HH11      ARG 114  20.729   2.300  12.079
  176   HH12  ARG 114          HH12      ARG 114  20.885   0.937  13.151
  177   HH21  ARG 114          HH21      ARG 114  19.855  -1.385  10.832
  178   HH22  ARG 114          HH22      ARG 114  20.396  -1.097  12.459
  179    H    THR 115           H        THR 115  21.148   5.157   4.968
  180    HA   THR 115           HA       THR 115  21.352   3.382   2.810
  181    HB   THR 115           HB       THR 115  23.599   4.949   4.130
  182    HG1  THR 115           HG1      THR 115  22.930   6.592   2.728
  183   HG21  THR 115          HG21      THR 115  24.490   5.077   1.803
  184   HG22  THR 115          HG22      THR 115  24.466   3.425   2.430
  185   HG23  THR 115          HG23      THR 115  23.219   3.949   1.273
  186    HA   PRO 116           HA       PRO 116  22.985  -0.325   4.860
  187    HB2  PRO 116           HB2      PRO 116  23.969  -0.969   2.088
  188    HB3  PRO 116           HB3      PRO 116  23.072  -2.005   3.235
  189    HG2  PRO 116           HG2      PRO 116  21.809  -0.849   1.125
  190    HG3  PRO 116           HG3      PRO 116  21.018  -0.947   2.731
  191    HD2  PRO 116           HD2      PRO 116  22.383   1.427   1.455
  192    HD3  PRO 116           HD3      PRO 116  20.879   1.341   2.429
  193    H    ALA 117           H        ALA 117  25.006  -1.156   5.539
  194    HA   ALA 117           HA       ALA 117  26.992   0.723   5.933
  195    HB1  ALA 117           HB1      ALA 117  26.597  -1.226   7.364
  196    HB2  ALA 117           HB2      ALA 117  27.211  -2.315   6.097
  197    HB3  ALA 117           HB3      ALA 117  28.301  -1.151   6.875
  198    H    VAL 118           H        VAL 118  27.234  -1.969   3.511
  199    HA   VAL 118           HA       VAL 118  29.833  -1.222   2.594
  200    HB   VAL 118           HB       VAL 118  27.636  -2.709   1.112
  201   HG11  VAL 118          HG11      VAL 118  29.498  -3.672  -0.251
  202   HG12  VAL 118          HG12      VAL 118  29.299  -1.942  -0.519
  203   HG13  VAL 118          HG13      VAL 118  30.623  -2.532   0.513
  204   HG21  VAL 118          HG21      VAL 118  28.938  -4.737   1.788
  205   HG22  VAL 118          HG22      VAL 118  30.025  -3.703   2.736
  206   HG23  VAL 118          HG23      VAL 118  28.313  -3.870   3.189
  207    H    ILE 119           H        ILE 119  26.607  -0.222   1.445
  208    HA   ILE 119           HA       ILE 119  27.478   1.339  -0.803
  209    HB   ILE 119           HB       ILE 119  25.024   1.759   0.944
  210   HG12  ILE 119          HG12      ILE 119  25.026  -0.555   0.116
  211   HG13  ILE 119          HG13      ILE 119  23.731   0.415  -0.544
  212   HG21  ILE 119          HG21      ILE 119  25.387   3.699  -0.459
  213   HG22  ILE 119          HG22      ILE 119  25.664   2.685  -1.886
  214   HG23  ILE 119          HG23      ILE 119  24.054   2.770  -1.141
  215   HD11  ILE 119          HD11      ILE 119  26.292  -0.313  -2.025
  216   HD12  ILE 119          HD12      ILE 119  24.700  -1.076  -2.227
  217   HD13  ILE 119          HD13      ILE 119  24.914   0.611  -2.689
  218    H    LYS 120           H        LYS 120  26.818   2.254   2.607
  219    HA   LYS 120           HA       LYS 120  27.572   5.006   2.494
  220    HB2  LYS 120           HB2      LYS 120  26.388   4.226   4.392
  221    HB3  LYS 120           HB3      LYS 120  27.499   2.893   4.684
  222    HG2  LYS 120           HG2      LYS 120  29.254   4.386   5.447
  223    HG3  LYS 120           HG3      LYS 120  28.275   5.815   5.003
  224    HD2  LYS 120           HD2      LYS 120  26.526   5.013   6.658
  225    HD3  LYS 120           HD3      LYS 120  27.658   3.765   7.186
  226    HE2  LYS 120           HE2      LYS 120  28.102   6.793   7.311
  227    HE3  LYS 120           HE3      LYS 120  27.624   5.769   8.664
  228    HZ1  LYS 120           HZ1      LYS 120  29.989   6.161   8.735
  229    HZ2  LYS 120           HZ2      LYS 120  29.776   4.574   8.403
  230    HZ3  LYS 120           HZ3      LYS 120  30.228   5.639   7.214
  231    H    LYS 121           H        LYS 121  29.562   2.147   3.288
  232    HA   LYS 121           HA       LYS 121  31.928   3.622   3.796
  233    HB2  LYS 121           HB2      LYS 121  31.245   1.176   4.393
  234    HB3  LYS 121           HB3      LYS 121  31.855   0.735   2.805
  235    HG2  LYS 121           HG2      LYS 121  33.477   0.321   4.560
  236    HG3  LYS 121           HG3      LYS 121  34.106   1.569   3.476
  237    HD2  LYS 121           HD2      LYS 121  33.885   3.267   5.074
  238    HD3  LYS 121           HD3      LYS 121  32.561   2.462   5.935
  239    HE2  LYS 121           HE2      LYS 121  34.063   0.844   6.926
  240    HE3  LYS 121           HE3      LYS 121  35.387   1.312   5.850
  241    HZ1  LYS 121           HZ1      LYS 121  35.515   3.452   6.950
  242    HZ2  LYS 121           HZ2      LYS 121  34.244   3.099   7.945
  243    HZ3  LYS 121           HZ3      LYS 121  35.651   2.271   8.071
  244    H    ALA 122           H        ALA 122  30.828   2.095   0.773
  245    HA   ALA 122           HA       ALA 122  33.084   2.812  -0.819
  246    HB1  ALA 122           HB1      ALA 122  30.182   2.320  -1.615
  247    HB2  ALA 122           HB2      ALA 122  31.605   2.256  -2.684
  248    HB3  ALA 122           HB3      ALA 122  31.426   1.072  -1.385
  249    H    MET 123           H        MET 123  30.011   4.617  -0.160
  250    HA   MET 123           HA       MET 123  30.594   6.843  -1.860
  251    HB2  MET 123           HB2      MET 123  28.947   6.641   0.690
  252    HB3  MET 123           HB3      MET 123  29.020   8.081  -0.320
  253    HG2  MET 123           HG2      MET 123  27.986   6.964  -2.173
  254    HG3  MET 123           HG3      MET 123  28.171   5.389  -1.422
  255    HE1  MET 123           HE1      MET 123  26.099   8.643  -1.715
  256    HE2  MET 123           HE2      MET 123  25.020   8.596  -0.304
  257    HE3  MET 123           HE3      MET 123  26.754   8.911  -0.079
  258    H    GLU 124           H        GLU 124  31.357   6.296   1.618
  259    HA   GLU 124           HA       GLU 124  32.597   8.845   1.999
  260    HB2  GLU 124           HB2      GLU 124  32.705   6.244   3.563
  261    HB3  GLU 124           HB3      GLU 124  33.486   7.735   4.102
  262    HG2  GLU 124           HG2      GLU 124  31.319   8.913   4.082
  263    HG3  GLU 124           HG3      GLU 124  30.496   7.432   3.603
  264    H    GLU 125           H        GLU 125  34.067   5.624   1.382
  265    HA   GLU 125           HA       GLU 125  36.778   6.887   1.433
  266    HB2  GLU 125           HB2      GLU 125  35.893   4.031   1.915
  267    HB3  GLU 125           HB3      GLU 125  37.563   4.619   1.973
  268    HG2  GLU 125           HG2      GLU 125  36.917   6.242   3.767
  269    HG3  GLU 125           HG3      GLU 125  35.291   5.559   3.781
  270    H    GLN 126           H        GLN 126  34.669   5.402  -0.855
  271    HA   GLN 126           HA       GLN 126  36.944   5.234  -2.806
  272    HB2  GLN 126           HB2      GLN 126  34.400   3.574  -2.815
  273    HB3  GLN 126           HB3      GLN 126  35.711   3.500  -3.984
  274    HG2  GLN 126           HG2      GLN 126  37.271   2.780  -2.172
  275    HG3  GLN 126           HG3      GLN 126  35.921   2.741  -1.033
  276   HE21  GLN 126          HE22      GLN 126  37.780   0.610  -2.617
  277   HE22  GLN 126          HE21      GLN 126  36.567  -0.599  -3.019
  278    H    GLY 127           H        GLY 127  34.496   7.267  -1.969
  279    HA2  GLY 127           HA2      GLY 127  33.540   9.053  -3.045
  280    HA3  GLY 127           HA3      GLY 127  34.638   8.761  -4.394
  281    H    LYS 128           H        LYS 128  32.453   6.162  -3.537
  282    HA   LYS 128           HA       LYS 128  31.201   6.231  -6.167
  283    HB2  LYS 128           HB2      LYS 128  30.656   4.536  -3.673
  284    HB3  LYS 128           HB3      LYS 128  29.832   4.286  -5.200
  285    HG2  LYS 128           HG2      LYS 128  32.815   3.951  -4.739
  286    HG3  LYS 128           HG3      LYS 128  31.594   2.696  -4.974
  287    HD2  LYS 128           HD2      LYS 128  31.128   3.845  -7.270
  288    HD3  LYS 128           HD3      LYS 128  32.691   4.655  -7.018
  289    HE2  LYS 128           HE2      LYS 128  33.783   2.436  -6.745
  290    HE3  LYS 128           HE3      LYS 128  32.207   1.646  -6.947
  291    HZ1  LYS 128           HZ1      LYS 128  33.504   1.667  -9.020
  292    HZ2  LYS 128           HZ2      LYS 128  32.082   2.453  -9.198
  293    HZ3  LYS 128           HZ3      LYS 128  33.491   3.304  -9.061
  294    H    GLN 129           H        GLN 129  28.847   5.851  -6.391
  295    HA   GLN 129           HA       GLN 129  27.066   7.462  -4.663
  296    HB2  GLN 129           HB2      GLN 129  27.839   8.918  -6.525
  297    HB3  GLN 129           HB3      GLN 129  27.330   7.709  -7.699
  298    HG2  GLN 129           HG2      GLN 129  25.785   9.616  -7.564
  299    HG3  GLN 129           HG3      GLN 129  24.979   8.110  -7.171
  300   HE21  GLN 129          HE22      GLN 129  25.856  11.302  -5.950
  301   HE22  GLN 129          HE21      GLN 129  25.087  11.080  -4.386
  302    H    LEU 130           H        LEU 130  24.752   6.805  -5.056
  303    HA   LEU 130           HA       LEU 130  24.448   4.014  -4.810
  304    HB2  LEU 130           HB2      LEU 130  22.590   6.357  -5.227
  305    HB3  LEU 130           HB3      LEU 130  21.953   4.739  -5.411
  306    HG   LEU 130           HG       LEU 130  22.651   4.108  -3.158
  307   HD11  LEU 130          HD11      LEU 130  24.541   5.627  -2.768
  308   HD12  LEU 130          HD12      LEU 130  23.448   7.030  -2.842
  309   HD13  LEU 130          HD13      LEU 130  23.309   5.851  -1.526
  310   HD21  LEU 130          HD21      LEU 130  20.963   6.644  -3.321
  311   HD22  LEU 130          HD22      LEU 130  20.390   4.975  -3.560
  312   HD23  LEU 130          HD23      LEU 130  20.965   5.497  -1.967
  313    H    GLU 131           H        GLU 131  24.294   5.937  -7.736
  314    HA   GLU 131           HA       GLU 131  23.095   3.988  -9.489
  315    HB2  GLU 131           HB2      GLU 131  25.042   6.258 -10.068
  316    HB3  GLU 131           HB3      GLU 131  24.195   5.318 -11.302
  317    HG2  GLU 131           HG2      GLU 131  22.015   6.038 -10.378
  318    HG3  GLU 131           HG3      GLU 131  22.838   7.005  -9.155
  319    H    ASP 132           H        ASP 132  26.373   4.049  -8.158
  320    HA   ASP 132           HA       ASP 132  27.527   2.251 -10.089
  321    HB2  ASP 132           HB2      ASP 132  28.752   3.668  -8.335
  322    HB3  ASP 132           HB3      ASP 132  28.289   2.444  -7.158
  323    H    PHE 133           H        PHE 133  25.236   1.842  -7.561
  324    HA   PHE 133           HA       PHE 133  25.480  -1.136  -7.488
  325    HB2  PHE 133           HB2      PHE 133  24.290   0.794  -5.461
  326    HB3  PHE 133           HB3      PHE 133  24.483  -0.934  -5.262
  327    HD1  PHE 133           HD1      PHE 133  26.854  -1.923  -5.204
  328    HD2  PHE 133           HD2      PHE 133  26.081   2.308  -4.924
  329    HE1  PHE 133           HE1      PHE 133  29.100  -1.575  -4.204
  330    HE2  PHE 133           HE2      PHE 133  28.321   2.651  -3.918
  331    HZ   PHE 133           HZ       PHE 133  29.840   0.700  -3.568
  332    H    LEU 134           H        LEU 134  23.376   1.482  -8.332
  333    HA   LEU 134           HA       LEU 134  20.803   0.300  -8.252
  334    HB2  LEU 134           HB2      LEU 134  21.589   2.709  -8.630
  335    HB3  LEU 134           HB3      LEU 134  21.847   2.269 -10.319
  336    HG   LEU 134           HG       LEU 134  19.222   2.329  -8.779
  337   HD11  LEU 134          HD11      LEU 134  20.267   4.034 -11.075
  338   HD12  LEU 134          HD12      LEU 134  18.693   4.203 -10.270
  339   HD13  LEU 134          HD13      LEU 134  20.182   4.529  -9.368
  340   HD21  LEU 134          HD21      LEU 134  19.745   1.511 -11.650
  341   HD22  LEU 134          HD22      LEU 134  18.883   0.614 -10.374
  342   HD23  LEU 134          HD23      LEU 134  18.165   2.074 -11.071
  343    H    ILE 135           H        ILE 135  20.036  -1.371  -9.313
  344    HA   ILE 135           HA       ILE 135  21.194  -2.200 -11.954
  345    HB   ILE 135           HB       ILE 135  20.808  -4.596 -11.209
  346   HG12  ILE 135          HG12      ILE 135  21.115  -5.073  -8.822
  347   HG13  ILE 135          HG13      ILE 135  20.866  -3.382  -8.408
  348   HG21  ILE 135          HG21      ILE 135  23.012  -4.689 -10.176
  349   HG22  ILE 135          HG22      ILE 135  23.001  -3.532 -11.507
  350   HG23  ILE 135          HG23      ILE 135  22.958  -2.950  -9.833
  351   HD11  ILE 135          HD11      ILE 135  18.893  -4.837  -7.982
  352   HD12  ILE 135          HD12      ILE 135  18.516  -3.548  -9.135
  353   HD13  ILE 135          HD13      ILE 135  18.797  -5.208  -9.713
  354    H    LYS 136           H        LYS 136  18.126  -1.562 -10.486
  355    HA   LYS 136           HA       LYS 136  16.735  -3.303 -12.439
  356    HB2  LYS 136           HB2      LYS 136  16.103  -3.232 -10.056
  357    HB3  LYS 136           HB3      LYS 136  15.571  -1.550 -10.247
  358    HG2  LYS 136           HG2      LYS 136  13.836  -2.233 -11.832
  359    HG3  LYS 136           HG3      LYS 136  14.458  -3.895 -11.846
  360    HD2  LYS 136           HD2      LYS 136  13.824  -4.168  -9.476
  361    HD3  LYS 136           HD3      LYS 136  13.345  -2.470  -9.396
  362    HE2  LYS 136           HE2      LYS 136  11.340  -3.746  -9.592
  363    HE3  LYS 136           HE3      LYS 136  11.576  -2.893 -11.114
  364    HZ1  LYS 136           HZ1      LYS 136  12.241  -5.768 -10.651
  365    HZ2  LYS 136           HZ2      LYS 136  10.927  -5.228 -11.446
  366    HZ3  LYS 136           HZ3      LYS 136  12.407  -4.991 -12.083
  367    H    GLU 137           H        GLU 137  17.281   0.155 -12.149
  368    HA   GLU 137           HA       GLU 137  15.511   0.648 -14.525
  369    HB2  GLU 137           HB2      GLU 137  15.652   2.325 -11.989
  370    HB3  GLU 137           HB3      GLU 137  14.725   2.711 -13.447
  371    HG2  GLU 137           HG2      GLU 137  13.491   0.508 -13.133
  372    HG3  GLU 137           HG3      GLU 137  14.220   0.418 -11.534
  373    H    LEU 138           H        LEU 138  18.395   0.321 -14.589
  374    HA   LEU 138           HA       LEU 138  19.581   2.948 -15.090
  375    HB2  LEU 138           HB2      LEU 138  20.377   0.158 -16.030
  376    HB3  LEU 138           HB3      LEU 138  21.323   1.617 -16.292
  377    HG   LEU 138           HG       LEU 138  20.712   0.362 -13.588
  378   HD11  LEU 138          HD11      LEU 138  23.288   0.648 -15.199
  379   HD12  LEU 138          HD12      LEU 138  23.149  -0.061 -13.580
  380   HD13  LEU 138          HD13      LEU 138  22.367  -0.852 -14.955
  381   HD21  LEU 138          HD21      LEU 138  20.857   2.798 -13.294
  382   HD22  LEU 138          HD22      LEU 138  22.339   2.038 -12.703
  383   HD23  LEU 138          HD23      LEU 138  22.340   2.853 -14.279
  384    H    GLU 139           H        GLU 139  17.337   1.057 -16.862
  385    HA   GLU 139           HA       GLU 139  17.530   2.804 -19.254
  386    HB2  GLU 139           HB2      GLU 139  17.512  -0.245 -19.345
  387    HB3  GLU 139           HB3      GLU 139  17.203   0.816 -20.722
  388    HG2  GLU 139           HG2      GLU 139  19.487   1.808 -20.444
  389    HG3  GLU 139           HG3      GLU 139  19.813   0.639 -19.159
  Start of MODEL   11
    1    H1   ALA  91           H1       ALA  91  14.480 -11.967 -17.284
    2    H2   ALA  91           H2       ALA  91  16.044 -11.534 -17.495
    3    H3   ALA  91           H3       ALA  91  15.616 -13.116 -17.561
    4    HA   ALA  91           HA       ALA  91  14.985 -13.112 -15.239
    5    HB1  ALA  91           HB1      ALA  91  17.287 -13.809 -15.818
    6    HB2  ALA  91           HB2      ALA  91  17.846 -12.125 -15.687
    7    HB3  ALA  91           HB3      ALA  91  17.242 -12.979 -14.258
    8    H    ALA  92           H        ALA  92  14.981 -12.038 -13.170
    9    HA   ALA  92           HA       ALA  92  15.269  -9.106 -13.060
   10    HB1  ALA  92           HB1      ALA  92  12.603 -10.522 -12.554
   11    HB2  ALA  92           HB2      ALA  92  12.925  -8.793 -12.295
   12    HB3  ALA  92           HB3      ALA  92  12.967  -9.459 -13.932
   13    H    ARG  93           H        ARG  93  14.768  -8.301 -10.804
   14    HA   ARG  93           HA       ARG  93  15.227 -10.287  -8.619
   15    HB2  ARG  93           HB2      ARG  93  16.812  -7.721  -9.112
   16    HB3  ARG  93           HB3      ARG  93  16.843  -8.617  -7.592
   17    HG2  ARG  93           HG2      ARG  93  17.754 -10.600  -8.736
   18    HG3  ARG  93           HG3      ARG  93  17.715  -9.741 -10.285
   19    HD2  ARG  93           HD2      ARG  93  19.278  -8.019  -9.350
   20    HD3  ARG  93           HD3      ARG  93  19.319  -8.909  -7.830
   21    HE   ARG  93           HE       ARG  93  20.806 -10.424  -8.715
   22   HH11  ARG  93          HH11      ARG  93  19.513  -8.656 -11.492
   23   HH12  ARG  93          HH12      ARG  93  20.663  -9.389 -12.571
   24   HH21  ARG  93          HH21      ARG  93  22.226 -11.257 -10.122
   25   HH22  ARG  93          HH22      ARG  93  22.146 -10.843 -11.821
   26    HA   PRO  94           HA       PRO  94  12.066  -7.787  -6.694
   27    HB2  PRO  94           HB2      PRO  94  12.033  -8.769  -4.160
   28    HB3  PRO  94           HB3      PRO  94  11.726  -9.823  -5.565
   29    HG2  PRO  94           HG2      PRO  94  14.382  -9.406  -4.141
   30    HG3  PRO  94           HG3      PRO  94  13.536 -10.957  -4.457
   31    HD2  PRO  94           HD2      PRO  94  15.468  -9.991  -6.134
   32    HD3  PRO  94           HD3      PRO  94  14.034 -10.875  -6.745
   33    H    ALA  95           H        ALA  95  14.471  -6.341  -7.065
   34    HA   ALA  95           HA       ALA  95  14.597  -4.464  -4.785
   35    HB1  ALA  95           HB1      ALA  95  16.974  -6.136  -5.750
   36    HB2  ALA  95           HB2      ALA  95  17.062  -4.829  -4.551
   37    HB3  ALA  95           HB3      ALA  95  16.148  -6.297  -4.184
   38    H    LYS  96           H        LYS  96  16.330  -2.734  -5.318
   39    HA   LYS  96           HA       LYS  96  16.526  -2.170  -8.227
   40    HB2  LYS  96           HB2      LYS  96  14.790  -0.755  -7.309
   41    HB3  LYS  96           HB3      LYS  96  15.860  -0.188  -6.017
   42    HG2  LYS  96           HG2      LYS  96  17.248   1.010  -7.528
   43    HG3  LYS  96           HG3      LYS  96  16.580   0.175  -8.940
   44    HD2  LYS  96           HD2      LYS  96  15.870   2.471  -8.883
   45    HD3  LYS  96           HD3      LYS  96  14.485   1.378  -8.728
   46    HE2  LYS  96           HE2      LYS  96  14.584   1.805  -6.196
   47    HE3  LYS  96           HE3      LYS  96  15.838   3.011  -6.534
   48    HZ1  LYS  96           HZ1      LYS  96  14.132   4.053  -8.095
   49    HZ2  LYS  96           HZ2      LYS  96  13.006   3.082  -7.421
   50    HZ3  LYS  96           HZ3      LYS  96  13.775   4.181  -6.483
   51    H    TYR  97           H        TYR  97  18.264  -2.404  -5.248
   52    HA   TYR  97           HA       TYR  97  20.741  -1.690  -6.747
   53    HB2  TYR  97           HB2      TYR  97  20.284  -1.093  -3.806
   54    HB3  TYR  97           HB3      TYR  97  21.650  -0.603  -4.789
   55    HD1  TYR  97           HD1      TYR  97  18.068  -0.002  -4.035
   56    HD2  TYR  97           HD2      TYR  97  21.570   1.450  -6.092
   57    HE1  TYR  97           HE1      TYR  97  16.932   2.173  -4.452
   58    HE2  TYR  97           HE2      TYR  97  20.420   3.613  -6.520
   59    HH   TYR  97           HH       TYR  97  18.489   4.871  -6.214
   60    H    SER  98           H        SER  98  22.656  -2.823  -6.011
   61    HA   SER  98           HA       SER  98  22.406  -4.843  -3.899
   62    HB2  SER  98           HB2      SER  98  23.092  -6.736  -5.248
   63    HB3  SER  98           HB3      SER  98  21.589  -6.057  -5.905
   64    HG   SER  98           HG       SER  98  23.213  -6.555  -7.525
   65    H    TYR  99           H        TYR  99  24.391  -5.760  -3.206
   66    HA   TYR  99           HA       TYR  99  26.899  -4.617  -4.292
   67    HB2  TYR  99           HB2      TYR  99  27.648  -3.883  -2.095
   68    HB3  TYR  99           HB3      TYR  99  26.239  -3.011  -2.624
   69    HD1  TYR  99           HD1      TYR  99  24.004  -3.414  -1.595
   70    HD2  TYR  99           HD2      TYR  99  27.594  -5.268  -0.075
   71    HE1  TYR  99           HE1      TYR  99  22.917  -3.701   0.640
   72    HE2  TYR  99           HE2      TYR  99  26.511  -5.549   2.142
   73    HH   TYR  99           HH       TYR  99  24.662  -5.073   3.454
   74    H    VAL 100           H        VAL 100  28.839  -5.550  -3.167
   75    HA   VAL 100           HA       VAL 100  28.469  -8.484  -2.781
   76    HB   VAL 100           HB       VAL 100  28.799  -8.063  -5.110
   77   HG11  VAL 100          HG11      VAL 100  31.495  -6.809  -4.445
   78   HG12  VAL 100          HG12      VAL 100  30.874  -7.202  -6.061
   79   HG13  VAL 100          HG13      VAL 100  30.080  -5.953  -5.098
   80   HG21  VAL 100          HG21      VAL 100  31.327  -9.275  -3.917
   81   HG22  VAL 100          HG22      VAL 100  29.753 -10.107  -4.060
   82   HG23  VAL 100          HG23      VAL 100  30.635  -9.585  -5.511
   83    H    ASP 101           H        ASP 101  29.795  -9.493  -1.453
   84    HA   ASP 101           HA       ASP 101  32.408  -8.297  -0.731
   85    HB2  ASP 101           HB2      ASP 101  30.693  -7.653   1.022
   86    HB3  ASP 101           HB3      ASP 101  30.470  -9.369   1.355
   87    H    GLU 102           H        GLU 102  30.281 -11.175  -0.704
   88    HA   GLU 102           HA       GLU 102  32.710 -12.914  -1.063
   89    HB2  GLU 102           HB2      GLU 102  30.397 -13.418   0.852
   90    HB3  GLU 102           HB3      GLU 102  31.720 -14.532   0.526
   91    HG2  GLU 102           HG2      GLU 102  33.340 -12.825   1.396
   92    HG3  GLU 102           HG3      GLU 102  31.955 -11.837   1.889
   93    H    ASN 103           H        ASN 103  29.520 -12.312  -2.300
   94    HA   ASN 103           HA       ASN 103  29.358 -15.087  -3.346
   95    HB2  ASN 103           HB2      ASN 103  27.833 -14.424  -1.463
   96    HB3  ASN 103           HB3      ASN 103  27.114 -13.215  -2.524
   97   HD21  ASN 103          HD22      ASN 103  25.186 -13.903  -3.403
   98   HD22  ASN 103          HD21      ASN 103  24.799 -15.596  -3.710
   99    H    GLY 104           H        GLY 104  30.255 -12.341  -4.744
  100    HA2  GLY 104           HA2      GLY 104  30.114 -11.517  -6.933
  101    HA3  GLY 104           HA3      GLY 104  28.950 -12.779  -7.339
  102    H    GLU 105           H        GLU 105  26.945 -12.340  -5.531
  103    HA   GLU 105           HA       GLU 105  26.219  -9.522  -5.317
  104    HB2  GLU 105           HB2      GLU 105  23.936  -9.890  -6.006
  105    HB3  GLU 105           HB3      GLU 105  25.091 -10.156  -7.314
  106    HG2  GLU 105           HG2      GLU 105  24.832 -12.630  -7.003
  107    HG3  GLU 105           HG3      GLU 105  23.567 -12.314  -5.801
  108    H    THR 106           H        THR 106  26.347  -9.300  -3.198
  109    HA   THR 106           HA       THR 106  25.989 -11.598  -1.420
  110    HB   THR 106           HB       THR 106  27.251  -8.888  -1.212
  111    HG1  THR 106           HG1      THR 106  28.112 -11.505  -0.522
  112   HG21  THR 106          HG21      THR 106  26.229  -8.907   0.901
  113   HG22  THR 106          HG22      THR 106  26.654 -10.624   1.175
  114   HG23  THR 106          HG23      THR 106  27.923  -9.371   1.096
  115    H    LYS 107           H        LYS 107  24.735  -8.239  -1.572
  116    HA   LYS 107           HA       LYS 107  22.134  -9.136  -0.426
  117    HB2  LYS 107           HB2      LYS 107  24.042  -7.141   0.842
  118    HB3  LYS 107           HB3      LYS 107  22.300  -6.997   1.093
  119    HG2  LYS 107           HG2      LYS 107  22.240  -9.340   1.960
  120    HG3  LYS 107           HG3      LYS 107  24.009  -9.412   1.826
  121    HD2  LYS 107           HD2      LYS 107  24.244  -7.559   3.405
  122    HD3  LYS 107           HD3      LYS 107  22.473  -7.400   3.526
  123    HE2  LYS 107           HE2      LYS 107  22.329  -9.738   4.370
  124    HE3  LYS 107           HE3      LYS 107  24.087  -9.884   4.277
  125    HZ1  LYS 107           HZ1      LYS 107  23.354  -9.313   6.531
  126    HZ2  LYS 107           HZ2      LYS 107  24.263  -8.096   5.937
  127    HZ3  LYS 107           HZ3      LYS 107  22.632  -7.942   6.014
  128    H    THR 108           H        THR 108  20.492  -7.467  -0.499
  129    HA   THR 108           HA       THR 108  20.714  -5.649  -2.852
  130    HB   THR 108           HB       THR 108  18.568  -6.484  -3.659
  131    HG1  THR 108           HG1      THR 108  17.732  -8.426  -2.732
  132   HG21  THR 108          HG21      THR 108  20.672  -7.573  -4.498
  133   HG22  THR 108          HG22      THR 108  20.445  -8.851  -3.292
  134   HG23  THR 108          HG23      THR 108  19.244  -8.616  -4.575
  135    H    TRP 109           H        TRP 109  18.978  -4.078  -3.045
  136    HA   TRP 109           HA       TRP 109  17.425  -3.419  -0.603
  137    HB2  TRP 109           HB2      TRP 109  19.693  -2.579  -0.181
  138    HB3  TRP 109           HB3      TRP 109  19.712  -1.752  -1.721
  139    HD1  TRP 109           HD1      TRP 109  17.211  -1.642   1.267
  140    HE1  TRP 109           HE1      TRP 109  16.854   0.808   1.950
  141    HE3  TRP 109           HE3      TRP 109  20.392   0.627  -2.067
  142    HZ2  TRP 109           HZ2      TRP 109  17.957   3.369   1.303
  143    HZ3  TRP 109           HZ3      TRP 109  20.759   3.069  -1.960
  144    HH2  TRP 109           HH2      TRP 109  19.564   4.460  -0.277
  145    H    THR 110           H        THR 110  15.917  -1.676  -0.901
  146    HA   THR 110           HA       THR 110  14.908  -1.462  -3.695
  147    HB   THR 110           HB       THR 110  12.791  -0.823  -2.540
  148    HG1  THR 110           HG1      THR 110  12.814  -1.139  -0.244
  149   HG21  THR 110          HG21      THR 110  12.269  -2.991  -1.552
  150   HG22  THR 110          HG22      THR 110  13.246  -3.238  -3.011
  151   HG23  THR 110          HG23      THR 110  13.990  -3.390  -1.404
  152    H    GLY 111           H        GLY 111  16.339   0.554  -1.247
  153    HA2  GLY 111           HA2      GLY 111  16.925   2.875  -1.697
  154    HA3  GLY 111           HA3      GLY 111  15.429   3.072  -2.597
  155    H    GLN 112           H        GLN 112  14.336   1.265  -0.117
  156    HA   GLN 112           HA       GLN 112  13.212   3.528   1.346
  157    HB2  GLN 112           HB2      GLN 112  13.032   0.510   1.740
  158    HB3  GLN 112           HB3      GLN 112  12.120   1.705   2.672
  159    HG2  GLN 112           HG2      GLN 112  10.984   2.501   0.645
  160    HG3  GLN 112           HG3      GLN 112  11.917   1.394  -0.359
  161   HE21  GLN 112          HE22      GLN 112   9.076   1.672   1.640
  162   HE22  GLN 112          HE21      GLN 112   8.616  -0.021   1.520
  163    H    GLY 113           H        GLY 113  13.640   4.198   3.444
  164    HA2  GLY 113           HA2      GLY 113  14.759   4.435   5.468
  165    HA3  GLY 113           HA3      GLY 113  15.361   2.787   5.298
  166    H    ARG 114           H        ARG 114  17.292   3.762   6.304
  167    HA   ARG 114           HA       ARG 114  18.985   5.652   4.885
  168    HB2  ARG 114           HB2      ARG 114  19.580   3.661   7.129
  169    HB3  ARG 114           HB3      ARG 114  20.748   4.825   6.496
  170    HG2  ARG 114           HG2      ARG 114  19.190   6.694   7.070
  171    HG3  ARG 114           HG3      ARG 114  18.112   5.534   7.859
  172    HD2  ARG 114           HD2      ARG 114  21.040   5.959   8.570
  173    HD3  ARG 114           HD3      ARG 114  19.682   6.749   9.399
  174    HE   ARG 114           HE       ARG 114  19.120   4.004   9.497
  175   HH11  ARG 114          HH11      ARG 114  21.609   6.091  10.819
  176   HH12  ARG 114          HH12      ARG 114  21.907   5.032  12.171
  177   HH21  ARG 114          HH21      ARG 114  19.553   2.696  11.241
  178   HH22  ARG 114          HH22      ARG 114  20.754   3.169  12.408
  179    H    THR 115           H        THR 115  20.929   5.318   3.842
  180    HA   THR 115           HA       THR 115  21.116   3.346   1.896
  181    HB   THR 115           HB       THR 115  23.392   4.964   3.084
  182    HG1  THR 115           HG1      THR 115  22.771   6.509   1.604
  183   HG21  THR 115          HG21      THR 115  24.227   3.267   1.515
  184   HG22  THR 115          HG22      THR 115  23.008   3.747   0.305
  185   HG23  THR 115          HG23      THR 115  24.312   4.864   0.772
  186    HA   PRO 116           HA       PRO 116  22.697  -0.281   4.103
  187    HB2  PRO 116           HB2      PRO 116  23.910  -0.850   1.385
  188    HB3  PRO 116           HB3      PRO 116  23.059  -1.964   2.500
  189    HG2  PRO 116           HG2      PRO 116  21.760  -0.918   0.368
  190    HG3  PRO 116           HG3      PRO 116  20.941  -1.009   1.966
  191    HD2  PRO 116           HD2      PRO 116  22.248   1.389   0.664
  192    HD3  PRO 116           HD3      PRO 116  20.717   1.273   1.583
  193    H    ALA 117           H        ALA 117  24.613  -0.960   5.076
  194    HA   ALA 117           HA       ALA 117  26.499   0.986   5.578
  195    HB1  ALA 117           HB1      ALA 117  26.775  -2.028   5.962
  196    HB2  ALA 117           HB2      ALA 117  27.712  -0.778   6.809
  197    HB3  ALA 117           HB3      ALA 117  25.964  -0.896   7.065
  198    H    VAL 118           H        VAL 118  27.050  -1.801   3.343
  199    HA   VAL 118           HA       VAL 118  29.753  -1.083   2.741
  200    HB   VAL 118           HB       VAL 118  27.763  -2.687   1.100
  201   HG11  VAL 118          HG11      VAL 118  30.792  -2.482   0.816
  202   HG12  VAL 118          HG12      VAL 118  29.778  -3.698   0.016
  203   HG13  VAL 118          HG13      VAL 118  29.581  -1.993  -0.393
  204   HG21  VAL 118          HG21      VAL 118  29.981  -3.534   3.027
  205   HG22  VAL 118          HG22      VAL 118  28.236  -3.695   3.314
  206   HG23  VAL 118          HG23      VAL 118  29.008  -4.642   2.042
  207    H    ILE 119           H        ILE 119  26.685  -0.152   1.157
  208    HA   ILE 119           HA       ILE 119  27.907   1.334  -1.007
  209    HB   ILE 119           HB       ILE 119  25.131   1.574   0.225
  210   HG12  ILE 119          HG12      ILE 119  26.170   0.049  -2.200
  211   HG13  ILE 119          HG13      ILE 119  25.590  -0.657  -0.700
  212   HG21  ILE 119          HG21      ILE 119  25.739   3.651  -0.995
  213   HG22  ILE 119          HG22      ILE 119  26.190   2.687  -2.410
  214   HG23  ILE 119          HG23      ILE 119  24.503   2.763  -1.858
  215   HD11  ILE 119          HD11      ILE 119  23.312   0.287  -1.164
  216   HD12  ILE 119          HD12      ILE 119  23.904   0.795  -2.765
  217   HD13  ILE 119          HD13      ILE 119  23.877  -0.922  -2.337
  218    H    LYS 120           H        LYS 120  26.708   2.304   2.229
  219    HA   LYS 120           HA       LYS 120  27.417   5.082   2.133
  220    HB2  LYS 120           HB2      LYS 120  25.963   4.329   3.844
  221    HB3  LYS 120           HB3      LYS 120  27.032   3.024   4.336
  222    HG2  LYS 120           HG2      LYS 120  28.608   4.538   5.349
  223    HG3  LYS 120           HG3      LYS 120  27.726   5.954   4.715
  224    HD2  LYS 120           HD2      LYS 120  25.803   5.468   6.129
  225    HD3  LYS 120           HD3      LYS 120  26.478   3.905   6.598
  226    HE2  LYS 120           HE2      LYS 120  26.715   5.494   8.419
  227    HE3  LYS 120           HE3      LYS 120  28.292   4.962   7.835
  228    HZ1  LYS 120           HZ1      LYS 120  27.040   7.548   7.029
  229    HZ2  LYS 120           HZ2      LYS 120  28.131   7.396   8.235
  230    HZ3  LYS 120           HZ3      LYS 120  28.591   7.057   6.713
  231    H    LYS 121           H        LYS 121  29.366   2.264   3.209
  232    HA   LYS 121           HA       LYS 121  31.680   3.830   3.800
  233    HB2  LYS 121           HB2      LYS 121  31.051   1.236   4.302
  234    HB3  LYS 121           HB3      LYS 121  32.039   0.985   2.867
  235    HG2  LYS 121           HG2      LYS 121  33.612   0.887   4.601
  236    HG3  LYS 121           HG3      LYS 121  33.755   2.575   4.085
  237    HD2  LYS 121           HD2      LYS 121  31.981   3.088   5.939
  238    HD3  LYS 121           HD3      LYS 121  32.289   1.450   6.506
  239    HE2  LYS 121           HE2      LYS 121  34.234   3.790   6.390
  240    HE3  LYS 121           HE3      LYS 121  33.579   2.993   7.823
  241    HZ1  LYS 121           HZ1      LYS 121  34.822   0.942   7.030
  242    HZ2  LYS 121           HZ2      LYS 121  35.566   1.907   5.899
  243    HZ3  LYS 121           HZ3      LYS 121  35.782   2.183   7.487
  244    H    ALA 122           H        ALA 122  30.739   2.210   0.758
  245    HA   ALA 122           HA       ALA 122  33.072   2.905  -0.716
  246    HB1  ALA 122           HB1      ALA 122  31.685   2.370  -2.667
  247    HB2  ALA 122           HB2      ALA 122  31.435   1.180  -1.377
  248    HB3  ALA 122           HB3      ALA 122  30.216   2.438  -1.676
  249    H    MET 123           H        MET 123  30.038   4.772  -0.170
  250    HA   MET 123           HA       MET 123  30.723   6.985  -1.836
  251    HB2  MET 123           HB2      MET 123  29.085   6.881   0.722
  252    HB3  MET 123           HB3      MET 123  29.190   8.283  -0.331
  253    HG2  MET 123           HG2      MET 123  28.025   7.219  -2.088
  254    HG3  MET 123           HG3      MET 123  28.291   5.615  -1.434
  255    HE1  MET 123           HE1      MET 123  25.185   8.663   0.168
  256    HE2  MET 123           HE2      MET 123  26.927   8.952   0.337
  257    HE3  MET 123           HE3      MET 123  26.183   8.892  -1.280
  258    H    GLU 124           H        GLU 124  31.488   6.361   1.618
  259    HA   GLU 124           HA       GLU 124  32.896   8.843   1.962
  260    HB2  GLU 124           HB2      GLU 124  32.640   6.323   3.634
  261    HB3  GLU 124           HB3      GLU 124  33.607   7.720   4.136
  262    HG2  GLU 124           HG2      GLU 124  31.630   9.195   3.963
  263    HG3  GLU 124           HG3      GLU 124  30.637   7.822   3.464
  264    H    GLU 125           H        GLU 125  34.095   5.531   1.282
  265    HA   GLU 125           HA       GLU 125  36.904   6.537   1.443
  266    HB2  GLU 125           HB2      GLU 125  35.785   3.717   1.565
  267    HB3  GLU 125           HB3      GLU 125  37.495   4.153   1.643
  268    HG2  GLU 125           HG2      GLU 125  36.844   5.669   3.643
  269    HG3  GLU 125           HG3      GLU 125  35.333   4.762   3.681
  270    H    GLN 126           H        GLN 126  34.691   5.465  -1.014
  271    HA   GLN 126           HA       GLN 126  36.975   5.308  -2.963
  272    HB2  GLN 126           HB2      GLN 126  34.348   3.773  -3.088
  273    HB3  GLN 126           HB3      GLN 126  35.667   3.712  -4.258
  274    HG2  GLN 126           HG2      GLN 126  37.183   2.806  -2.501
  275    HG3  GLN 126           HG3      GLN 126  35.838   2.794  -1.356
  276   HE21  GLN 126          HE22      GLN 126  36.794   0.399  -1.441
  277   HE22  GLN 126          HE21      GLN 126  35.900  -0.653  -2.531
  278    H    GLY 127           H        GLY 127  34.483   7.311  -2.052
  279    HA2  GLY 127           HA2      GLY 127  33.552   9.158  -3.030
  280    HA3  GLY 127           HA3      GLY 127  34.651   8.943  -4.397
  281    H    LYS 128           H        LYS 128  32.597   6.245  -3.747
  282    HA   LYS 128           HA       LYS 128  31.218   6.488  -6.323
  283    HB2  LYS 128           HB2      LYS 128  31.191   4.442  -4.073
  284    HB3  LYS 128           HB3      LYS 128  30.137   4.310  -5.487
  285    HG2  LYS 128           HG2      LYS 128  32.042   4.321  -7.012
  286    HG3  LYS 128           HG3      LYS 128  33.170   4.551  -5.669
  287    HD2  LYS 128           HD2      LYS 128  32.601   2.364  -4.752
  288    HD3  LYS 128           HD3      LYS 128  31.370   2.112  -6.011
  289    HE2  LYS 128           HE2      LYS 128  33.051   2.102  -7.758
  290    HE3  LYS 128           HE3      LYS 128  34.303   2.661  -6.641
  291    HZ1  LYS 128           HZ1      LYS 128  34.173   0.567  -5.453
  292    HZ2  LYS 128           HZ2      LYS 128  32.964   0.010  -6.428
  293    HZ3  LYS 128           HZ3      LYS 128  34.461   0.256  -7.034
  294    H    GLN 129           H        GLN 129  28.837   5.950  -6.399
  295    HA   GLN 129           HA       GLN 129  27.186   7.326  -4.310
  296    HB2  GLN 129           HB2      GLN 129  27.091   7.763  -7.329
  297    HB3  GLN 129           HB3      GLN 129  25.851   8.331  -6.221
  298    HG2  GLN 129           HG2      GLN 129  28.761   9.236  -6.123
  299    HG3  GLN 129           HG3      GLN 129  27.465  10.083  -6.941
  300   HE21  GLN 129          HE22      GLN 129  28.771   9.262  -3.728
  301   HE22  GLN 129          HE21      GLN 129  27.770  10.451  -2.889
  302    H    LEU 130           H        LEU 130  24.754   6.810  -4.785
  303    HA   LEU 130           HA       LEU 130  24.398   4.006  -4.583
  304    HB2  LEU 130           HB2      LEU 130  22.528   6.350  -5.071
  305    HB3  LEU 130           HB3      LEU 130  21.931   4.697  -5.115
  306    HG   LEU 130           HG       LEU 130  22.612   4.270  -2.827
  307   HD11  LEU 130          HD11      LEU 130  23.308   6.121  -1.333
  308   HD12  LEU 130          HD12      LEU 130  24.541   5.740  -2.533
  309   HD13  LEU 130          HD13      LEU 130  23.505   7.181  -2.740
  310   HD21  LEU 130          HD21      LEU 130  21.004   6.844  -3.144
  311   HD22  LEU 130          HD22      LEU 130  20.373   5.190  -3.292
  312   HD23  LEU 130          HD23      LEU 130  20.982   5.766  -1.733
  313    H    GLU 131           H        GLU 131  24.323   6.047  -7.462
  314    HA   GLU 131           HA       GLU 131  23.166   4.201  -9.297
  315    HB2  GLU 131           HB2      GLU 131  23.539   6.617  -9.695
  316    HB3  GLU 131           HB3      GLU 131  25.281   6.335  -9.791
  317    HG2  GLU 131           HG2      GLU 131  24.969   4.931 -11.783
  318    HG3  GLU 131           HG3      GLU 131  23.215   5.067 -11.639
  319    H    ASP 132           H        ASP 132  26.472   4.268  -7.954
  320    HA   ASP 132           HA       ASP 132  27.610   2.432  -9.862
  321    HB2  ASP 132           HB2      ASP 132  28.433   3.101  -7.009
  322    HB3  ASP 132           HB3      ASP 132  29.361   2.105  -8.112
  323    H    PHE 133           H        PHE 133  25.292   1.991  -7.438
  324    HA   PHE 133           HA       PHE 133  25.673  -0.973  -7.330
  325    HB2  PHE 133           HB2      PHE 133  24.554   0.909  -5.225
  326    HB3  PHE 133           HB3      PHE 133  24.670  -0.834  -5.077
  327    HD1  PHE 133           HD1      PHE 133  26.893  -1.958  -4.876
  328    HD2  PHE 133           HD2      PHE 133  26.527   2.333  -4.930
  329    HE1  PHE 133           HE1      PHE 133  29.185  -1.753  -3.941
  330    HE2  PHE 133           HE2      PHE 133  28.818   2.542  -4.006
  331    HZ   PHE 133           HZ       PHE 133  30.161   0.490  -3.525
  332    H    LEU 134           H        LEU 134  23.718   1.428  -8.565
  333    HA   LEU 134           HA       LEU 134  21.061   0.305  -8.244
  334    HB2  LEU 134           HB2      LEU 134  21.544   2.708  -8.498
  335    HB3  LEU 134           HB3      LEU 134  22.360   2.393 -10.034
  336    HG   LEU 134           HG       LEU 134  20.287   1.891 -11.142
  337   HD11  LEU 134          HD11      LEU 134  18.956   0.927  -9.330
  338   HD12  LEU 134          HD12      LEU 134  18.925   2.487  -8.488
  339   HD13  LEU 134          HD13      LEU 134  18.108   2.291 -10.051
  340   HD21  LEU 134          HD21      LEU 134  19.303   4.142 -11.041
  341   HD22  LEU 134          HD22      LEU 134  20.064   4.434  -9.465
  342   HD23  LEU 134          HD23      LEU 134  21.067   4.269 -10.913
  343    H    ILE 135           H        ILE 135  20.067  -1.101  -9.431
  344    HA   ILE 135           HA       ILE 135  21.290  -2.105 -11.990
  345    HB   ILE 135           HB       ILE 135  20.927  -4.349 -11.353
  346   HG12  ILE 135          HG12      ILE 135  19.217  -3.223  -9.174
  347   HG13  ILE 135          HG13      ILE 135  18.926  -4.561 -10.257
  348   HG21  ILE 135          HG21      ILE 135  22.971  -3.160 -10.550
  349   HG22  ILE 135          HG22      ILE 135  22.194  -2.988  -8.960
  350   HG23  ILE 135          HG23      ILE 135  22.543  -4.593  -9.618
  351   HD11  ILE 135          HD11      ILE 135  20.705  -4.535  -7.796
  352   HD12  ILE 135          HD12      ILE 135  19.157  -5.363  -7.991
  353   HD13  ILE 135          HD13      ILE 135  20.569  -5.921  -8.917
  354    H    LYS 136           H        LYS 136  18.242  -1.034 -10.733
  355    HA   LYS 136           HA       LYS 136  16.876  -2.264 -13.099
  356    HB2  LYS 136           HB2      LYS 136  16.711  -3.409 -10.665
  357    HB3  LYS 136           HB3      LYS 136  15.405  -2.241 -10.475
  358    HG2  LYS 136           HG2      LYS 136  14.402  -3.139 -12.636
  359    HG3  LYS 136           HG3      LYS 136  15.756  -4.255 -12.752
  360    HD2  LYS 136           HD2      LYS 136  13.908  -5.483 -11.927
  361    HD3  LYS 136           HD3      LYS 136  15.055  -5.305 -10.584
  362    HE2  LYS 136           HE2      LYS 136  13.699  -3.559  -9.572
  363    HE3  LYS 136           HE3      LYS 136  12.664  -3.449 -11.003
  364    HZ1  LYS 136           HZ1      LYS 136  11.647  -4.773  -9.184
  365    HZ2  LYS 136           HZ2      LYS 136  11.808  -5.653 -10.546
  366    HZ3  LYS 136           HZ3      LYS 136  12.843  -5.894  -9.300
  367    H    GLU 137           H        GLU 137  17.682   0.524 -12.700
  368    HA   GLU 137           HA       GLU 137  15.068   1.661 -13.593
  369    HB2  GLU 137           HB2      GLU 137  15.736   2.171 -11.093
  370    HB3  GLU 137           HB3      GLU 137  16.850   3.327 -11.814
  371    HG2  GLU 137           HG2      GLU 137  14.783   4.316 -13.025
  372    HG3  GLU 137           HG3      GLU 137  13.805   3.230 -12.044
  373    H    LEU 138           H        LEU 138  17.673   0.774 -14.898
  374    HA   LEU 138           HA       LEU 138  18.485   3.329 -16.223
  375    HB2  LEU 138           HB2      LEU 138  20.286   1.026 -15.374
  376    HB3  LEU 138           HB3      LEU 138  20.808   2.495 -16.179
  377    HG   LEU 138           HG       LEU 138  19.641   2.373 -13.370
  378   HD11  LEU 138          HD11      LEU 138  21.860   1.362 -13.513
  379   HD12  LEU 138          HD12      LEU 138  22.491   2.798 -14.345
  380   HD13  LEU 138          HD13      LEU 138  21.947   2.912 -12.663
  381   HD21  LEU 138          HD21      LEU 138  19.164   4.556 -14.370
  382   HD22  LEU 138          HD22      LEU 138  20.443   4.715 -13.176
  383   HD23  LEU 138          HD23      LEU 138  20.857   4.710 -14.906
  384    H    GLU 139           H        GLU 139  16.594   1.219 -17.040
  385    HA   GLU 139           HA       GLU 139  17.525   0.808 -19.812
  386    HB2  GLU 139           HB2      GLU 139  18.273  -1.220 -18.569
  387    HB3  GLU 139           HB3      GLU 139  16.596  -1.535 -18.102
  388    HG2  GLU 139           HG2      GLU 139  15.967  -1.792 -20.481
  389    HG3  GLU 139           HG3      GLU 139  17.610  -1.373 -20.976
  Start of MODEL   12
    1    H1   ALA  91           H1       ALA  91  10.203 -15.351  -1.768
    2    H2   ALA  91           H2       ALA  91  11.572 -14.648  -1.216
    3    H3   ALA  91           H3       ALA  91  10.376 -15.049  -0.168
    4    HA   ALA  91           HA       ALA  91   8.877 -13.443  -1.144
    5    HB1  ALA  91           HB1      ALA  91  10.255 -12.738   0.801
    6    HB2  ALA  91           HB2      ALA  91  11.540 -12.194  -0.306
    7    HB3  ALA  91           HB3      ALA  91   9.956 -11.394  -0.307
    8    H    ALA  92           H        ALA  92   8.581 -11.572  -2.543
    9    HA   ALA  92           HA       ALA  92  10.323 -11.507  -4.979
   10    HB1  ALA  92           HB1      ALA  92   7.295 -11.856  -4.889
   11    HB2  ALA  92           HB2      ALA  92   8.300 -11.758  -6.350
   12    HB3  ALA  92           HB3      ALA  92   8.475 -13.137  -5.255
   13    H    ARG  93           H        ARG  93   9.802  -9.540  -2.673
   14    HA   ARG  93           HA       ARG  93   8.309  -7.292  -3.711
   15    HB2  ARG  93           HB2      ARG  93  10.450  -7.519  -1.543
   16    HB3  ARG  93           HB3      ARG  93   9.596  -6.022  -1.911
   17    HG2  ARG  93           HG2      ARG  93   7.422  -7.107  -1.414
   18    HG3  ARG  93           HG3      ARG  93   8.269  -8.613  -1.000
   19    HD2  ARG  93           HD2      ARG  93   9.493  -7.434   0.800
   20    HD3  ARG  93           HD3      ARG  93   8.654  -5.924   0.386
   21    HE   ARG  93           HE       ARG  93   6.674  -7.898   0.859
   22   HH11  ARG  93          HH11      ARG  93   9.063  -6.172   2.763
   23   HH12  ARG  93          HH12      ARG  93   8.130  -6.310   4.229
   24   HH21  ARG  93          HH21      ARG  93   5.534  -8.035   2.769
   25   HH22  ARG  93          HH22      ARG  93   6.187  -7.345   4.227
   26    HA   PRO  94           HA       PRO  94  11.268  -5.519  -6.501
   27    HB2  PRO  94           HB2      PRO  94  10.549  -2.870  -6.542
   28    HB3  PRO  94           HB3      PRO  94   9.522  -4.172  -7.218
   29    HG2  PRO  94           HG2      PRO  94   9.336  -2.889  -4.473
   30    HG3  PRO  94           HG3      PRO  94   8.017  -3.150  -5.662
   31    HD2  PRO  94           HD2      PRO  94   8.458  -4.873  -3.602
   32    HD3  PRO  94           HD3      PRO  94   7.950  -5.465  -5.207
   33    H    ALA  95           H        ALA  95  13.028  -3.928  -6.696
   34    HA   ALA  95           HA       ALA  95  14.086  -2.647  -4.263
   35    HB1  ALA  95           HB1      ALA  95  14.912  -4.966  -4.094
   36    HB2  ALA  95           HB2      ALA  95  15.572  -4.874  -5.743
   37    HB3  ALA  95           HB3      ALA  95  16.250  -3.864  -4.445
   38    H    LYS  96           H        LYS  96  16.232  -1.516  -4.809
   39    HA   LYS  96           HA       LYS  96  16.187  -0.385  -7.565
   40    HB2  LYS  96           HB2      LYS  96  16.627   1.055  -4.932
   41    HB3  LYS  96           HB3      LYS  96  16.867   1.782  -6.527
   42    HG2  LYS  96           HG2      LYS  96  14.429   1.368  -7.019
   43    HG3  LYS  96           HG3      LYS  96  14.244   0.784  -5.350
   44    HD2  LYS  96           HD2      LYS  96  15.194   3.023  -4.556
   45    HD3  LYS  96           HD3      LYS  96  15.181   3.555  -6.232
   46    HE2  LYS  96           HE2      LYS  96  13.251   4.464  -5.181
   47    HE3  LYS  96           HE3      LYS  96  12.700   3.224  -6.308
   48    HZ1  LYS  96           HZ1      LYS  96  12.284   1.744  -4.456
   49    HZ2  LYS  96           HZ2      LYS  96  13.066   2.706  -3.382
   50    HZ3  LYS  96           HZ3      LYS  96  11.632   3.173  -4.035
   51    H    TYR  97           H        TYR  97  18.225  -1.474  -4.920
   52    HA   TYR  97           HA       TYR  97  20.623  -1.130  -6.673
   53    HB2  TYR  97           HB2      TYR  97  20.687  -0.645  -3.687
   54    HB3  TYR  97           HB3      TYR  97  21.886  -0.205  -4.884
   55    HD1  TYR  97           HD1      TYR  97  21.471   1.789  -6.391
   56    HD2  TYR  97           HD2      TYR  97  18.816   0.757  -3.147
   57    HE1  TYR  97           HE1      TYR  97  20.398   4.043  -6.528
   58    HE2  TYR  97           HE2      TYR  97  17.760   2.995  -3.308
   59    HH   TYR  97           HH       TYR  97  17.693   5.017  -4.401
   60    H    SER  98           H        SER  98  22.453  -2.533  -6.082
   61    HA   SER  98           HA       SER  98  21.902  -4.803  -4.257
   62    HB2  SER  98           HB2      SER  98  21.123  -5.397  -6.608
   63    HB3  SER  98           HB3      SER  98  22.818  -5.251  -7.113
   64    HG   SER  98           HG       SER  98  22.298  -7.422  -6.539
   65    H    TYR  99           H        TYR  99  23.704  -5.782  -3.415
   66    HA   TYR  99           HA       TYR  99  26.358  -4.706  -4.193
   67    HB2  TYR  99           HB2      TYR  99  26.911  -4.073  -1.961
   68    HB3  TYR  99           HB3      TYR  99  25.504  -3.211  -2.506
   69    HD1  TYR  99           HD2      TYR  99  23.267  -3.653  -1.541
   70    HD2  TYR  99           HD1      TYR  99  26.790  -5.664  -0.074
   71    HE1  TYR  99           HE2      TYR  99  22.121  -4.077   0.625
   72    HE2  TYR  99           HE1      TYR  99  25.644  -6.065   2.104
   73    HH   TYR  99           HH       TYR  99  22.345  -4.881   2.790
   74    H    VAL 100           H        VAL 100  28.135  -5.575  -3.051
   75    HA   VAL 100           HA       VAL 100  28.141  -8.561  -2.903
   76    HB   VAL 100           HB       VAL 100  29.986  -6.677  -4.464
   77   HG11  VAL 100          HG11      VAL 100  29.913  -9.712  -4.569
   78   HG12  VAL 100          HG12      VAL 100  30.942  -8.646  -5.532
   79   HG13  VAL 100          HG13      VAL 100  31.182  -8.737  -3.796
   80   HG21  VAL 100          HG21      VAL 100  29.052  -7.715  -6.531
   81   HG22  VAL 100          HG22      VAL 100  27.821  -8.532  -5.550
   82   HG23  VAL 100          HG23      VAL 100  27.864  -6.761  -5.657
   83    H    ASP 101           H        ASP 101  29.910  -9.421  -1.715
   84    HA   ASP 101           HA       ASP 101  31.665  -7.572  -0.191
   85    HB2  ASP 101           HB2      ASP 101  29.460  -8.181   1.041
   86    HB3  ASP 101           HB3      ASP 101  30.143  -9.794   1.194
   87    H    GLU 102           H        GLU 102  32.952  -9.481   1.413
   88    HA   GLU 102           HA       GLU 102  35.034 -10.182  -0.347
   89    HB2  GLU 102           HB2      GLU 102  35.126  -9.764   2.134
   90    HB3  GLU 102           HB3      GLU 102  34.431 -11.375   2.389
   91    HG2  GLU 102           HG2      GLU 102  36.386 -12.408   1.302
   92    HG3  GLU 102           HG3      GLU 102  37.041 -10.819   0.906
   93    H    ASN 103           H        ASN 103  32.458 -12.285   0.961
   94    HA   ASN 103           HA       ASN 103  33.587 -14.711  -0.107
   95    HB2  ASN 103           HB2      ASN 103  32.286 -14.465   2.028
   96    HB3  ASN 103           HB3      ASN 103  30.839 -14.133   1.072
   97   HD21  ASN 103          HD22      ASN 103  29.597 -15.939   1.473
   98   HD22  ASN 103          HD21      ASN 103  30.152 -17.587   1.216
   99    H    GLY 104           H        GLY 104  31.560 -12.303  -1.551
  100    HA2  GLY 104           HA2      GLY 104  31.300 -13.009  -4.104
  101    HA3  GLY 104           HA3      GLY 104  30.171 -14.165  -3.394
  102    H    GLU 105           H        GLU 105  28.684 -12.942  -4.898
  103    HA   GLU 105           HA       GLU 105  27.691 -10.353  -4.288
  104    HB2  GLU 105           HB2      GLU 105  25.673 -10.993  -5.442
  105    HB3  GLU 105           HB3      GLU 105  27.103 -11.512  -6.334
  106    HG2  GLU 105           HG2      GLU 105  26.778 -13.840  -5.431
  107    HG3  GLU 105           HG3      GLU 105  25.303 -13.290  -4.630
  108    H    THR 106           H        THR 106  25.987  -9.580  -2.960
  109    HA   THR 106           HA       THR 106  25.580 -11.281  -0.578
  110    HB   THR 106           HB       THR 106  25.852  -8.276  -0.743
  111    HG1  THR 106           HG1      THR 106  27.661 -10.279   0.149
  112   HG21  THR 106          HG21      THR 106  25.724 -10.147   1.644
  113   HG22  THR 106          HG22      THR 106  26.199  -8.424   1.688
  114   HG23  THR 106          HG23      THR 106  24.567  -8.874   1.183
  115    H    LYS 107           H        LYS 107  23.947  -8.249  -1.687
  116    HA   LYS 107           HA       LYS 107  21.386  -9.532  -2.029
  117    HB2  LYS 107           HB2      LYS 107  20.167  -8.867  -0.067
  118    HB3  LYS 107           HB3      LYS 107  21.530  -9.819   0.438
  119    HG2  LYS 107           HG2      LYS 107  22.754  -7.698   1.056
  120    HG3  LYS 107           HG3      LYS 107  21.327  -6.784   0.567
  121    HD2  LYS 107           HD2      LYS 107  21.202  -7.007   2.937
  122    HD3  LYS 107           HD3      LYS 107  19.970  -8.064   2.262
  123    HE2  LYS 107           HE2      LYS 107  21.489 -10.022   2.583
  124    HE3  LYS 107           HE3      LYS 107  22.746  -8.947   3.204
  125    HZ1  LYS 107           HZ1      LYS 107  21.496  -9.991   5.017
  126    HZ2  LYS 107           HZ2      LYS 107  21.246  -8.379   5.059
  127    HZ3  LYS 107           HZ3      LYS 107  20.085  -9.376   4.483
  128    H    THR 108           H        THR 108  19.497  -7.895  -1.842
  129    HA   THR 108           HA       THR 108  20.230  -5.453  -3.354
  130    HB   THR 108           HB       THR 108  17.797  -5.432  -3.933
  131    HG1  THR 108           HG1      THR 108  16.672  -7.417  -3.527
  132   HG21  THR 108          HG21      THR 108  17.884  -7.276  -5.539
  133   HG22  THR 108          HG22      THR 108  19.430  -6.424  -5.475
  134   HG23  THR 108          HG23      THR 108  19.262  -7.998  -4.674
  135    H    TRP 109           H        TRP 109  18.881  -3.527  -3.051
  136    HA   TRP 109           HA       TRP 109  17.730  -3.091  -0.350
  137    HB2  TRP 109           HB2      TRP 109  20.122  -2.522  -0.174
  138    HB3  TRP 109           HB3      TRP 109  19.985  -1.436  -1.547
  139    HD1  TRP 109           HD1      TRP 109  17.867  -1.704   1.713
  140    HE1  TRP 109           HE1      TRP 109  17.691   0.624   2.783
  141    HE3  TRP 109           HE3      TRP 109  20.914   0.917  -1.491
  142    HZ2  TRP 109           HZ2      TRP 109  18.838   3.229   2.406
  143    HZ3  TRP 109           HZ3      TRP 109  21.383   3.310  -1.065
  144    HH2  TRP 109           HH2      TRP 109  20.358   4.480   0.863
  145    H    THR 110           H        THR 110  16.437  -1.162  -0.197
  146    HA   THR 110           HA       THR 110  14.958  -0.635  -2.722
  147    HB   THR 110           HB       THR 110  13.100  -0.115  -1.110
  148    HG1  THR 110           HG1      THR 110  13.541  -0.647   1.096
  149   HG21  THR 110          HG21      THR 110  12.708  -2.384  -0.313
  150   HG22  THR 110          HG22      THR 110  13.420  -2.463  -1.932
  151   HG23  THR 110          HG23      THR 110  14.422  -2.801  -0.502
  152    H    GLY 111           H        GLY 111  17.066   1.108  -0.675
  153    HA2  GLY 111           HA2      GLY 111  17.596   3.392  -0.735
  154    HA3  GLY 111           HA3      GLY 111  16.152   3.729  -1.693
  155    H    GLN 112           H        GLN 112  15.638   1.830   1.187
  156    HA   GLN 112           HA       GLN 112  14.769   4.225   2.752
  157    HB2  GLN 112           HB2      GLN 112  13.333   1.564   2.414
  158    HB3  GLN 112           HB3      GLN 112  12.898   2.777   3.611
  159    HG2  GLN 112           HG2      GLN 112  12.848   3.192   0.586
  160    HG3  GLN 112           HG3      GLN 112  11.451   2.861   1.603
  161   HE21  GLN 112          HE22      GLN 112  11.734   5.211  -0.087
  162   HE22  GLN 112          HE21      GLN 112  11.744   6.590   1.002
  163    H    GLY 113           H        GLY 113  14.761   3.997   5.039
  164    HA2  GLY 113           HA2      GLY 113  15.798   3.434   7.052
  165    HA3  GLY 113           HA3      GLY 113  16.258   1.873   6.376
  166    H    ARG 114           H        ARG 114  18.273   2.452   7.653
  167    HA   ARG 114           HA       ARG 114  20.124   4.460   6.673
  168    HB2  ARG 114           HB2      ARG 114  20.576   1.901   8.278
  169    HB3  ARG 114           HB3      ARG 114  21.833   3.096   7.922
  170    HG2  ARG 114           HG2      ARG 114  20.505   4.850   9.088
  171    HG3  ARG 114           HG3      ARG 114  19.288   3.629   9.518
  172    HD2  ARG 114           HD2      ARG 114  21.043   2.337  10.741
  173    HD3  ARG 114           HD3      ARG 114  22.236   3.557  10.291
  174    HE   ARG 114           HE       ARG 114  21.373   5.061  11.840
  175   HH11  ARG 114          HH11      ARG 114  19.241   2.267  11.820
  176   HH12  ARG 114          HH12      ARG 114  18.424   2.777  13.273
  177   HH21  ARG 114          HH21      ARG 114  20.283   5.643  13.675
  178   HH22  ARG 114          HH22      ARG 114  18.995   4.647  14.285
  179    H    THR 115           H        THR 115  21.696   4.371   5.159
  180    HA   THR 115           HA       THR 115  21.664   2.601   2.974
  181    HB   THR 115           HB       THR 115  24.034   4.208   4.003
  182    HG1  THR 115           HG1      THR 115  23.167   5.865   2.732
  183   HG21  THR 115          HG21      THR 115  24.646   2.707   2.134
  184   HG22  THR 115          HG22      THR 115  23.295   3.345   1.168
  185   HG23  THR 115          HG23      THR 115  24.657   4.393   1.617
  186    HA   PRO 116           HA       PRO 116  23.655  -0.969   4.827
  187    HB2  PRO 116           HB2      PRO 116  24.402  -2.400   2.586
  188    HB3  PRO 116           HB3      PRO 116  22.733  -2.309   3.233
  189    HG2  PRO 116           HG2      PRO 116  23.965  -0.685   1.009
  190    HG3  PRO 116           HG3      PRO 116  22.371  -1.509   1.016
  191    HD2  PRO 116           HD2      PRO 116  22.581   1.144   1.515
  192    HD3  PRO 116           HD3      PRO 116  21.431   0.132   2.443
  193    H    ALA 117           H        ALA 117  25.692  -1.793   5.290
  194    HA   ALA 117           HA       ALA 117  27.624   0.060   5.675
  195    HB1  ALA 117           HB1      ALA 117  28.009  -2.963   5.499
  196    HB2  ALA 117           HB2      ALA 117  29.096  -1.819   6.327
  197    HB3  ALA 117           HB3      ALA 117  27.439  -2.037   6.906
  198    H    VAL 118           H        VAL 118  28.090  -2.445   3.062
  199    HA   VAL 118           HA       VAL 118  30.543  -1.273   2.257
  200    HB   VAL 118           HB       VAL 118  29.867  -3.586   1.757
  201   HG11  VAL 118          HG11      VAL 118  28.259  -2.429  -0.555
  202   HG12  VAL 118          HG12      VAL 118  28.566  -4.135  -0.200
  203   HG13  VAL 118          HG13      VAL 118  27.558  -3.175   0.901
  204   HG21  VAL 118          HG21      VAL 118  30.993  -3.756  -0.385
  205   HG22  VAL 118          HG22      VAL 118  30.738  -2.029  -0.711
  206   HG23  VAL 118          HG23      VAL 118  31.797  -2.541   0.624
  207    H    ILE 119           H        ILE 119  27.256  -0.487   1.174
  208    HA   ILE 119           HA       ILE 119  28.103   1.261  -0.999
  209    HB   ILE 119           HB       ILE 119  25.468   1.155   0.525
  210   HG12  ILE 119          HG12      ILE 119  26.456  -0.156  -2.039
  211   HG13  ILE 119          HG13      ILE 119  25.836  -0.942  -0.597
  212   HG21  ILE 119          HG21      ILE 119  25.836   3.369  -0.568
  213   HG22  ILE 119          HG22      ILE 119  26.123   2.538  -2.115
  214   HG23  ILE 119          HG23      ILE 119  24.536   2.468  -1.314
  215   HD11  ILE 119          HD11      ILE 119  24.247   0.590  -2.683
  216   HD12  ILE 119          HD12      ILE 119  24.160  -1.125  -2.284
  217   HD13  ILE 119          HD13      ILE 119  23.559   0.082  -1.126
  218    H    LYS 120           H        LYS 120  27.200   1.816   2.444
  219    HA   LYS 120           HA       LYS 120  27.651   4.644   2.541
  220    HB2  LYS 120           HB2      LYS 120  26.532   3.606   4.356
  221    HB3  LYS 120           HB3      LYS 120  27.784   2.387   4.583
  222    HG2  LYS 120           HG2      LYS 120  29.350   4.011   5.478
  223    HG3  LYS 120           HG3      LYS 120  28.231   5.349   5.113
  224    HD2  LYS 120           HD2      LYS 120  26.586   4.390   6.718
  225    HD3  LYS 120           HD3      LYS 120  27.713   3.050   7.059
  226    HE2  LYS 120           HE2      LYS 120  29.416   4.707   7.832
  227    HE3  LYS 120           HE3      LYS 120  28.286   6.023   7.505
  228    HZ1  LYS 120           HZ1      LYS 120  28.250   5.390   9.856
  229    HZ2  LYS 120           HZ2      LYS 120  26.790   5.070   9.200
  230    HZ3  LYS 120           HZ3      LYS 120  27.840   3.850   9.503
  231    H    LYS 121           H        LYS 121  29.931   1.972   3.161
  232    HA   LYS 121           HA       LYS 121  32.205   3.630   3.681
  233    HB2  LYS 121           HB2      LYS 121  31.942   0.746   2.740
  234    HB3  LYS 121           HB3      LYS 121  33.488   1.464   3.187
  235    HG2  LYS 121           HG2      LYS 121  31.116   1.451   5.101
  236    HG3  LYS 121           HG3      LYS 121  32.208   0.078   4.978
  237    HD2  LYS 121           HD2      LYS 121  33.195   2.902   5.578
  238    HD3  LYS 121           HD3      LYS 121  32.618   1.804   6.835
  239    HE2  LYS 121           HE2      LYS 121  34.287   0.120   6.252
  240    HE3  LYS 121           HE3      LYS 121  34.855   1.088   4.882
  241    HZ1  LYS 121           HZ1      LYS 121  35.024   1.999   7.714
  242    HZ2  LYS 121           HZ2      LYS 121  36.269   1.339   6.874
  243    HZ3  LYS 121           HZ3      LYS 121  35.646   2.766   6.390
  244    H    ALA 122           H        ALA 122  31.102   2.154   0.607
  245    HA   ALA 122           HA       ALA 122  33.230   3.174  -0.993
  246    HB1  ALA 122           HB1      ALA 122  30.360   2.480  -1.766
  247    HB2  ALA 122           HB2      ALA 122  31.745   2.621  -2.868
  248    HB3  ALA 122           HB3      ALA 122  31.720   1.334  -1.658
  249    H    MET 123           H        MET 123  30.050   4.653  -0.133
  250    HA   MET 123           HA       MET 123  30.375   7.004  -1.726
  251    HB2  MET 123           HB2      MET 123  28.797   6.488   0.820
  252    HB3  MET 123           HB3      MET 123  28.739   8.008  -0.072
  253    HG2  MET 123           HG2      MET 123  27.827   6.933  -2.025
  254    HG3  MET 123           HG3      MET 123  28.089   5.335  -1.351
  255    HE1  MET 123           HE1      MET 123  25.903   8.557  -1.382
  256    HE2  MET 123           HE2      MET 123  24.783   8.308  -0.026
  257    HE3  MET 123           HE3      MET 123  26.500   8.649   0.292
  258    H    GLU 124           H        GLU 124  31.208   6.426   1.744
  259    HA   GLU 124           HA       GLU 124  32.217   9.082   2.122
  260    HB2  GLU 124           HB2      GLU 124  32.513   6.540   3.766
  261    HB3  GLU 124           HB3      GLU 124  33.135   8.116   4.259
  262    HG2  GLU 124           HG2      GLU 124  30.806   9.057   4.018
  263    HG3  GLU 124           HG3      GLU 124  30.214   7.413   3.792
  264    H    GLU 125           H        GLU 125  33.965   5.997   1.504
  265    HA   GLU 125           HA       GLU 125  36.557   7.492   1.620
  266    HB2  GLU 125           HB2      GLU 125  35.886   4.568   2.026
  267    HB3  GLU 125           HB3      GLU 125  37.519   5.250   2.059
  268    HG2  GLU 125           HG2      GLU 125  36.806   6.807   3.899
  269    HG3  GLU 125           HG3      GLU 125  35.249   5.980   3.961
  270    H    GLN 126           H        GLN 126  34.596   5.971  -0.746
  271    HA   GLN 126           HA       GLN 126  36.880   6.175  -2.692
  272    HB2  GLN 126           HB2      GLN 126  34.590   4.183  -2.727
  273    HB3  GLN 126           HB3      GLN 126  35.783   4.368  -4.000
  274    HG2  GLN 126           HG2      GLN 126  36.504   3.584  -1.138
  275    HG3  GLN 126           HG3      GLN 126  36.167   2.444  -2.430
  276   HE21  GLN 126          HE22      GLN 126  38.486   5.025  -1.438
  277   HE22  GLN 126          HE21      GLN 126  39.772   4.414  -2.479
  278    H    GLY 127           H        GLY 127  34.226   7.828  -1.778
  279    HA2  GLY 127           HA2      GLY 127  33.138   9.592  -2.741
  280    HA3  GLY 127           HA3      GLY 127  34.266   9.480  -4.089
  281    H    LYS 128           H        LYS 128  32.309   6.662  -3.465
  282    HA   LYS 128           HA       LYS 128  31.044   6.827  -6.082
  283    HB2  LYS 128           HB2      LYS 128  30.635   4.942  -3.708
  284    HB3  LYS 128           HB3      LYS 128  29.819   4.730  -5.244
  285    HG2  LYS 128           HG2      LYS 128  32.839   4.615  -4.838
  286    HG3  LYS 128           HG3      LYS 128  31.727   3.261  -5.073
  287    HD2  LYS 128           HD2      LYS 128  31.084   4.367  -7.322
  288    HD3  LYS 128           HD3      LYS 128  32.535   5.368  -7.109
  289    HE2  LYS 128           HE2      LYS 128  33.937   3.352  -6.955
  290    HE3  LYS 128           HE3      LYS 128  32.487   2.324  -7.019
  291    HZ1  LYS 128           HZ1      LYS 128  32.066   3.004  -9.253
  292    HZ2  LYS 128           HZ2      LYS 128  33.290   4.119  -9.253
  293    HZ3  LYS 128           HZ3      LYS 128  33.626   2.520  -9.191
  294    H    GLN 129           H        GLN 129  28.738   6.397  -6.381
  295    HA   GLN 129           HA       GLN 129  26.850   7.637  -4.449
  296    HB2  GLN 129           HB2      GLN 129  27.020   8.249  -7.436
  297    HB3  GLN 129           HB3      GLN 129  25.638   8.658  -6.412
  298    HG2  GLN 129           HG2      GLN 129  27.125  10.068  -4.988
  299    HG3  GLN 129           HG3      GLN 129  28.480   9.710  -6.061
  300   HE21  GLN 129          HE22      GLN 129  25.438  11.539  -5.757
  301   HE22  GLN 129          HE21      GLN 129  25.703  12.483  -7.214
  302    H    LEU 130           H        LEU 130  24.536   6.900  -5.063
  303    HA   LEU 130           HA       LEU 130  24.594   4.078  -4.890
  304    HB2  LEU 130           HB2      LEU 130  22.173   5.733  -5.657
  305    HB3  LEU 130           HB3      LEU 130  22.227   4.132  -4.893
  306    HG   LEU 130           HG       LEU 130  22.941   6.754  -3.613
  307   HD11  LEU 130          HD11      LEU 130  20.770   4.729  -2.995
  308   HD12  LEU 130          HD12      LEU 130  21.067   6.242  -2.116
  309   HD13  LEU 130          HD13      LEU 130  20.539   6.292  -3.803
  310   HD21  LEU 130          HD21      LEU 130  24.492   5.065  -2.740
  311   HD22  LEU 130          HD22      LEU 130  23.263   5.400  -1.518
  312   HD23  LEU 130          HD23      LEU 130  23.148   3.925  -2.507
  313    H    GLU 131           H        GLU 131  24.307   6.041  -7.740
  314    HA   GLU 131           HA       GLU 131  23.290   4.154  -9.604
  315    HB2  GLU 131           HB2      GLU 131  24.325   5.477 -11.326
  316    HB3  GLU 131           HB3      GLU 131  23.555   6.511 -10.125
  317    HG2  GLU 131           HG2      GLU 131  25.786   6.977  -9.105
  318    HG3  GLU 131           HG3      GLU 131  26.551   5.932 -10.300
  319    H    ASP 132           H        ASP 132  26.444   4.148  -8.035
  320    HA   ASP 132           HA       ASP 132  27.700   2.322  -9.880
  321    HB2  ASP 132           HB2      ASP 132  28.816   3.810  -8.103
  322    HB3  ASP 132           HB3      ASP 132  28.362   2.578  -6.928
  323    H    PHE 133           H        PHE 133  25.237   1.885  -7.557
  324    HA   PHE 133           HA       PHE 133  25.514  -1.095  -7.465
  325    HB2  PHE 133           HB2      PHE 133  24.311   0.816  -5.429
  326    HB3  PHE 133           HB3      PHE 133  24.421  -0.923  -5.264
  327    HD1  PHE 133           HD1      PHE 133  26.659  -2.040  -4.966
  328    HD2  PHE 133           HD2      PHE 133  26.219   2.247  -4.938
  329    HE1  PHE 133           HE1      PHE 133  28.878  -1.815  -3.866
  330    HE2  PHE 133           HE2      PHE 133  28.425   2.470  -3.828
  331    HZ   PHE 133           HZ       PHE 133  29.765   0.432  -3.296
  332    H    LEU 134           H        LEU 134  23.576   1.448  -8.574
  333    HA   LEU 134           HA       LEU 134  20.915   0.623  -8.344
  334    HB2  LEU 134           HB2      LEU 134  21.715   2.807  -8.995
  335    HB3  LEU 134           HB3      LEU 134  22.498   2.172 -10.435
  336    HG   LEU 134           HG       LEU 134  20.572   3.584 -10.858
  337   HD11  LEU 134          HD11      LEU 134  21.245   1.888 -12.536
  338   HD12  LEU 134          HD12      LEU 134  19.970   0.818 -11.924
  339   HD13  LEU 134          HD13      LEU 134  19.550   2.385 -12.612
  340   HD21  LEU 134          HD21      LEU 134  19.163   2.949  -8.946
  341   HD22  LEU 134          HD22      LEU 134  18.315   2.867 -10.500
  342   HD23  LEU 134          HD23      LEU 134  18.847   1.379  -9.700
  343    H    ILE 135           H        ILE 135  19.617  -0.694  -9.262
  344    HA   ILE 135           HA       ILE 135  20.460  -2.338 -11.631
  345    HB   ILE 135           HB       ILE 135  19.374  -4.247 -10.748
  346   HG12  ILE 135          HG12      ILE 135  18.088  -2.332  -8.846
  347   HG13  ILE 135          HG13      ILE 135  17.412  -3.684  -9.720
  348   HG21  ILE 135          HG21      ILE 135  20.807  -4.780  -8.926
  349   HG22  ILE 135          HG22      ILE 135  21.692  -3.690  -9.993
  350   HG23  ILE 135          HG23      ILE 135  21.011  -3.069  -8.477
  351   HD11  ILE 135          HD11      ILE 135  19.114  -3.813  -7.207
  352   HD12  ILE 135          HD12      ILE 135  17.379  -4.108  -7.331
  353   HD13  ILE 135          HD13      ILE 135  18.516  -5.243  -8.091
  354    H    LYS 136           H        LYS 136  17.979  -0.205 -10.532
  355    HA   LYS 136           HA       LYS 136  16.208  -0.988 -12.803
  356    HB2  LYS 136           HB2      LYS 136  15.601  -2.314 -10.815
  357    HB3  LYS 136           HB3      LYS 136  15.301  -0.849  -9.890
  358    HG2  LYS 136           HG2      LYS 136  13.447  -0.249 -11.383
  359    HG3  LYS 136           HG3      LYS 136  13.840  -1.606 -12.457
  360    HD2  LYS 136           HD2      LYS 136  13.417  -3.192 -10.580
  361    HD3  LYS 136           HD3      LYS 136  12.926  -1.849  -9.547
  362    HE2  LYS 136           HE2      LYS 136  11.594  -2.486 -12.223
  363    HE3  LYS 136           HE3      LYS 136  11.086  -3.239 -10.713
  364    HZ1  LYS 136           HZ1      LYS 136   9.727  -1.301 -11.192
  365    HZ2  LYS 136           HZ2      LYS 136  10.571  -1.016  -9.829
  366    HZ3  LYS 136           HZ3      LYS 136  11.003  -0.291 -11.235
  367    H    GLU 137           H        GLU 137  15.838   1.283 -10.014
  368    HA   GLU 137           HA       GLU 137  15.494   3.559 -11.916
  369    HB2  GLU 137           HB2      GLU 137  13.407   2.373 -10.051
  370    HB3  GLU 137           HB3      GLU 137  13.363   4.080 -10.509
  371    HG2  GLU 137           HG2      GLU 137  13.193   3.552 -12.858
  372    HG3  GLU 137           HG3      GLU 137  13.397   1.828 -12.542
  373    H    LEU 138           H        LEU 138  15.562   5.621 -10.996
  374    HA   LEU 138           HA       LEU 138  16.409   5.989  -8.208
  375    HB2  LEU 138           HB2      LEU 138  18.316   5.648 -10.319
  376    HB3  LEU 138           HB3      LEU 138  18.268   7.369 -10.022
  377    HG   LEU 138           HG       LEU 138  18.771   5.208  -7.927
  378   HD11  LEU 138          HD11      LEU 138  20.594   5.469  -9.579
  379   HD12  LEU 138          HD12      LEU 138  20.673   7.207  -9.225
  380   HD13  LEU 138          HD13      LEU 138  21.093   6.016  -7.972
  381   HD21  LEU 138          HD21      LEU 138  19.537   7.109  -6.488
  382   HD22  LEU 138          HD22      LEU 138  18.928   8.252  -7.700
  383   HD23  LEU 138          HD23      LEU 138  17.813   7.169  -6.822
  384    H    GLU 139           H        GLU 139  16.879   8.431  -7.878
  385    HA   GLU 139           HA       GLU 139  15.349  10.300  -9.555
  386    HB2  GLU 139           HB2      GLU 139  13.656   9.280  -8.037
  387    HB3  GLU 139           HB3      GLU 139  14.598   9.810  -6.642
  388    HG2  GLU 139           HG2      GLU 139  14.288  12.173  -7.318
  389    HG3  GLU 139           HG3      GLU 139  13.435  11.656  -8.774
  Start of MODEL   13
    1    H1   ALA  91           H1       ALA  91   7.494   4.126   1.629
    2    H2   ALA  91           H2       ALA  91   6.500   3.734   0.385
    3    H3   ALA  91           H3       ALA  91   6.333   2.985   1.828
    4    HA   ALA  91           HA       ALA  91   8.653   2.756   0.029
    5    HB1  ALA  91           HB1      ALA  91   9.535   1.063   1.590
    6    HB2  ALA  91           HB2      ALA  91   9.330   2.613   2.411
    7    HB3  ALA  91           HB3      ALA  91   8.152   1.308   2.675
    8    H    ALA  92           H        ALA  92   9.009   0.431  -0.698
    9    HA   ALA  92           HA       ALA  92   6.527  -1.158  -1.020
   10    HB1  ALA  92           HB1      ALA  92   6.591   0.437  -2.931
   11    HB2  ALA  92           HB2      ALA  92   8.213  -0.146  -3.357
   12    HB3  ALA  92           HB3      ALA  92   6.810  -1.238  -3.462
   13    H    ARG  93           H        ARG  93   6.906  -3.297  -1.875
   14    HA   ARG  93           HA       ARG  93   8.980  -4.611  -0.502
   15    HB2  ARG  93           HB2      ARG  93   6.732  -5.508  -0.942
   16    HB3  ARG  93           HB3      ARG  93   7.136  -5.712  -2.647
   17    HG2  ARG  93           HG2      ARG  93   8.880  -7.372  -2.047
   18    HG3  ARG  93           HG3      ARG  93   8.580  -7.069  -0.327
   19    HD2  ARG  93           HD2      ARG  93   7.474  -9.109  -0.931
   20    HD3  ARG  93           HD3      ARG  93   6.251  -7.871  -0.598
   21    HE   ARG  93           HE       ARG  93   6.944  -8.031  -3.428
   22   HH11  ARG  93          HH11      ARG  93   4.962  -9.650  -1.039
   23   HH12  ARG  93          HH12      ARG  93   3.830 -10.227  -2.232
   24   HH21  ARG  93          HH21      ARG  93   5.448  -8.781  -4.900
   25   HH22  ARG  93          HH22      ARG  93   4.120  -9.764  -4.361
   26    HA   PRO  94           HA       PRO  94  11.108  -5.954  -4.487
   27    HB2  PRO  94           HB2      PRO  94  10.983  -4.510  -6.812
   28    HB3  PRO  94           HB3      PRO  94   9.749  -5.710  -6.325
   29    HG2  PRO  94           HG2      PRO  94   9.664  -2.703  -5.970
   30    HG3  PRO  94           HG3      PRO  94   8.381  -3.781  -6.613
   31    HD2  PRO  94           HD2      PRO  94   8.433  -2.933  -4.018
   32    HD3  PRO  94           HD3      PRO  94   7.835  -4.561  -4.447
   33    H    ALA  95           H        ALA  95  13.249  -5.673  -5.034
   34    HA   ALA  95           HA       ALA  95  14.668  -3.397  -3.905
   35    HB1  ALA  95           HB1      ALA  95  16.666  -4.692  -4.594
   36    HB2  ALA  95           HB2      ALA  95  15.505  -5.701  -3.701
   37    HB3  ALA  95           HB3      ALA  95  15.629  -5.830  -5.472
   38    H    LYS  96           H        LYS  96  16.304  -2.224  -5.047
   39    HA   LYS  96           HA       LYS  96  16.206  -2.091  -7.988
   40    HB2  LYS  96           HB2      LYS  96  14.762  -0.300  -7.202
   41    HB3  LYS  96           HB3      LYS  96  16.019   0.332  -6.146
   42    HG2  LYS  96           HG2      LYS  96  17.398   0.916  -8.093
   43    HG3  LYS  96           HG3      LYS  96  16.202   0.219  -9.192
   44    HD2  LYS  96           HD2      LYS  96  15.798   2.640  -7.367
   45    HD3  LYS  96           HD3      LYS  96  16.171   2.694  -9.096
   46    HE2  LYS  96           HE2      LYS  96  14.034   1.488  -9.590
   47    HE3  LYS  96           HE3      LYS  96  13.647   1.483  -7.863
   48    HZ1  LYS  96           HZ1      LYS  96  13.987   3.933  -9.530
   49    HZ2  LYS  96           HZ2      LYS  96  12.562   3.341  -9.005
   50    HZ3  LYS  96           HZ3      LYS  96  13.638   3.935  -7.932
   51    H    TYR  97           H        TYR  97  18.077  -2.381  -5.204
   52    HA   TYR  97           HA       TYR  97  20.616  -1.643  -6.591
   53    HB2  TYR  97           HB2      TYR  97  19.691  -1.151  -3.734
   54    HB3  TYR  97           HB3      TYR  97  21.352  -0.957  -4.263
   55    HD1  TYR  97           HD1      TYR  97  17.877   0.339  -4.806
   56    HD2  TYR  97           HD2      TYR  97  22.109   1.087  -5.107
   57    HE1  TYR  97           HE1      TYR  97  17.411   2.678  -5.516
   58    HE2  TYR  97           HE2      TYR  97  21.638   3.436  -5.725
   59    HH   TYR  97           HH       TYR  97  18.312   4.735  -6.068
   60    H    SER  98           H        SER  98  22.500  -2.818  -5.879
   61    HA   SER  98           HA       SER  98  22.176  -4.927  -3.863
   62    HB2  SER  98           HB2      SER  98  23.033  -6.731  -5.160
   63    HB3  SER  98           HB3      SER  98  21.675  -6.052  -6.067
   64    HG   SER  98           HG       SER  98  23.550  -6.522  -7.331
   65    H    TYR  99           H        TYR  99  24.171  -5.785  -3.050
   66    HA   TYR  99           HA       TYR  99  26.671  -4.448  -3.863
   67    HB2  TYR  99           HB2      TYR  99  27.234  -3.711  -1.632
   68    HB3  TYR  99           HB3      TYR  99  25.742  -2.969  -2.158
   69    HD1  TYR  99           HD1      TYR  99  23.540  -3.703  -1.198
   70    HD2  TYR  99           HD2      TYR  99  27.304  -5.191   0.296
   71    HE1  TYR  99           HE1      TYR  99  22.457  -4.274   0.981
   72    HE2  TYR  99           HE2      TYR  99  26.226  -5.775   2.451
   73    HH   TYR  99           HH       TYR  99  24.294  -5.654   3.725
   74    H    VAL 100           H        VAL 100  28.568  -5.310  -2.590
   75    HA   VAL 100           HA       VAL 100  28.450  -8.280  -2.672
   76    HB   VAL 100           HB       VAL 100  30.684  -8.128  -3.577
   77   HG11  VAL 100          HG11      VAL 100  28.702  -8.073  -5.083
   78   HG12  VAL 100          HG12      VAL 100  28.853  -6.308  -5.182
   79   HG13  VAL 100          HG13      VAL 100  30.159  -7.362  -5.788
   80   HG21  VAL 100          HG21      VAL 100  31.723  -6.060  -4.314
   81   HG22  VAL 100          HG22      VAL 100  30.398  -5.099  -3.635
   82   HG23  VAL 100          HG23      VAL 100  31.485  -6.016  -2.564
   83    H    ASP 101           H        ASP 101  30.399  -9.313  -1.630
   84    HA   ASP 101           HA       ASP 101  31.573  -7.804   0.644
   85    HB2  ASP 101           HB2      ASP 101  29.606  -8.871   1.606
   86    HB3  ASP 101           HB3      ASP 101  30.126 -10.450   1.000
   87    H    GLU 102           H        GLU 102  31.631 -11.070  -0.998
   88    HA   GLU 102           HA       GLU 102  34.541 -10.699  -1.384
   89    HB2  GLU 102           HB2      GLU 102  34.344 -11.808   0.791
   90    HB3  GLU 102           HB3      GLU 102  33.279 -13.046   0.110
   91    HG2  GLU 102           HG2      GLU 102  35.056 -13.875  -1.309
   92    HG3  GLU 102           HG3      GLU 102  36.120 -12.540  -0.838
   93    H    ASN 103           H        ASN 103  32.033 -13.287  -1.796
   94    HA   ASN 103           HA       ASN 103  33.372 -14.312  -4.092
   95    HB2  ASN 103           HB2      ASN 103  32.076 -15.606  -2.393
   96    HB3  ASN 103           HB3      ASN 103  30.586 -14.886  -3.003
   97   HD21  ASN 103          HD22      ASN 103  29.507 -16.451  -4.167
   98   HD22  ASN 103          HD21      ASN 103  30.287 -17.556  -5.289
   99    H    GLY 104           H        GLY 104  30.932 -11.836  -3.876
  100    HA2  GLY 104           HA2      GLY 104  30.685 -10.905  -6.428
  101    HA3  GLY 104           HA3      GLY 104  29.684 -12.360  -6.474
  102    H    GLU 105           H        GLU 105  27.888 -10.899  -6.893
  103    HA   GLU 105           HA       GLU 105  26.773  -9.018  -5.106
  104    HB2  GLU 105           HB2      GLU 105  25.380 -11.029  -6.892
  105    HB3  GLU 105           HB3      GLU 105  24.564  -9.763  -5.954
  106    HG2  GLU 105           HG2      GLU 105  26.027  -8.052  -7.098
  107    HG3  GLU 105           HG3      GLU 105  26.617  -9.338  -8.160
  108    H    THR 106           H        THR 106  25.982  -9.072  -3.181
  109    HA   THR 106           HA       THR 106  25.854 -11.646  -1.741
  110    HB   THR 106           HB       THR 106  27.004  -8.951  -1.129
  111    HG1  THR 106           HG1      THR 106  28.193 -10.772  -2.010
  112   HG21  THR 106          HG21      THR 106  27.457  -9.688   1.195
  113   HG22  THR 106          HG22      THR 106  25.799  -9.197   0.863
  114   HG23  THR 106          HG23      THR 106  26.200 -10.939   0.996
  115    H    LYS 107           H        LYS 107  24.488  -8.317  -1.617
  116    HA   LYS 107           HA       LYS 107  21.851  -9.399  -0.747
  117    HB2  LYS 107           HB2      LYS 107  23.622  -7.503   0.833
  118    HB3  LYS 107           HB3      LYS 107  21.865  -7.433   0.998
  119    HG2  LYS 107           HG2      LYS 107  21.805  -9.820   1.631
  120    HG3  LYS 107           HG3      LYS 107  23.574  -9.893   1.546
  121    HD2  LYS 107           HD2      LYS 107  23.746  -8.145   3.280
  122    HD3  LYS 107           HD3      LYS 107  21.984  -8.080   3.420
  123    HE2  LYS 107           HE2      LYS 107  23.710 -10.557   3.947
  124    HE3  LYS 107           HE3      LYS 107  23.180  -9.430   5.193
  125    HZ1  LYS 107           HZ1      LYS 107  21.685 -11.321   5.089
  126    HZ2  LYS 107           HZ2      LYS 107  20.861  -9.990   4.639
  127    HZ3  LYS 107           HZ3      LYS 107  21.354 -11.083   3.515
  128    H    THR 108           H        THR 108  20.170  -7.732  -0.735
  129    HA   THR 108           HA       THR 108  20.525  -5.687  -2.878
  130    HB   THR 108           HB       THR 108  18.218  -6.264  -3.616
  131    HG1  THR 108           HG1      THR 108  17.403  -8.295  -2.923
  132   HG21  THR 108          HG21      THR 108  20.169  -8.603  -3.738
  133   HG22  THR 108          HG22      THR 108  18.795  -8.313  -4.828
  134   HG23  THR 108          HG23      THR 108  20.160  -7.190  -4.820
  135    H    TRP 109           H        TRP 109  18.906  -4.003  -2.964
  136    HA   TRP 109           HA       TRP 109  17.568  -3.307  -0.407
  137    HB2  TRP 109           HB2      TRP 109  19.839  -2.601  -0.046
  138    HB3  TRP 109           HB3      TRP 109  19.948  -1.870  -1.625
  139    HD1  TRP 109           HD1      TRP 109  17.461  -1.282   1.317
  140    HE1  TRP 109           HE1      TRP 109  17.337   1.233   1.798
  141    HE3  TRP 109           HE3      TRP 109  20.968   0.389  -2.050
  142    HZ2  TRP 109           HZ2      TRP 109  18.766   3.608   1.048
  143    HZ3  TRP 109           HZ3      TRP 109  21.602   2.784  -2.090
  144    HH2  TRP 109           HH2      TRP 109  20.524   4.399  -0.537
  145    H    THR 110           H        THR 110  16.138  -1.510  -0.553
  146    HA   THR 110           HA       THR 110  14.664  -1.315  -3.064
  147    HB   THR 110           HB       THR 110  13.169   0.127  -1.657
  148    HG1  THR 110           HG1      THR 110  13.819   0.174   0.625
  149   HG21  THR 110          HG21      THR 110  12.435  -1.569  -0.086
  150   HG22  THR 110          HG22      THR 110  12.922  -2.370  -1.589
  151   HG23  THR 110          HG23      THR 110  13.996  -2.412  -0.172
  152    H    GLY 111           H        GLY 111  17.093   0.640  -1.491
  153    HA2  GLY 111           HA2      GLY 111  18.088   2.630  -2.324
  154    HA3  GLY 111           HA3      GLY 111  16.717   2.883  -3.407
  155    H    GLN 112           H        GLN 112  15.679   2.067  -0.240
  156    HA   GLN 112           HA       GLN 112  15.273   4.932   0.526
  157    HB2  GLN 112           HB2      GLN 112  13.194   2.703   0.531
  158    HB3  GLN 112           HB3      GLN 112  12.966   4.326   1.191
  159    HG2  GLN 112           HG2      GLN 112  13.436   5.277  -1.086
  160    HG3  GLN 112           HG3      GLN 112  13.463   3.641  -1.741
  161   HE21  GLN 112          HE22      GLN 112  11.610   5.915  -2.376
  162   HE22  GLN 112          HE21      GLN 112  10.012   5.258  -2.060
  163    H    GLY 113           H        GLY 113  14.729   5.260   2.798
  164    HA2  GLY 113           HA2      GLY 113  15.210   4.984   5.066
  165    HA3  GLY 113           HA3      GLY 113  15.451   3.252   4.796
  166    H    ARG 114           H        ARG 114  17.265   3.701   6.358
  167    HA   ARG 114           HA       ARG 114  19.576   5.218   5.684
  168    HB2  ARG 114           HB2      ARG 114  20.742   3.947   7.390
  169    HB3  ARG 114           HB3      ARG 114  19.143   4.435   7.936
  170    HG2  ARG 114           HG2      ARG 114  18.311   2.096   7.450
  171    HG3  ARG 114           HG3      ARG 114  19.979   1.640   7.039
  172    HD2  ARG 114           HD2      ARG 114  20.724   2.270   9.305
  173    HD3  ARG 114           HD3      ARG 114  19.061   2.758   9.719
  174    HE   ARG 114           HE       ARG 114  19.033   0.060   8.778
  175   HH11  ARG 114          HH11      ARG 114  20.114   1.817  11.611
  176   HH12  ARG 114          HH12      ARG 114  19.914   0.439  12.660
  177   HH21  ARG 114          HH21      ARG 114  18.802  -1.664  10.172
  178   HH22  ARG 114          HH22      ARG 114  19.188  -1.480  11.857
  179    H    THR 115           H        THR 115  21.297   4.933   4.431
  180    HA   THR 115           HA       THR 115  21.379   3.066   2.322
  181    HB   THR 115           HB       THR 115  23.694   4.656   3.479
  182    HG1  THR 115           HG1      THR 115  23.004   6.241   2.031
  183   HG21  THR 115          HG21      THR 115  23.177   3.566   0.674
  184   HG22  THR 115          HG22      THR 115  24.501   4.673   1.123
  185   HG23  THR 115          HG23      THR 115  24.460   3.044   1.797
  186    HA   PRO 116           HA       PRO 116  23.074  -0.628   4.362
  187    HB2  PRO 116           HB2      PRO 116  24.119  -1.077   1.553
  188    HB3  PRO 116           HB3      PRO 116  23.366  -2.251   2.682
  189    HG2  PRO 116           HG2      PRO 116  21.895  -1.171   0.695
  190    HG3  PRO 116           HG3      PRO 116  21.199  -1.317   2.336
  191    HD2  PRO 116           HD2      PRO 116  22.363   1.132   1.008
  192    HD3  PRO 116           HD3      PRO 116  20.907   0.968   2.039
  193    H    ALA 117           H        ALA 117  25.050  -1.263   5.237
  194    HA   ALA 117           HA       ALA 117  26.924   0.713   5.650
  195    HB1  ALA 117           HB1      ALA 117  26.525  -1.189   7.142
  196    HB2  ALA 117           HB2      ALA 117  27.283  -2.296   5.974
  197    HB3  ALA 117           HB3      ALA 117  28.251  -1.040   6.773
  198    H    VAL 118           H        VAL 118  27.404  -2.039   3.354
  199    HA   VAL 118           HA       VAL 118  30.037  -1.239   2.587
  200    HB   VAL 118           HB       VAL 118  28.005  -2.847   0.992
  201   HG11  VAL 118          HG11      VAL 118  30.000  -3.810  -0.158
  202   HG12  VAL 118          HG12      VAL 118  29.808  -2.096  -0.503
  203   HG13  VAL 118          HG13      VAL 118  31.033  -2.630   0.673
  204   HG21  VAL 118          HG21      VAL 118  29.276  -4.817   1.858
  205   HG22  VAL 118          HG22      VAL 118  30.255  -3.736   2.864
  206   HG23  VAL 118          HG23      VAL 118  28.512  -3.915   3.166
  207    H    ILE 119           H        ILE 119  26.865  -0.358   1.222
  208    HA   ILE 119           HA       ILE 119  27.892   1.174  -1.007
  209    HB   ILE 119           HB       ILE 119  25.212   1.313   0.431
  210   HG12  ILE 119          HG12      ILE 119  26.120  -0.164  -2.070
  211   HG13  ILE 119          HG13      ILE 119  25.647  -0.893  -0.541
  212   HG21  ILE 119          HG21      ILE 119  25.696   3.412  -0.833
  213   HG22  ILE 119          HG22      ILE 119  26.016   2.450  -2.288
  214   HG23  ILE 119          HG23      ILE 119  24.389   2.511  -1.566
  215   HD11  ILE 119          HD11      ILE 119  23.329   0.027  -0.868
  216   HD12  ILE 119          HD12      ILE 119  23.816   0.523  -2.503
  217   HD13  ILE 119          HD13      ILE 119  23.832  -1.184  -2.056
  218    H    LYS 120           H        LYS 120  26.944   2.051   2.335
  219    HA   LYS 120           HA       LYS 120  27.530   4.857   2.214
  220    HB2  LYS 120           HB2      LYS 120  26.243   4.036   4.022
  221    HB3  LYS 120           HB3      LYS 120  27.413   2.794   4.441
  222    HG2  LYS 120           HG2      LYS 120  29.015   4.420   5.235
  223    HG3  LYS 120           HG3      LYS 120  27.973   5.769   4.743
  224    HD2  LYS 120           HD2      LYS 120  27.299   3.672   6.862
  225    HD3  LYS 120           HD3      LYS 120  27.968   5.276   7.185
  226    HE2  LYS 120           HE2      LYS 120  25.955   6.313   6.089
  227    HE3  LYS 120           HE3      LYS 120  25.252   4.694   5.914
  228    HZ1  LYS 120           HZ1      LYS 120  24.453   5.808   7.936
  229    HZ2  LYS 120           HZ2      LYS 120  25.306   4.482   8.357
  230    HZ3  LYS 120           HZ3      LYS 120  25.967   5.971   8.514
  231    H    LYS 121           H        LYS 121  29.635   2.125   3.226
  232    HA   LYS 121           HA       LYS 121  31.957   3.754   3.644
  233    HB2  LYS 121           HB2      LYS 121  31.607   0.790   3.066
  234    HB3  LYS 121           HB3      LYS 121  33.191   1.506   3.356
  235    HG2  LYS 121           HG2      LYS 121  30.881   1.621   5.344
  236    HG3  LYS 121           HG3      LYS 121  32.171   0.419   5.348
  237    HD2  LYS 121           HD2      LYS 121  33.854   2.287   5.635
  238    HD3  LYS 121           HD3      LYS 121  32.510   3.428   5.719
  239    HE2  LYS 121           HE2      LYS 121  33.099   3.030   7.956
  240    HE3  LYS 121           HE3      LYS 121  31.590   2.160   7.694
  241    HZ1  LYS 121           HZ1      LYS 121  32.903   0.086   7.509
  242    HZ2  LYS 121           HZ2      LYS 121  34.309   0.913   7.692
  243    HZ3  LYS 121           HZ3      LYS 121  33.240   0.830   8.918
  244    H    ALA 122           H        ALA 122  30.855   2.086   0.680
  245    HA   ALA 122           HA       ALA 122  33.118   2.818  -0.892
  246    HB1  ALA 122           HB1      ALA 122  31.685   2.241  -2.779
  247    HB2  ALA 122           HB2      ALA 122  31.488   1.063  -1.480
  248    HB3  ALA 122           HB3      ALA 122  30.238   2.303  -1.742
  249    H    MET 123           H        MET 123  30.051   4.613  -0.249
  250    HA   MET 123           HA       MET 123  30.652   6.850  -1.932
  251    HB2  MET 123           HB2      MET 123  28.955   6.589   0.579
  252    HB3  MET 123           HB3      MET 123  29.063   8.073  -0.367
  253    HG2  MET 123           HG2      MET 123  28.076   7.057  -2.284
  254    HG3  MET 123           HG3      MET 123  28.227   5.433  -1.613
  255    HE1  MET 123           HE1      MET 123  25.734   5.168  -2.497
  256    HE2  MET 123           HE2      MET 123  24.350   6.073  -1.841
  257    HE3  MET 123           HE3      MET 123  25.521   6.883  -2.901
  258    H    GLU 124           H        GLU 124  31.286   6.351   1.591
  259    HA   GLU 124           HA       GLU 124  32.556   8.893   1.915
  260    HB2  GLU 124           HB2      GLU 124  32.545   6.390   3.644
  261    HB3  GLU 124           HB3      GLU 124  33.272   7.934   4.124
  262    HG2  GLU 124           HG2      GLU 124  31.053   9.046   3.749
  263    HG3  GLU 124           HG3      GLU 124  30.327   7.458   3.512
  264    H    GLU 125           H        GLU 125  33.988   5.647   1.383
  265    HA   GLU 125           HA       GLU 125  36.726   6.799   1.663
  266    HB2  GLU 125           HB2      GLU 125  35.795   3.911   1.744
  267    HB3  GLU 125           HB3      GLU 125  37.416   4.489   2.081
  268    HG2  GLU 125           HG2      GLU 125  34.919   5.074   3.724
  269    HG3  GLU 125           HG3      GLU 125  36.221   3.974   4.143
  270    H    GLN 126           H        GLN 126  34.686   5.555  -0.850
  271    HA   GLN 126           HA       GLN 126  37.047   5.392  -2.697
  272    HB2  GLN 126           HB2      GLN 126  34.556   3.649  -2.759
  273    HB3  GLN 126           HB3      GLN 126  35.910   3.586  -3.886
  274    HG2  GLN 126           HG2      GLN 126  37.432   2.967  -2.018
  275    HG3  GLN 126           HG3      GLN 126  36.052   2.917  -0.914
  276   HE21  GLN 126          HE22      GLN 126  38.010   0.779  -2.277
  277   HE22  GLN 126          HE21      GLN 126  36.856  -0.469  -2.709
  278    H    GLY 127           H        GLY 127  34.483   7.327  -2.031
  279    HA2  GLY 127           HA2      GLY 127  33.559   9.076  -3.167
  280    HA3  GLY 127           HA3      GLY 127  34.705   8.774  -4.472
  281    H    LYS 128           H        LYS 128  32.530   6.156  -3.678
  282    HA   LYS 128           HA       LYS 128  31.303   6.214  -6.326
  283    HB2  LYS 128           HB2      LYS 128  30.603   4.551  -3.859
  284    HB3  LYS 128           HB3      LYS 128  29.998   4.275  -5.482
  285    HG2  LYS 128           HG2      LYS 128  32.854   3.917  -4.534
  286    HG3  LYS 128           HG3      LYS 128  31.708   2.688  -5.074
  287    HD2  LYS 128           HD2      LYS 128  31.719   3.873  -7.361
  288    HD3  LYS 128           HD3      LYS 128  33.132   4.770  -6.767
  289    HE2  LYS 128           HE2      LYS 128  34.277   2.591  -6.313
  290    HE3  LYS 128           HE3      LYS 128  32.857   1.734  -6.940
  291    HZ1  LYS 128           HZ1      LYS 128  34.579   3.584  -8.527
  292    HZ2  LYS 128           HZ2      LYS 128  34.555   1.957  -8.661
  293    HZ3  LYS 128           HZ3      LYS 128  33.246   2.830  -9.105
  294    H    GLN 129           H        GLN 129  28.961   5.969  -6.641
  295    HA   GLN 129           HA       GLN 129  27.260   7.744  -4.928
  296    HB2  GLN 129           HB2      GLN 129  27.446   7.762  -7.973
  297    HB3  GLN 129           HB3      GLN 129  26.255   8.652  -7.016
  298    HG2  GLN 129           HG2      GLN 129  28.112   9.892  -5.897
  299    HG3  GLN 129           HG3      GLN 129  29.269   9.112  -6.968
  300   HE21  GLN 129          HE22      GLN 129  28.697  12.009  -6.735
  301   HE22  GLN 129          HE21      GLN 129  28.164  12.495  -8.341
  302    H    LEU 130           H        LEU 130  24.836   7.435  -5.761
  303    HA   LEU 130           HA       LEU 130  24.099   4.808  -5.002
  304    HB2  LEU 130           HB2      LEU 130  22.646   7.104  -6.385
  305    HB3  LEU 130           HB3      LEU 130  21.815   5.603  -6.052
  306    HG   LEU 130           HG       LEU 130  23.152   7.266  -3.882
  307   HD11  LEU 130          HD11      LEU 130  20.227   7.151  -4.719
  308   HD12  LEU 130          HD12      LEU 130  20.879   8.013  -3.306
  309   HD13  LEU 130          HD13      LEU 130  21.322   8.535  -4.938
  310   HD21  LEU 130          HD21      LEU 130  21.741   5.953  -2.349
  311   HD22  LEU 130          HD22      LEU 130  21.066   5.038  -3.709
  312   HD23  LEU 130          HD23      LEU 130  22.776   4.864  -3.273
  313    H    GLU 131           H        GLU 131  24.425   6.173  -8.266
  314    HA   GLU 131           HA       GLU 131  23.254   3.919  -9.627
  315    HB2  GLU 131           HB2      GLU 131  25.144   6.098 -10.605
  316    HB3  GLU 131           HB3      GLU 131  24.356   4.911 -11.657
  317    HG2  GLU 131           HG2      GLU 131  22.134   5.694 -10.928
  318    HG3  GLU 131           HG3      GLU 131  22.878   6.893  -9.873
  319    H    ASP 132           H        ASP 132  26.426   4.167  -8.191
  320    HA   ASP 132           HA       ASP 132  27.680   2.129  -9.814
  321    HB2  ASP 132           HB2      ASP 132  28.276   3.102  -6.994
  322    HB3  ASP 132           HB3      ASP 132  29.255   1.940  -7.876
  323    H    PHE 133           H        PHE 133  25.250   2.057  -7.361
  324    HA   PHE 133           HA       PHE 133  25.472  -0.920  -7.058
  325    HB2  PHE 133           HB2      PHE 133  24.524   1.164  -5.064
  326    HB3  PHE 133           HB3      PHE 133  24.524  -0.575  -4.811
  327    HD1  PHE 133           HD2      PHE 133  26.695  -1.846  -4.689
  328    HD2  PHE 133           HD1      PHE 133  26.576   2.457  -4.882
  329    HE1  PHE 133           HE2      PHE 133  29.054  -1.750  -3.913
  330    HE2  PHE 133           HE1      PHE 133  28.924   2.553  -4.072
  331    HZ   PHE 133           HZ       PHE 133  30.172   0.437  -3.622
  332    H    LEU 134           H        LEU 134  23.391   1.680  -8.001
  333    HA   LEU 134           HA       LEU 134  20.845   0.362  -7.932
  334    HB2  LEU 134           HB2      LEU 134  21.541   2.848  -8.270
  335    HB3  LEU 134           HB3      LEU 134  21.788   2.414  -9.949
  336    HG   LEU 134           HG       LEU 134  19.199   2.317  -8.378
  337   HD11  LEU 134          HD11      LEU 134  18.525   4.167  -9.829
  338   HD12  LEU 134          HD12      LEU 134  20.005   4.570  -8.955
  339   HD13  LEU 134          HD13      LEU 134  20.086   4.114 -10.670
  340   HD21  LEU 134          HD21      LEU 134  18.975   0.579 -10.016
  341   HD22  LEU 134          HD22      LEU 134  18.114   1.979 -10.650
  342   HD23  LEU 134          HD23      LEU 134  19.717   1.579 -11.290
  343    H    ILE 135           H        ILE 135  20.253  -1.378  -9.087
  344    HA   ILE 135           HA       ILE 135  21.687  -2.082 -11.626
  345    HB   ILE 135           HB       ILE 135  21.552  -4.485 -10.892
  346   HG12  ILE 135          HG12      ILE 135  21.570  -4.992  -8.515
  347   HG13  ILE 135          HG13      ILE 135  21.134  -3.339  -8.104
  348   HG21  ILE 135          HG21      ILE 135  23.603  -4.342  -9.604
  349   HG22  ILE 135          HG22      ILE 135  23.614  -3.160 -10.924
  350   HG23  ILE 135          HG23      ILE 135  23.312  -2.623  -9.262
  351   HD11  ILE 135          HD11      ILE 135  19.255  -4.969  -7.954
  352   HD12  ILE 135          HD12      ILE 135  18.909  -3.660  -9.088
  353   HD13  ILE 135          HD13      ILE 135  19.392  -5.259  -9.705
  354    H    LYS 136           H        LYS 136  18.505  -1.571 -10.510
  355    HA   LYS 136           HA       LYS 136  17.168  -3.666 -11.916
  356    HB2  LYS 136           HB2      LYS 136  16.194  -2.196 -10.155
  357    HB3  LYS 136           HB3      LYS 136  16.090  -0.875 -11.332
  358    HG2  LYS 136           HG2      LYS 136  14.557  -2.238 -12.718
  359    HG3  LYS 136           HG3      LYS 136  14.751  -3.610 -11.610
  360    HD2  LYS 136           HD2      LYS 136  13.703  -2.278  -9.790
  361    HD3  LYS 136           HD3      LYS 136  13.512  -0.906 -10.916
  362    HE2  LYS 136           HE2      LYS 136  12.139  -2.364 -12.415
  363    HE3  LYS 136           HE3      LYS 136  12.301  -3.696 -11.266
  364    HZ1  LYS 136           HZ1      LYS 136  11.107  -2.322  -9.615
  365    HZ2  LYS 136           HZ2      LYS 136  10.946  -1.095 -10.699
  366    HZ3  LYS 136           HZ3      LYS 136  10.200  -2.518 -10.958
  367    H    GLU 137           H        GLU 137  18.240  -0.525 -13.109
  368    HA   GLU 137           HA       GLU 137  17.490  -1.305 -15.899
  369    HB2  GLU 137           HB2      GLU 137  15.808   0.172 -14.528
  370    HB3  GLU 137           HB3      GLU 137  16.955   1.477 -14.823
  371    HG2  GLU 137           HG2      GLU 137  16.675   1.116 -17.286
  372    HG3  GLU 137           HG3      GLU 137  15.619  -0.256 -16.958
  373    H    LEU 138           H        LEU 138  20.117  -1.172 -14.476
  374    HA   LEU 138           HA       LEU 138  21.614   0.561 -16.360
  375    HB2  LEU 138           HB2      LEU 138  21.925   0.569 -13.330
  376    HB3  LEU 138           HB3      LEU 138  23.089   1.279 -14.437
  377    HG   LEU 138           HG       LEU 138  20.200   2.221 -14.144
  378   HD11  LEU 138          HD11      LEU 138  21.591   2.614 -12.136
  379   HD12  LEU 138          HD12      LEU 138  22.783   3.469 -13.126
  380   HD13  LEU 138          HD13      LEU 138  21.133   4.115 -12.948
  381   HD21  LEU 138          HD21      LEU 138  21.132   2.768 -16.380
  382   HD22  LEU 138          HD22      LEU 138  20.996   4.217 -15.382
  383   HD23  LEU 138          HD23      LEU 138  22.582   3.446 -15.613
  384    H    GLU 139           H        GLU 139  23.798  -0.044 -16.615
  385    HA   GLU 139           HA       GLU 139  24.718  -2.689 -15.624
  386    HB2  GLU 139           HB2      GLU 139  24.421  -1.946 -18.563
  387    HB3  GLU 139           HB3      GLU 139  25.336  -3.325 -17.955
  388    HG2  GLU 139           HG2      GLU 139  23.243  -4.255 -16.948
  389    HG3  GLU 139           HG3      GLU 139  22.329  -2.917 -17.655
  Start of MODEL   14
    1    H1   ALA  91           H1       ALA  91   6.631 -17.524  -2.416
    2    H2   ALA  91           H2       ALA  91   7.700 -17.114  -3.584
    3    H3   ALA  91           H3       ALA  91   8.230 -17.403  -2.062
    4    HA   ALA  91           HA       ALA  91   6.487 -15.180  -2.889
    5    HB1  ALA  91           HB1      ALA  91   6.706 -14.332  -0.575
    6    HB2  ALA  91           HB2      ALA  91   5.952 -15.931  -0.597
    7    HB3  ALA  91           HB3      ALA  91   7.659 -15.759  -0.124
    8    H    ALA  92           H        ALA  92   7.457 -13.046  -2.767
    9    HA   ALA  92           HA       ALA  92  10.398 -12.814  -2.692
   10    HB1  ALA  92           HB1      ALA  92   9.917 -13.507  -5.021
   11    HB2  ALA  92           HB2      ALA  92   8.756 -12.176  -5.189
   12    HB3  ALA  92           HB3      ALA  92  10.486 -11.836  -4.962
   13    H    ARG  93           H        ARG  93  11.045 -10.486  -3.088
   14    HA   ARG  93           HA       ARG  93   9.048  -8.430  -2.271
   15    HB2  ARG  93           HB2      ARG  93  11.739  -8.997  -0.931
   16    HB3  ARG  93           HB3      ARG  93  10.834  -7.517  -0.677
   17    HG2  ARG  93           HG2      ARG  93   9.906 -10.320   0.076
   18    HG3  ARG  93           HG3      ARG  93  10.538  -9.104   1.175
   19    HD2  ARG  93           HD2      ARG  93   7.956  -8.869  -0.428
   20    HD3  ARG  93           HD3      ARG  93   8.084  -9.276   1.287
   21    HE   ARG  93           HE       ARG  93   9.404  -6.895   1.214
   22   HH11  ARG  93          HH11      ARG  93   6.190  -7.778   0.127
   23   HH12  ARG  93          HH12      ARG  93   5.568  -6.167   0.358
   24   HH21  ARG  93          HH21      ARG  93   8.547  -4.867   1.494
   25   HH22  ARG  93          HH22      ARG  93   6.872  -4.569   1.134
   26    HA   PRO  94           HA       PRO  94  11.094  -6.091  -5.391
   27    HB2  PRO  94           HB2      PRO  94  10.540  -3.495  -4.716
   28    HB3  PRO  94           HB3      PRO  94   9.286  -4.659  -5.241
   29    HG2  PRO  94           HG2      PRO  94  10.055  -3.920  -2.397
   30    HG3  PRO  94           HG3      PRO  94   8.416  -3.955  -3.126
   31    HD2  PRO  94           HD2      PRO  94   9.382  -6.041  -1.677
   32    HD3  PRO  94           HD3      PRO  94   8.364  -6.312  -3.118
   33    H    ALA  95           H        ALA  95  12.849  -4.702  -5.905
   34    HA   ALA  95           HA       ALA  95  14.496  -3.417  -3.882
   35    HB1  ALA  95           HB1      ALA  95  15.624  -5.764  -5.487
   36    HB2  ALA  95           HB2      ALA  95  16.571  -4.664  -4.460
   37    HB3  ALA  95           HB3      ALA  95  15.364  -5.737  -3.731
   38    H    LYS  96           H        LYS  96  16.303  -2.229  -4.906
   39    HA   LYS  96           HA       LYS  96  16.277  -1.952  -7.834
   40    HB2  LYS  96           HB2      LYS  96  14.707  -0.263  -7.143
   41    HB3  LYS  96           HB3      LYS  96  15.806   0.356  -5.906
   42    HG2  LYS  96           HG2      LYS  96  17.244   1.348  -7.518
   43    HG3  LYS  96           HG3      LYS  96  16.572   0.394  -8.838
   44    HD2  LYS  96           HD2      LYS  96  15.895   2.732  -8.991
   45    HD3  LYS  96           HD3      LYS  96  14.503   1.658  -8.805
   46    HE2  LYS  96           HE2      LYS  96  14.363   2.233  -6.385
   47    HE3  LYS  96           HE3      LYS  96  15.783   3.269  -6.545
   48    HZ1  LYS  96           HZ1      LYS  96  13.192   3.710  -7.954
   49    HZ2  LYS  96           HZ2      LYS  96  13.720   4.565  -6.671
   50    HZ3  LYS  96           HZ3      LYS  96  14.502   4.677  -8.095
   51    H    TYR  97           H        TYR  97  18.095  -2.083  -4.965
   52    HA   TYR  97           HA       TYR  97  20.576  -1.400  -6.469
   53    HB2  TYR  97           HB2      TYR  97  20.065  -0.874  -3.528
   54    HB3  TYR  97           HB3      TYR  97  21.465  -0.376  -4.462
   55    HD1  TYR  97           HD1      TYR  97  17.861   0.222  -3.801
   56    HD2  TYR  97           HD2      TYR  97  21.388   1.672  -5.815
   57    HE1  TYR  97           HE1      TYR  97  16.675   2.339  -4.355
   58    HE2  TYR  97           HE2      TYR  97  20.183   3.791  -6.359
   59    HH   TYR  97           HH       TYR  97  18.235   5.020  -6.137
   60    H    SER  98           H        SER  98  22.475  -2.587  -5.831
   61    HA   SER  98           HA       SER  98  22.181  -4.957  -4.060
   62    HB2  SER  98           HB2      SER  98  21.495  -5.650  -6.360
   63    HB3  SER  98           HB3      SER  98  23.071  -5.102  -6.961
   64    HG   SER  98           HG       SER  98  23.088  -7.307  -6.592
   65    H    TYR  99           H        TYR  99  24.128  -5.727  -3.254
   66    HA   TYR  99           HA       TYR  99  26.657  -4.505  -4.175
   67    HB2  TYR  99           HB2      TYR  99  27.356  -3.736  -2.033
   68    HB3  TYR  99           HB3      TYR  99  25.831  -2.993  -2.423
   69    HD1  TYR  99           HD1      TYR  99  23.724  -3.734  -1.259
   70    HD2  TYR  99           HD2      TYR  99  27.622  -5.172  -0.097
   71    HE1  TYR  99           HE1      TYR  99  22.839  -4.320   1.001
   72    HE2  TYR  99           HE2      TYR  99  26.737  -5.760   2.154
   73    HH   TYR  99           HH       TYR  99  24.912  -5.741   3.565
   74    H    VAL 100           H        VAL 100  28.560  -5.357  -3.087
   75    HA   VAL 100           HA       VAL 100  28.457  -8.354  -3.073
   76    HB   VAL 100           HB       VAL 100  30.402  -6.368  -4.327
   77   HG11  VAL 100          HG11      VAL 100  31.775  -8.206  -3.535
   78   HG12  VAL 100          HG12      VAL 100  30.654  -9.398  -4.226
   79   HG13  VAL 100          HG13      VAL 100  31.591  -8.324  -5.282
   80   HG21  VAL 100          HG21      VAL 100  29.759  -7.393  -6.457
   81   HG22  VAL 100          HG22      VAL 100  28.647  -8.493  -5.622
   82   HG23  VAL 100          HG23      VAL 100  28.332  -6.743  -5.647
   83    H    ASP 101           H        ASP 101  29.728  -9.415  -1.640
   84    HA   ASP 101           HA       ASP 101  31.910  -8.049  -0.181
   85    HB2  ASP 101           HB2      ASP 101  29.811  -7.804   1.243
   86    HB3  ASP 101           HB3      ASP 101  29.750  -9.578   1.307
   87    H    GLU 102           H        GLU 102  30.042 -11.084  -0.655
   88    HA   GLU 102           HA       GLU 102  32.477 -12.701  -0.183
   89    HB2  GLU 102           HB2      GLU 102  31.065 -14.603  -0.095
   90    HB3  GLU 102           HB3      GLU 102  30.553 -13.372   1.043
   91    HG2  GLU 102           HG2      GLU 102  28.583 -12.954  -0.000
   92    HG3  GLU 102           HG3      GLU 102  29.232 -13.233  -1.616
   93    H    ASN 103           H        ASN 103  30.983 -14.724  -2.076
   94    HA   ASN 103           HA       ASN 103  32.939 -14.610  -4.140
   95    HB2  ASN 103           HB2      ASN 103  30.349 -16.210  -3.931
   96    HB3  ASN 103           HB3      ASN 103  31.667 -16.544  -5.048
   97   HD21  ASN 103          HD22      ASN 103  30.552 -16.891  -1.766
   98   HD22  ASN 103          HD21      ASN 103  31.936 -17.857  -1.227
   99    H    GLY 104           H        GLY 104  30.080 -12.781  -3.964
  100    HA2  GLY 104           HA2      GLY 104  30.179 -11.591  -6.524
  101    HA3  GLY 104           HA3      GLY 104  29.003 -12.911  -6.590
  102    H    GLU 105           H        GLU 105  27.322 -11.327  -6.903
  103    HA   GLU 105           HA       GLU 105  26.530  -9.268  -5.157
  104    HB2  GLU 105           HB2      GLU 105  24.801 -11.211  -6.714
  105    HB3  GLU 105           HB3      GLU 105  24.195  -9.819  -5.797
  106    HG2  GLU 105           HG2      GLU 105  25.686  -8.323  -7.159
  107    HG3  GLU 105           HG3      GLU 105  26.112  -9.715  -8.160
  108    H    THR 106           H        THR 106  25.929  -9.148  -3.199
  109    HA   THR 106           HA       THR 106  25.771 -11.584  -1.535
  110    HB   THR 106           HB       THR 106  26.932  -8.828  -1.233
  111    HG1  THR 106           HG1      THR 106  27.976 -10.837  -2.100
  112   HG21  THR 106          HG21      THR 106  25.858  -9.044   0.855
  113   HG22  THR 106          HG22      THR 106  26.421 -10.736   1.053
  114   HG23  THR 106          HG23      THR 106  27.566  -9.367   1.076
  115    H    LYS 107           H        LYS 107  24.467  -8.224  -1.611
  116    HA   LYS 107           HA       LYS 107  21.829  -9.210  -0.644
  117    HB2  LYS 107           HB2      LYS 107  23.643  -7.259   0.819
  118    HB3  LYS 107           HB3      LYS 107  21.914  -7.204   1.066
  119    HG2  LYS 107           HG2      LYS 107  23.712  -9.579   1.688
  120    HG3  LYS 107           HG3      LYS 107  23.137  -8.409   2.847
  121    HD2  LYS 107           HD2      LYS 107  21.366 -10.308   1.250
  122    HD3  LYS 107           HD3      LYS 107  21.884 -10.562   2.899
  123    HE2  LYS 107           HE2      LYS 107  20.179  -8.191   1.993
  124    HE3  LYS 107           HE3      LYS 107  19.533  -9.704   2.628
  125    HZ1  LYS 107           HZ1      LYS 107  20.722  -9.292   4.715
  126    HZ2  LYS 107           HZ2      LYS 107  21.312  -7.864   4.161
  127    HZ3  LYS 107           HZ3      LYS 107  19.709  -8.060   4.393
  128    H    THR 108           H        THR 108  20.134  -7.667  -0.827
  129    HA   THR 108           HA       THR 108  20.597  -5.449  -2.768
  130    HB   THR 108           HB       THR 108  18.380  -5.973  -3.714
  131    HG1  THR 108           HG1      THR 108  17.464  -8.027  -3.142
  132   HG21  THR 108          HG21      THR 108  20.208  -8.414  -3.725
  133   HG22  THR 108          HG22      THR 108  18.993  -7.977  -4.951
  134   HG23  THR 108          HG23      THR 108  20.424  -6.965  -4.730
  135    H    TRP 109           H        TRP 109  18.875  -3.817  -2.842
  136    HA   TRP 109           HA       TRP 109  17.492  -3.272  -0.276
  137    HB2  TRP 109           HB2      TRP 109  19.810  -2.565   0.058
  138    HB3  TRP 109           HB3      TRP 109  19.777  -1.612  -1.410
  139    HD1  TRP 109           HD1      TRP 109  17.376  -1.644   1.654
  140    HE1  TRP 109           HE1      TRP 109  17.158   0.748   2.560
  141    HE3  TRP 109           HE3      TRP 109  20.692   0.744  -1.467
  142    HZ2  TRP 109           HZ2      TRP 109  18.412   3.291   2.166
  143    HZ3  TRP 109           HZ3      TRP 109  21.207   3.152  -1.105
  144    HH2  TRP 109           HH2      TRP 109  20.087   4.425   0.698
  145    H    THR 110           H        THR 110  16.088  -1.425  -0.344
  146    HA   THR 110           HA       THR 110  14.774  -1.012  -2.966
  147    HB   THR 110           HB       THR 110  12.978  -0.039  -1.473
  148    HG1  THR 110           HG1      THR 110  13.306  -0.427   0.784
  149   HG21  THR 110          HG21      THR 110  12.279  -2.151  -0.461
  150   HG22  THR 110          HG22      THR 110  12.930  -2.448  -2.080
  151   HG23  THR 110          HG23      THR 110  13.910  -2.830  -0.648
  152    H    GLY 111           H        GLY 111  16.932   0.770  -0.936
  153    HA2  GLY 111           HA2      GLY 111  17.745   2.946  -1.304
  154    HA3  GLY 111           HA3      GLY 111  16.392   3.316  -2.363
  155    H    GLN 112           H        GLN 112  15.535   1.867   0.697
  156    HA   GLN 112           HA       GLN 112  14.773   4.527   1.846
  157    HB2  GLN 112           HB2      GLN 112  13.097   1.984   1.738
  158    HB3  GLN 112           HB3      GLN 112  12.657   3.476   2.577
  159    HG2  GLN 112           HG2      GLN 112  12.699   4.695   0.387
  160    HG3  GLN 112           HG3      GLN 112  13.027   3.167  -0.435
  161   HE21  GLN 112          HE22      GLN 112  10.513   5.248   0.487
  162   HE22  GLN 112          HE21      GLN 112   9.209   4.074   0.370
  163    H    GLY 113           H        GLY 113  14.633   4.653   4.116
  164    HA2  GLY 113           HA2      GLY 113  15.334   4.206   6.299
  165    HA3  GLY 113           HA3      GLY 113  15.594   2.518   5.868
  166    H    ARG 114           H        ARG 114  17.502   2.860   7.271
  167    HA   ARG 114           HA       ARG 114  19.741   4.508   6.640
  168    HB2  ARG 114           HB2      ARG 114  19.305   3.353   8.800
  169    HB3  ARG 114           HB3      ARG 114  19.649   1.795   8.041
  170    HG2  ARG 114           HG2      ARG 114  21.984   2.526   7.599
  171    HG3  ARG 114           HG3      ARG 114  21.622   4.113   8.314
  172    HD2  ARG 114           HD2      ARG 114  21.088   3.015  10.470
  173    HD3  ARG 114           HD3      ARG 114  21.440   1.426   9.751
  174    HE   ARG 114           HE       ARG 114  23.715   3.097   9.384
  175   HH11  ARG 114          HH11      ARG 114  22.069   1.531  12.055
  176   HH12  ARG 114          HH12      ARG 114  23.508   1.445  13.027
  177   HH21  ARG 114          HH21      ARG 114  25.534   2.954  10.682
  178   HH22  ARG 114          HH22      ARG 114  25.418   2.230  12.259
  179    H    THR 115           H        THR 115  21.207   4.443   5.048
  180    HA   THR 115           HA       THR 115  21.257   2.682   2.885
  181    HB   THR 115           HB       THR 115  23.612   4.279   3.953
  182    HG1  THR 115           HG1      THR 115  22.748   5.936   2.678
  183   HG21  THR 115          HG21      THR 115  22.895   3.381   1.123
  184   HG22  THR 115          HG22      THR 115  24.225   4.475   1.554
  185   HG23  THR 115          HG23      THR 115  24.267   2.798   2.095
  186    HA   PRO 116           HA       PRO 116  23.275  -1.036   4.526
  187    HB2  PRO 116           HB2      PRO 116  24.174  -1.257   1.645
  188    HB3  PRO 116           HB3      PRO 116  23.524  -2.524   2.739
  189    HG2  PRO 116           HG2      PRO 116  21.922  -1.373   0.878
  190    HG3  PRO 116           HG3      PRO 116  21.307  -1.670   2.534
  191    HD2  PRO 116           HD2      PRO 116  22.307   0.920   1.351
  192    HD3  PRO 116           HD3      PRO 116  20.903   0.614   2.424
  193    H    ALA 117           H        ALA 117  25.312  -1.569   5.275
  194    HA   ALA 117           HA       ALA 117  27.098   0.496   5.660
  195    HB1  ALA 117           HB1      ALA 117  28.576  -1.212   6.660
  196    HB2  ALA 117           HB2      ALA 117  26.888  -1.463   7.122
  197    HB3  ALA 117           HB3      ALA 117  27.634  -2.502   5.886
  198    H    VAL 118           H        VAL 118  27.729  -2.247   3.364
  199    HA   VAL 118           HA       VAL 118  30.255  -1.255   2.534
  200    HB   VAL 118           HB       VAL 118  28.317  -2.953   0.914
  201   HG11  VAL 118          HG11      VAL 118  30.096  -2.095  -0.542
  202   HG12  VAL 118          HG12      VAL 118  31.333  -2.597   0.632
  203   HG13  VAL 118          HG13      VAL 118  30.357  -3.808  -0.223
  204   HG21  VAL 118          HG21      VAL 118  29.662  -4.876   1.770
  205   HG22  VAL 118          HG22      VAL 118  30.554  -3.761   2.825
  206   HG23  VAL 118          HG23      VAL 118  28.814  -4.038   3.067
  207    H    ILE 119           H        ILE 119  27.020  -0.580   1.193
  208    HA   ILE 119           HA       ILE 119  27.862   1.034  -1.035
  209    HB   ILE 119           HB       ILE 119  25.277   1.056   0.581
  210   HG12  ILE 119          HG12      ILE 119  26.086  -0.271  -2.036
  211   HG13  ILE 119          HG13      ILE 119  25.698  -1.081  -0.527
  212   HG21  ILE 119          HG21      ILE 119  25.581   3.233  -0.564
  213   HG22  ILE 119          HG22      ILE 119  25.855   2.383  -2.101
  214   HG23  ILE 119          HG23      ILE 119  24.278   2.314  -1.269
  215   HD11  ILE 119          HD11      ILE 119  23.334  -0.193  -0.721
  216   HD12  ILE 119          HD12      ILE 119  23.756   0.381  -2.355
  217   HD13  ILE 119          HD13      ILE 119  23.825  -1.344  -1.982
  218    H    LYS 120           H        LYS 120  27.007   1.911   2.342
  219    HA   LYS 120           HA       LYS 120  27.500   4.732   2.139
  220    HB2  LYS 120           HB2      LYS 120  26.248   3.960   3.973
  221    HB3  LYS 120           HB3      LYS 120  27.420   2.721   4.412
  222    HG2  LYS 120           HG2      LYS 120  28.993   4.346   5.241
  223    HG3  LYS 120           HG3      LYS 120  28.004   5.693   4.632
  224    HD2  LYS 120           HD2      LYS 120  26.208   5.138   6.220
  225    HD3  LYS 120           HD3      LYS 120  27.060   3.677   6.719
  226    HE2  LYS 120           HE2      LYS 120  27.336   5.352   8.426
  227    HE3  LYS 120           HE3      LYS 120  28.898   5.022   7.674
  228    HZ1  LYS 120           HZ1      LYS 120  27.191   7.366   6.962
  229    HZ2  LYS 120           HZ2      LYS 120  28.430   7.421   8.022
  230    HZ3  LYS 120           HZ3      LYS 120  28.749   7.091   6.464
  231    H    LYS 121           H        LYS 121  29.706   2.112   3.217
  232    HA   LYS 121           HA       LYS 121  31.930   3.853   3.698
  233    HB2  LYS 121           HB2      LYS 121  31.902   0.876   3.038
  234    HB3  LYS 121           HB3      LYS 121  33.321   1.760   3.574
  235    HG2  LYS 121           HG2      LYS 121  30.844   1.102   5.184
  236    HG3  LYS 121           HG3      LYS 121  32.493   0.581   5.448
  237    HD2  LYS 121           HD2      LYS 121  31.358   3.373   5.871
  238    HD3  LYS 121           HD3      LYS 121  31.819   2.212   7.112
  239    HE2  LYS 121           HE2      LYS 121  34.186   2.339   6.439
  240    HE3  LYS 121           HE3      LYS 121  33.775   3.405   5.094
  241    HZ1  LYS 121           HZ1      LYS 121  33.504   4.079   7.971
  242    HZ2  LYS 121           HZ2      LYS 121  34.551   4.730   6.881
  243    HZ3  LYS 121           HZ3      LYS 121  32.934   5.031   6.747
  244    H    ALA 122           H        ALA 122  31.087   2.012   0.762
  245    HA   ALA 122           HA       ALA 122  33.356   2.817  -0.760
  246    HB1  ALA 122           HB1      ALA 122  31.910   0.907  -1.319
  247    HB2  ALA 122           HB2      ALA 122  30.559   2.009  -1.654
  248    HB3  ALA 122           HB3      ALA 122  32.017   2.040  -2.676
  249    H    MET 123           H        MET 123  30.088   4.335  -0.468
  250    HA   MET 123           HA       MET 123  30.630   6.443  -2.322
  251    HB2  MET 123           HB2      MET 123  28.620   6.157  -0.068
  252    HB3  MET 123           HB3      MET 123  28.706   7.584  -1.108
  253    HG2  MET 123           HG2      MET 123  28.323   6.240  -3.106
  254    HG3  MET 123           HG3      MET 123  28.378   4.754  -2.175
  255    HE1  MET 123           HE1      MET 123  26.421   8.144  -1.167
  256    HE2  MET 123           HE2      MET 123  26.361   8.035  -2.947
  257    HE3  MET 123           HE3      MET 123  24.888   7.812  -1.983
  258    H    GLU 124           H        GLU 124  31.123   6.315   1.253
  259    HA   GLU 124           HA       GLU 124  31.909   9.100   1.223
  260    HB2  GLU 124           HB2      GLU 124  31.650   9.104   3.510
  261    HB3  GLU 124           HB3      GLU 124  30.413   8.006   2.904
  262    HG2  GLU 124           HG2      GLU 124  32.059   6.100   3.463
  263    HG3  GLU 124           HG3      GLU 124  33.032   7.327   4.271
  264    H    GLU 125           H        GLU 125  33.786   6.065   1.566
  265    HA   GLU 125           HA       GLU 125  36.266   7.738   1.814
  266    HB2  GLU 125           HB2      GLU 125  35.718   4.861   2.606
  267    HB3  GLU 125           HB3      GLU 125  37.331   5.589   2.554
  268    HG2  GLU 125           HG2      GLU 125  36.447   7.429   4.095
  269    HG3  GLU 125           HG3      GLU 125  35.002   6.440   4.294
  270    H    GLN 126           H        GLN 126  34.693   5.630  -0.468
  271    HA   GLN 126           HA       GLN 126  37.229   5.528  -2.070
  272    HB2  GLN 126           HB2      GLN 126  34.874   3.631  -2.276
  273    HB3  GLN 126           HB3      GLN 126  36.413   3.529  -3.121
  274    HG2  GLN 126           HG2      GLN 126  37.581   3.279  -0.922
  275    HG3  GLN 126           HG3      GLN 126  36.017   3.249  -0.107
  276   HE21  GLN 126          HE22      GLN 126  38.399   1.183  -1.165
  277   HE22  GLN 126          HE21      GLN 126  37.388  -0.223  -1.461
  278    H    GLY 127           H        GLY 127  34.542   7.380  -1.947
  279    HA2  GLY 127           HA2      GLY 127  33.897   9.052  -3.353
  280    HA3  GLY 127           HA3      GLY 127  35.144   8.539  -4.490
  281    H    LYS 128           H        LYS 128  32.830   6.071  -3.736
  282    HA   LYS 128           HA       LYS 128  31.742   6.045  -6.444
  283    HB2  LYS 128           HB2      LYS 128  30.974   4.569  -3.878
  284    HB3  LYS 128           HB3      LYS 128  30.143   4.300  -5.392
  285    HG2  LYS 128           HG2      LYS 128  33.095   3.751  -4.906
  286    HG3  LYS 128           HG3      LYS 128  31.777   2.576  -4.992
  287    HD2  LYS 128           HD2      LYS 128  31.333   3.517  -7.384
  288    HD3  LYS 128           HD3      LYS 128  32.955   4.238  -7.247
  289    HE2  LYS 128           HE2      LYS 128  33.902   1.989  -6.775
  290    HE3  LYS 128           HE3      LYS 128  32.270   1.290  -6.873
  291    HZ1  LYS 128           HZ1      LYS 128  33.540   1.040  -8.959
  292    HZ2  LYS 128           HZ2      LYS 128  32.156   1.875  -9.192
  293    HZ3  LYS 128           HZ3      LYS 128  33.609   2.662  -9.155
  294    H    GLN 129           H        GLN 129  29.440   5.932  -6.885
  295    HA   GLN 129           HA       GLN 129  27.699   7.779  -5.313
  296    HB2  GLN 129           HB2      GLN 129  27.893   7.567  -8.354
  297    HB3  GLN 129           HB3      GLN 129  26.663   8.476  -7.465
  298    HG2  GLN 129           HG2      GLN 129  28.440   9.894  -6.460
  299    HG3  GLN 129           HG3      GLN 129  29.664   9.057  -7.420
  300   HE21  GLN 129          HE22      GLN 129  28.171  11.940  -7.378
  301   HE22  GLN 129          HE21      GLN 129  28.008  12.210  -9.106
  302    H    LEU 130           H        LEU 130  25.376   7.171  -5.509
  303    HA   LEU 130           HA       LEU 130  25.172   4.448  -4.856
  304    HB2  LEU 130           HB2      LEU 130  23.784   6.295  -3.953
  305    HB3  LEU 130           HB3      LEU 130  22.995   6.452  -5.528
  306    HG   LEU 130           HG       LEU 130  22.046   4.209  -5.296
  307   HD11  LEU 130          HD11      LEU 130  23.330   4.138  -2.544
  308   HD12  LEU 130          HD12      LEU 130  22.152   2.960  -3.181
  309   HD13  LEU 130          HD13      LEU 130  23.743   3.079  -3.913
  310   HD21  LEU 130          HD21      LEU 130  20.464   4.674  -3.475
  311   HD22  LEU 130          HD22      LEU 130  21.556   5.914  -2.825
  312   HD23  LEU 130          HD23      LEU 130  20.791   6.141  -4.416
  313    H    GLU 131           H        GLU 131  24.634   5.996  -7.947
  314    HA   GLU 131           HA       GLU 131  23.249   3.924  -9.334
  315    HB2  GLU 131           HB2      GLU 131  25.230   6.014 -10.319
  316    HB3  GLU 131           HB3      GLU 131  24.307   4.953 -11.373
  317    HG2  GLU 131           HG2      GLU 131  23.173   7.047 -11.305
  318    HG3  GLU 131           HG3      GLU 131  22.187   5.830 -10.500
  319    H    ASP 132           H        ASP 132  26.590   3.938  -8.236
  320    HA   ASP 132           HA       ASP 132  27.575   1.902 -10.004
  321    HB2  ASP 132           HB2      ASP 132  28.927   3.389  -8.419
  322    HB3  ASP 132           HB3      ASP 132  28.420   2.316  -7.117
  323    H    PHE 133           H        PHE 133  25.367   1.847  -7.346
  324    HA   PHE 133           HA       PHE 133  25.388  -1.131  -7.099
  325    HB2  PHE 133           HB2      PHE 133  24.380   0.986  -5.165
  326    HB3  PHE 133           HB3      PHE 133  24.449  -0.742  -4.878
  327    HD1  PHE 133           HD2      PHE 133  26.723  -1.906  -4.777
  328    HD2  PHE 133           HD1      PHE 133  26.319   2.384  -4.774
  329    HE1  PHE 133           HE2      PHE 133  29.023  -1.692  -3.867
  330    HE2  PHE 133           HE1      PHE 133  28.614   2.598  -3.861
  331    HZ   PHE 133           HZ       PHE 133  29.975   0.555  -3.426
  332    H    LEU 134           H        LEU 134  23.420   1.602  -8.026
  333    HA   LEU 134           HA       LEU 134  20.820   0.391  -7.913
  334    HB2  LEU 134           HB2      LEU 134  21.573   2.852  -8.220
  335    HB3  LEU 134           HB3      LEU 134  21.756   2.460  -9.928
  336    HG   LEU 134           HG       LEU 134  19.185   2.264  -8.314
  337   HD11  LEU 134          HD11      LEU 134  20.013   4.278 -10.440
  338   HD12  LEU 134          HD12      LEU 134  18.478   4.245  -9.545
  339   HD13  LEU 134          HD13      LEU 134  19.991   4.590  -8.694
  340   HD21  LEU 134          HD21      LEU 134  18.101   2.168 -10.607
  341   HD22  LEU 134          HD22      LEU 134  19.708   1.797 -11.263
  342   HD23  LEU 134          HD23      LEU 134  18.927   0.709 -10.084
  343    H    ILE 135           H        ILE 135  20.108  -1.294  -9.017
  344    HA   ILE 135           HA       ILE 135  21.377  -2.037 -11.631
  345    HB   ILE 135           HB       ILE 135  21.069  -4.443 -10.932
  346   HG12  ILE 135          HG12      ILE 135  21.201  -4.981  -8.567
  347   HG13  ILE 135          HG13      ILE 135  20.931  -3.304  -8.109
  348   HG21  ILE 135          HG21      ILE 135  23.058  -2.738  -9.388
  349   HG22  ILE 135          HG22      ILE 135  23.211  -4.466  -9.754
  350   HG23  ILE 135          HG23      ILE 135  23.231  -3.287 -11.069
  351   HD11  ILE 135          HD11      ILE 135  18.621  -3.436  -8.972
  352   HD12  ILE 135          HD12      ILE 135  18.931  -5.080  -9.585
  353   HD13  ILE 135          HD13      ILE 135  18.929  -4.755  -7.837
  354    H    LYS 136           H        LYS 136  18.271  -1.391 -10.326
  355    HA   LYS 136           HA       LYS 136  16.772  -3.249 -11.941
  356    HB2  LYS 136           HB2      LYS 136  15.882  -2.066  -9.961
  357    HB3  LYS 136           HB3      LYS 136  15.894  -0.540 -10.861
  358    HG2  LYS 136           HG2      LYS 136  14.254  -1.453 -12.465
  359    HG3  LYS 136           HG3      LYS 136  14.322  -3.032 -11.650
  360    HD2  LYS 136           HD2      LYS 136  13.392  -2.002  -9.584
  361    HD3  LYS 136           HD3      LYS 136  13.424  -0.416 -10.358
  362    HE2  LYS 136           HE2      LYS 136  11.173  -1.173 -10.448
  363    HE3  LYS 136           HE3      LYS 136  11.810  -1.238 -12.091
  364    HZ1  LYS 136           HZ1      LYS 136  10.544  -3.247 -11.511
  365    HZ2  LYS 136           HZ2      LYS 136  12.086  -3.658 -11.826
  366    HZ3  LYS 136           HZ3      LYS 136  11.548  -3.596 -10.277
  367    H    GLU 137           H        GLU 137  17.589   0.171 -12.557
  368    HA   GLU 137           HA       GLU 137  17.625  -0.199 -15.459
  369    HB2  GLU 137           HB2      GLU 137  15.186   0.009 -14.943
  370    HB3  GLU 137           HB3      GLU 137  15.485   1.565 -14.163
  371    HG2  GLU 137           HG2      GLU 137  16.238   2.513 -16.315
  372    HG3  GLU 137           HG3      GLU 137  16.119   0.925 -17.079
  373    H    LEU 138           H        LEU 138  18.870   1.367 -16.443
  374    HA   LEU 138           HA       LEU 138  19.489   3.938 -15.123
  375    HB2  LEU 138           HB2      LEU 138  21.560   1.852 -15.936
  376    HB3  LEU 138           HB3      LEU 138  21.950   3.547 -15.695
  377    HG   LEU 138           HG       LEU 138  20.895   1.689 -13.518
  378   HD11  LEU 138          HD11      LEU 138  23.666   2.841 -14.024
  379   HD12  LEU 138          HD12      LEU 138  23.176   1.855 -12.632
  380   HD13  LEU 138          HD13      LEU 138  23.178   1.145 -14.251
  381   HD21  LEU 138          HD21      LEU 138  20.259   4.009 -13.005
  382   HD22  LEU 138          HD22      LEU 138  21.627   3.541 -11.996
  383   HD23  LEU 138          HD23      LEU 138  21.895   4.579 -13.409
  384    H    GLU 139           H        GLU 139  20.629   5.410 -16.605
  385    HA   GLU 139           HA       GLU 139  20.471   4.883 -19.499
  386    HB2  GLU 139           HB2      GLU 139  19.093   6.786 -19.985
  387    HB3  GLU 139           HB3      GLU 139  18.227   5.697 -18.907
  388    HG2  GLU 139           HG2      GLU 139  18.761   7.191 -16.975
  389    HG3  GLU 139           HG3      GLU 139  19.603   8.290 -18.072
  Start of MODEL   15
    1    H1   ALA  91           H1       ALA  91  22.232  -9.621 -10.033
    2    H2   ALA  91           H2       ALA  91  21.201 -10.861  -9.746
    3    H3   ALA  91           H3       ALA  91  21.188 -10.115 -11.203
    4    HA   ALA  91           HA       ALA  91  20.455  -8.847  -8.639
    5    HB1  ALA  91           HB1      ALA  91  20.210  -7.760 -11.491
    6    HB2  ALA  91           HB2      ALA  91  19.660  -6.942 -10.020
    7    HB3  ALA  91           HB3      ALA  91  21.388  -7.228 -10.274
    8    H    ALA  92           H        ALA  92  18.058  -8.156  -8.621
    9    HA   ALA  92           HA       ALA  92  16.262 -10.028 -10.060
   10    HB1  ALA  92           HB1      ALA  92  15.279 -10.804  -7.934
   11    HB2  ALA  92           HB2      ALA  92  16.998 -11.197  -8.002
   12    HB3  ALA  92           HB3      ALA  92  16.446  -9.825  -7.016
   13    H    ARG  93           H        ARG  93  14.001  -9.542  -9.774
   14    HA   ARG  93           HA       ARG  93  13.440  -6.848 -10.342
   15    HB2  ARG  93           HB2      ARG  93  12.284  -8.853 -11.234
   16    HB3  ARG  93           HB3      ARG  93  11.459  -9.063  -9.692
   17    HG2  ARG  93           HG2      ARG  93  10.371  -6.835  -9.983
   18    HG3  ARG  93           HG3      ARG  93  11.214  -6.632 -11.526
   19    HD2  ARG  93           HD2      ARG  93   9.246  -8.866 -10.845
   20    HD3  ARG  93           HD3      ARG  93   8.828  -7.415 -11.744
   21    HE   ARG  93           HE       ARG  93  10.347  -9.748 -12.704
   22   HH11  ARG  93          HH11      ARG  93   9.420  -6.455 -13.507
   23   HH12  ARG  93          HH12      ARG  93   9.783  -6.674 -15.195
   24   HH21  ARG  93          HH21      ARG  93  10.798  -9.946 -14.863
   25   HH22  ARG  93          HH22      ARG  93  10.553  -8.599 -15.939
   26    HA   PRO  94           HA       PRO  94  11.074  -6.166  -6.339
   27    HB2  PRO  94           HB2      PRO  94  11.165  -7.800  -4.170
   28    HB3  PRO  94           HB3      PRO  94  10.341  -8.286  -5.675
   29    HG2  PRO  94           HG2      PRO  94  13.179  -8.971  -4.829
   30    HG3  PRO  94           HG3      PRO  94  11.882 -10.096  -5.347
   31    HD2  PRO  94           HD2      PRO  94  13.774  -9.113  -7.064
   32    HD3  PRO  94           HD3      PRO  94  12.110  -9.460  -7.605
   33    H    ALA  95           H        ALA  95  13.714  -5.272  -6.881
   34    HA   ALA  95           HA       ALA  95  14.473  -3.991  -4.348
   35    HB1  ALA  95           HB1      ALA  95  15.738  -6.095  -4.235
   36    HB2  ALA  95           HB2      ALA  95  16.399  -5.820  -5.856
   37    HB3  ALA  95           HB3      ALA  95  16.839  -4.737  -4.511
   38    H    LYS  96           H        LYS  96  16.319  -2.431  -4.713
   39    HA   LYS  96           HA       LYS  96  16.116  -1.119  -7.376
   40    HB2  LYS  96           HB2      LYS  96  14.753  -0.210  -5.419
   41    HB3  LYS  96           HB3      LYS  96  16.278   0.259  -4.673
   42    HG2  LYS  96           HG2      LYS  96  16.742   1.776  -6.592
   43    HG3  LYS  96           HG3      LYS  96  15.250   1.222  -7.384
   44    HD2  LYS  96           HD2      LYS  96  13.929   2.017  -5.410
   45    HD3  LYS  96           HD3      LYS  96  15.418   2.640  -4.679
   46    HE2  LYS  96           HE2      LYS  96  15.718   4.156  -6.647
   47    HE3  LYS  96           HE3      LYS  96  14.206   3.544  -7.327
   48    HZ1  LYS  96           HZ1      LYS  96  14.482   5.038  -4.762
   49    HZ2  LYS  96           HZ2      LYS  96  13.720   5.579  -6.109
   50    HZ3  LYS  96           HZ3      LYS  96  13.079   4.356  -5.257
   51    H    TYR  97           H        TYR  97  18.241  -1.932  -4.707
   52    HA   TYR  97           HA       TYR  97  20.583  -1.335  -6.436
   53    HB2  TYR  97           HB2      TYR  97  20.619  -0.845  -3.450
   54    HB3  TYR  97           HB3      TYR  97  21.791  -0.324  -4.648
   55    HD1  TYR  97           HD2      TYR  97  21.270   1.640  -6.131
   56    HD2  TYR  97           HD1      TYR  97  18.603   0.396  -2.983
   57    HE1  TYR  97           HE2      TYR  97  19.965   3.738  -6.405
   58    HE2  TYR  97           HE1      TYR  97  17.349   2.540  -3.219
   59    HH   TYR  97           HH       TYR  97  18.215   5.047  -5.602
   60    H    SER  98           H        SER  98  22.456  -2.664  -5.971
   61    HA   SER  98           HA       SER  98  22.120  -5.021  -4.174
   62    HB2  SER  98           HB2      SER  98  21.329  -5.642  -6.481
   63    HB3  SER  98           HB3      SER  98  22.951  -5.236  -7.085
   64    HG   SER  98           HG       SER  98  22.892  -7.425  -6.657
   65    H    TYR  99           H        TYR  99  24.012  -5.814  -3.369
   66    HA   TYR  99           HA       TYR  99  26.575  -4.546  -4.191
   67    HB2  TYR  99           HB2      TYR  99  27.102  -3.980  -1.860
   68    HB3  TYR  99           HB3      TYR  99  25.765  -3.091  -2.522
   69    HD1  TYR  99           HD2      TYR  99  23.440  -3.491  -1.747
   70    HD2  TYR  99           HD1      TYR  99  26.789  -5.558   0.005
   71    HE1  TYR  99           HE2      TYR  99  22.091  -3.931   0.306
   72    HE2  TYR  99           HE1      TYR  99  25.457  -5.982   2.061
   73    HH   TYR  99           HH       TYR  99  22.062  -4.867   2.421
   74    H    VAL 100           H        VAL 100  28.447  -5.342  -3.146
   75    HA   VAL 100           HA       VAL 100  28.489  -8.336  -3.198
   76    HB   VAL 100           HB       VAL 100  30.381  -6.204  -4.281
   77   HG11  VAL 100          HG11      VAL 100  30.783  -9.222  -4.294
   78   HG12  VAL 100          HG12      VAL 100  31.712  -8.061  -5.262
   79   HG13  VAL 100          HG13      VAL 100  31.813  -8.010  -3.509
   80   HG21  VAL 100          HG21      VAL 100  29.877  -7.170  -6.474
   81   HG22  VAL 100          HG22      VAL 100  28.796  -8.365  -5.734
   82   HG23  VAL 100          HG23      VAL 100  28.385  -6.635  -5.699
   83    H    ASP 101           H        ASP 101  29.775  -9.394  -1.815
   84    HA   ASP 101           HA       ASP 101  31.795  -8.020  -0.134
   85    HB2  ASP 101           HB2      ASP 101  29.591  -8.115   1.187
   86    HB3  ASP 101           HB3      ASP 101  29.728  -9.885   1.075
   87    H    GLU 102           H        GLU 102  30.053 -10.995  -0.842
   88    HA   GLU 102           HA       GLU 102  32.242 -12.883  -0.546
   89    HB2  GLU 102           HB2      GLU 102  29.489 -13.020  -1.854
   90    HB3  GLU 102           HB3      GLU 102  30.515 -14.418  -1.559
   91    HG2  GLU 102           HG2      GLU 102  30.305 -14.298   0.781
   92    HG3  GLU 102           HG3      GLU 102  29.657 -12.654   0.755
   93    H    ASN 103           H        ASN 103  32.007 -14.436  -2.718
   94    HA   ASN 103           HA       ASN 103  33.724 -13.319  -4.720
   95    HB2  ASN 103           HB2      ASN 103  32.102 -15.905  -4.674
   96    HB3  ASN 103           HB3      ASN 103  33.354 -15.533  -5.850
   97   HD21  ASN 103          HD22      ASN 103  35.600 -15.476  -5.164
   98   HD22  ASN 103          HD21      ASN 103  36.054 -16.216  -3.638
   99    H    GLY 104           H        GLY 104  30.557 -12.536  -4.397
  100    HA2  GLY 104           HA2      GLY 104  30.187 -11.436  -7.012
  101    HA3  GLY 104           HA3      GLY 104  29.192 -12.888  -6.807
  102    H    GLU 105           H        GLU 105  27.435 -11.210  -7.089
  103    HA   GLU 105           HA       GLU 105  26.698  -9.254  -5.197
  104    HB2  GLU 105           HB2      GLU 105  24.981 -11.168  -6.815
  105    HB3  GLU 105           HB3      GLU 105  24.323  -9.880  -5.797
  106    HG2  GLU 105           HG2      GLU 105  25.594  -8.189  -7.089
  107    HG3  GLU 105           HG3      GLU 105  26.213  -9.464  -8.151
  108    H    THR 106           H        THR 106  25.992  -9.222  -3.211
  109    HA   THR 106           HA       THR 106  25.819 -11.738  -1.688
  110    HB   THR 106           HB       THR 106  27.082  -9.063  -1.254
  111    HG1  THR 106           HG1      THR 106  27.711 -11.738  -0.620
  112   HG21  THR 106          HG21      THR 106  25.790  -9.043   0.734
  113   HG22  THR 106          HG22      THR 106  26.146 -10.762   1.070
  114   HG23  THR 106          HG23      THR 106  27.425  -9.525   1.149
  115    H    LYS 107           H        LYS 107  24.447  -8.408  -1.734
  116    HA   LYS 107           HA       LYS 107  21.809  -9.399  -0.880
  117    HB2  LYS 107           HB2      LYS 107  23.562  -7.643   0.888
  118    HB3  LYS 107           HB3      LYS 107  21.815  -7.624   1.045
  119    HG2  LYS 107           HG2      LYS 107  23.613 -10.011   1.559
  120    HG3  LYS 107           HG3      LYS 107  22.855  -8.985   2.759
  121    HD2  LYS 107           HD2      LYS 107  20.620  -9.669   2.033
  122    HD3  LYS 107           HD3      LYS 107  21.291 -10.707   0.770
  123    HE2  LYS 107           HE2      LYS 107  21.870 -11.048   3.745
  124    HE3  LYS 107           HE3      LYS 107  20.565 -11.874   2.898
  125    HZ1  LYS 107           HZ1      LYS 107  23.462 -12.193   2.279
  126    HZ2  LYS 107           HZ2      LYS 107  22.494 -13.303   2.976
  127    HZ3  LYS 107           HZ3      LYS 107  22.253 -12.881   1.417
  128    H    THR 108           H        THR 108  20.248  -7.573  -0.656
  129    HA   THR 108           HA       THR 108  20.732  -5.419  -2.668
  130    HB   THR 108           HB       THR 108  18.455  -5.834  -3.493
  131    HG1  THR 108           HG1      THR 108  17.419  -7.794  -2.825
  132   HG21  THR 108          HG21      THR 108  18.862  -7.884  -4.735
  133   HG22  THR 108          HG22      THR 108  20.373  -6.978  -4.589
  134   HG23  THR 108          HG23      THR 108  20.092  -8.399  -3.560
  135    H    TRP 109           H        TRP 109  19.062  -3.722  -2.677
  136    HA   TRP 109           HA       TRP 109  17.772  -3.138  -0.077
  137    HB2  TRP 109           HB2      TRP 109  20.136  -2.391   0.111
  138    HB3  TRP 109           HB3      TRP 109  19.939  -1.387  -1.313
  139    HD1  TRP 109           HD1      TRP 109  17.769  -1.694   1.905
  140    HE1  TRP 109           HE1      TRP 109  17.457   0.637   2.932
  141    HE3  TRP 109           HE3      TRP 109  20.724   1.027  -1.302
  142    HZ2  TRP 109           HZ2      TRP 109  18.486   3.287   2.536
  143    HZ3  TRP 109           HZ3      TRP 109  21.077   3.449  -0.902
  144    HH2  TRP 109           HH2      TRP 109  19.972   4.590   1.008
  145    H    THR 110           H        THR 110  16.380  -1.273  -0.139
  146    HA   THR 110           HA       THR 110  15.117  -0.842  -2.814
  147    HB   THR 110           HB       THR 110  13.022  -0.624  -1.456
  148    HG1  THR 110           HG1      THR 110  13.187  -1.309   0.736
  149   HG21  THR 110          HG21      THR 110  12.757  -2.986  -0.916
  150   HG22  THR 110          HG22      THR 110  13.657  -2.824  -2.430
  151   HG23  THR 110          HG23      THR 110  14.514  -3.230  -0.923
  152    H    GLY 111           H        GLY 111  16.915   0.928  -0.596
  153    HA2  GLY 111           HA2      GLY 111  17.297   3.228  -0.563
  154    HA3  GLY 111           HA3      GLY 111  15.881   3.512  -1.570
  155    H    GLN 112           H        GLN 112  15.486   1.564   1.320
  156    HA   GLN 112           HA       GLN 112  14.279   3.850   2.830
  157    HB2  GLN 112           HB2      GLN 112  13.138   1.054   2.396
  158    HB3  GLN 112           HB3      GLN 112  12.507   2.212   3.558
  159    HG2  GLN 112           HG2      GLN 112  12.597   2.620   0.538
  160    HG3  GLN 112           HG3      GLN 112  11.182   2.150   1.466
  161   HE21  GLN 112          HE22      GLN 112  11.367   4.523  -0.232
  162   HE22  GLN 112          HE21      GLN 112  11.161   5.895   0.849
  163    H    GLY 113           H        GLY 113  14.238   3.628   5.114
  164    HA2  GLY 113           HA2      GLY 113  15.239   3.150   7.160
  165    HA3  GLY 113           HA3      GLY 113  15.730   1.576   6.531
  166    H    ARG 114           H        ARG 114  17.675   2.165   7.872
  167    HA   ARG 114           HA       ARG 114  19.559   4.158   7.109
  168    HB2  ARG 114           HB2      ARG 114  21.191   2.904   8.401
  169    HB3  ARG 114           HB3      ARG 114  19.648   2.946   9.221
  170    HG2  ARG 114           HG2      ARG 114  20.144   0.757   9.584
  171    HG3  ARG 114           HG3      ARG 114  19.288   0.565   8.063
  172    HD2  ARG 114           HD2      ARG 114  21.655   0.702   6.943
  173    HD3  ARG 114           HD3      ARG 114  22.287   0.568   8.569
  174    HE   ARG 114           HE       ARG 114  21.699  -1.663   8.646
  175   HH11  ARG 114          HH11      ARG 114  20.056  -0.332   5.802
  176   HH12  ARG 114          HH12      ARG 114  19.616  -1.926   5.246
  177   HH21  ARG 114          HH21      ARG 114  21.102  -3.617   7.849
  178   HH22  ARG 114          HH22      ARG 114  20.190  -3.735   6.375
  179    H    THR 115           H        THR 115  21.159   4.315   5.613
  180    HA   THR 115           HA       THR 115  21.259   2.707   3.269
  181    HB   THR 115           HB       THR 115  23.482   4.434   4.404
  182    HG1  THR 115           HG1      THR 115  22.486   6.080   3.219
  183   HG21  THR 115          HG21      THR 115  24.056   4.772   2.007
  184   HG22  THR 115          HG22      THR 115  24.212   3.071   2.472
  185   HG23  THR 115          HG23      THR 115  22.794   3.605   1.544
  186    HA   PRO 116           HA       PRO 116  23.409  -0.881   4.989
  187    HB2  PRO 116           HB2      PRO 116  24.279  -1.278   2.127
  188    HB3  PRO 116           HB3      PRO 116  23.597  -2.469   3.269
  189    HG2  PRO 116           HG2      PRO 116  22.052  -1.369   1.321
  190    HG3  PRO 116           HG3      PRO 116  21.401  -1.627   2.975
  191    HD2  PRO 116           HD2      PRO 116  22.394   0.937   1.724
  192    HD3  PRO 116           HD3      PRO 116  20.994   0.645   2.800
  193    H    ALA 117           H        ALA 117  25.534  -1.540   5.532
  194    HA   ALA 117           HA       ALA 117  27.348   0.511   5.935
  195    HB1  ALA 117           HB1      ALA 117  27.192  -1.530   7.288
  196    HB2  ALA 117           HB2      ALA 117  27.868  -2.494   5.954
  197    HB3  ALA 117           HB3      ALA 117  28.859  -1.258   6.757
  198    H    VAL 118           H        VAL 118  27.836  -2.109   3.453
  199    HA   VAL 118           HA       VAL 118  30.200  -0.783   2.516
  200    HB   VAL 118           HB       VAL 118  29.805  -3.220   2.318
  201   HG11  VAL 118          HG11      VAL 118  27.478  -3.228   1.461
  202   HG12  VAL 118          HG12      VAL 118  28.049  -2.534  -0.077
  203   HG13  VAL 118          HG13      VAL 118  28.591  -4.144   0.436
  204   HG21  VAL 118          HG21      VAL 118  30.487  -1.901  -0.339
  205   HG22  VAL 118          HG22      VAL 118  31.595  -2.104   1.036
  206   HG23  VAL 118          HG23      VAL 118  30.946  -3.529   0.204
  207    H    ILE 119           H        ILE 119  26.838  -0.426   1.544
  208    HA   ILE 119           HA       ILE 119  27.289   1.072  -0.883
  209    HB   ILE 119           HB       ILE 119  25.019   1.212   1.137
  210   HG12  ILE 119          HG12      ILE 119  25.207  -1.011   0.040
  211   HG13  ILE 119          HG13      ILE 119  23.714  -0.152  -0.297
  212   HG21  ILE 119          HG21      ILE 119  23.707   2.253  -0.735
  213   HG22  ILE 119          HG22      ILE 119  24.969   3.285  -0.066
  214   HG23  ILE 119          HG23      ILE 119  25.240   2.473  -1.616
  215   HD11  ILE 119          HD11      ILE 119  24.602   0.483  -2.548
  216   HD12  ILE 119          HD12      ILE 119  26.071  -0.458  -2.183
  217   HD13  ILE 119          HD13      ILE 119  24.488  -1.255  -2.296
  218    H    LYS 120           H        LYS 120  26.779   2.189   2.523
  219    HA   LYS 120           HA       LYS 120  27.352   4.933   1.851
  220    HB2  LYS 120           HB2      LYS 120  27.296   5.436   4.137
  221    HB3  LYS 120           HB3      LYS 120  26.030   4.251   3.809
  222    HG2  LYS 120           HG2      LYS 120  27.457   2.481   4.772
  223    HG3  LYS 120           HG3      LYS 120  28.674   3.678   5.212
  224    HD2  LYS 120           HD2      LYS 120  25.807   3.477   6.208
  225    HD3  LYS 120           HD3      LYS 120  27.249   3.070   7.122
  226    HE2  LYS 120           HE2      LYS 120  26.461   5.876   6.183
  227    HE3  LYS 120           HE3      LYS 120  26.241   5.227   7.803
  228    HZ1  LYS 120           HZ1      LYS 120  28.708   4.991   7.944
  229    HZ2  LYS 120           HZ2      LYS 120  28.864   5.742   6.476
  230    HZ3  LYS 120           HZ3      LYS 120  28.238   6.544   7.745
  231    H    LYS 121           H        LYS 121  29.503   2.392   3.175
  232    HA   LYS 121           HA       LYS 121  31.760   4.130   3.431
  233    HB2  LYS 121           HB2      LYS 121  31.539   1.108   3.251
  234    HB3  LYS 121           HB3      LYS 121  33.067   1.959   3.530
  235    HG2  LYS 121           HG2      LYS 121  32.256   2.967   5.578
  236    HG3  LYS 121           HG3      LYS 121  30.614   2.418   5.284
  237    HD2  LYS 121           HD2      LYS 121  31.538   1.049   6.976
  238    HD3  LYS 121           HD3      LYS 121  31.311   0.065   5.525
  239    HE2  LYS 121           HE2      LYS 121  33.743   0.298   4.991
  240    HE3  LYS 121           HE3      LYS 121  33.956   1.355   6.391
  241    HZ1  LYS 121           HZ1      LYS 121  33.329  -0.532   7.827
  242    HZ2  LYS 121           HZ2      LYS 121  33.154  -1.518   6.529
  243    HZ3  LYS 121           HZ3      LYS 121  34.626  -0.922   6.914
  244    H    ALA 122           H        ALA 122  30.698   2.182   0.623
  245    HA   ALA 122           HA       ALA 122  32.981   2.751  -0.988
  246    HB1  ALA 122           HB1      ALA 122  31.492   2.195  -2.867
  247    HB2  ALA 122           HB2      ALA 122  31.345   1.025  -1.547
  248    HB3  ALA 122           HB3      ALA 122  30.085   2.259  -1.777
  249    H    MET 123           H        MET 123  29.923   4.622  -0.525
  250    HA   MET 123           HA       MET 123  30.742   6.723  -2.317
  251    HB2  MET 123           HB2      MET 123  28.683   6.735  -0.077
  252    HB3  MET 123           HB3      MET 123  28.903   8.024  -1.268
  253    HG2  MET 123           HG2      MET 123  28.511   6.335  -3.089
  254    HG3  MET 123           HG3      MET 123  28.091   5.150  -1.863
  255    HE1  MET 123           HE1      MET 123  26.035   5.311  -0.288
  256    HE2  MET 123           HE2      MET 123  26.317   6.983   0.247
  257    HE3  MET 123           HE3      MET 123  24.731   6.515  -0.404
  258    H    GLU 124           H        GLU 124  30.998   6.411   1.240
  259    HA   GLU 124           HA       GLU 124  32.073   9.030   1.657
  260    HB2  GLU 124           HB2      GLU 124  31.961   6.523   3.374
  261    HB3  GLU 124           HB3      GLU 124  32.568   8.070   3.960
  262    HG2  GLU 124           HG2      GLU 124  30.434   9.162   3.557
  263    HG3  GLU 124           HG3      GLU 124  29.756   7.707   2.845
  264    H    GLU 125           H        GLU 125  33.702   5.825   1.494
  265    HA   GLU 125           HA       GLU 125  36.340   7.148   1.963
  266    HB2  GLU 125           HB2      GLU 125  35.561   4.234   2.306
  267    HB3  GLU 125           HB3      GLU 125  37.093   4.989   2.738
  268    HG2  GLU 125           HG2      GLU 125  35.804   6.511   4.321
  269    HG3  GLU 125           HG3      GLU 125  34.389   5.493   4.037
  270    H    GLN 126           H        GLN 126  34.633   5.489  -0.565
  271    HA   GLN 126           HA       GLN 126  37.192   5.215  -2.113
  272    HB2  GLN 126           HB2      GLN 126  34.674   3.538  -2.404
  273    HB3  GLN 126           HB3      GLN 126  36.182   3.358  -3.300
  274    HG2  GLN 126           HG2      GLN 126  37.371   2.845  -1.166
  275    HG3  GLN 126           HG3      GLN 126  35.832   2.911  -0.298
  276   HE21  GLN 126          HE22      GLN 126  37.964   0.692  -1.441
  277   HE22  GLN 126          HE21      GLN 126  36.835  -0.590  -1.851
  278    H    GLY 127           H        GLY 127  34.583   7.216  -1.898
  279    HA2  GLY 127           HA2      GLY 127  33.934   8.960  -3.216
  280    HA3  GLY 127           HA3      GLY 127  35.242   8.550  -4.326
  281    H    LYS 128           H        LYS 128  32.856   6.061  -3.785
  282    HA   LYS 128           HA       LYS 128  31.934   6.226  -6.581
  283    HB2  LYS 128           HB2      LYS 128  30.855   4.415  -4.382
  284    HB3  LYS 128           HB3      LYS 128  30.698   4.193  -6.115
  285    HG2  LYS 128           HG2      LYS 128  33.127   3.792  -4.378
  286    HG3  LYS 128           HG3      LYS 128  32.279   2.619  -5.368
  287    HD2  LYS 128           HD2      LYS 128  33.992   4.923  -6.413
  288    HD3  LYS 128           HD3      LYS 128  34.537   3.274  -6.233
  289    HE2  LYS 128           HE2      LYS 128  32.241   4.094  -8.073
  290    HE3  LYS 128           HE3      LYS 128  33.934   3.994  -8.566
  291    HZ1  LYS 128           HZ1      LYS 128  32.887   1.936  -9.118
  292    HZ2  LYS 128           HZ2      LYS 128  33.894   1.608  -7.878
  293    HZ3  LYS 128           HZ3      LYS 128  32.258   1.709  -7.639
  294    H    GLN 129           H        GLN 129  29.470   5.814  -6.875
  295    HA   GLN 129           HA       GLN 129  27.776   7.637  -5.211
  296    HB2  GLN 129           HB2      GLN 129  27.850   7.430  -8.263
  297    HB3  GLN 129           HB3      GLN 129  26.582   8.221  -7.346
  298    HG2  GLN 129           HG2      GLN 129  28.001   9.950  -8.129
  299    HG3  GLN 129           HG3      GLN 129  28.241   9.817  -6.393
  300   HE21  GLN 129          HE22      GLN 129  30.399  10.506  -6.138
  301   HE22  GLN 129          HE21      GLN 129  31.737   9.688  -6.926
  302    H    LEU 130           H        LEU 130  25.436   7.011  -5.351
  303    HA   LEU 130           HA       LEU 130  25.151   4.256  -4.822
  304    HB2  LEU 130           HB2      LEU 130  23.843   6.152  -3.871
  305    HB3  LEU 130           HB3      LEU 130  23.052   6.373  -5.440
  306    HG   LEU 130           HG       LEU 130  21.982   4.191  -5.240
  307   HD11  LEU 130          HD11      LEU 130  22.055   2.915  -3.108
  308   HD12  LEU 130          HD12      LEU 130  23.614   2.904  -3.935
  309   HD13  LEU 130          HD13      LEU 130  23.359   3.978  -2.533
  310   HD21  LEU 130          HD21      LEU 130  20.490   4.711  -3.324
  311   HD22  LEU 130          HD22      LEU 130  21.676   5.894  -2.730
  312   HD23  LEU 130          HD23      LEU 130  20.852   6.155  -4.278
  313    H    GLU 131           H        GLU 131  24.744   5.991  -7.828
  314    HA   GLU 131           HA       GLU 131  23.347   4.081  -9.386
  315    HB2  GLU 131           HB2      GLU 131  23.912   6.436 -10.008
  316    HB3  GLU 131           HB3      GLU 131  25.585   5.935 -10.281
  317    HG2  GLU 131           HG2      GLU 131  24.842   4.404 -12.074
  318    HG3  GLU 131           HG3      GLU 131  23.153   4.797 -11.734
  319    H    ASP 132           H        ASP 132  26.687   3.952  -8.178
  320    HA   ASP 132           HA       ASP 132  27.672   1.942  -9.949
  321    HB2  ASP 132           HB2      ASP 132  28.975   3.467  -8.394
  322    HB3  ASP 132           HB3      ASP 132  28.456   2.435  -7.060
  323    H    PHE 133           H        PHE 133  25.337   1.778  -7.465
  324    HA   PHE 133           HA       PHE 133  25.443  -1.212  -7.292
  325    HB2  PHE 133           HB2      PHE 133  24.441   0.803  -5.244
  326    HB3  PHE 133           HB3      PHE 133  24.501  -0.939  -5.044
  327    HD1  PHE 133           HD2      PHE 133  26.751  -2.129  -4.973
  328    HD2  PHE 133           HD1      PHE 133  26.395   2.169  -4.865
  329    HE1  PHE 133           HE2      PHE 133  29.069  -1.961  -4.090
  330    HE2  PHE 133           HE1      PHE 133  28.707   2.334  -3.971
  331    HZ   PHE 133           HZ       PHE 133  30.048   0.261  -3.599
  332    H    LEU 134           H        LEU 134  23.569   1.460  -8.293
  333    HA   LEU 134           HA       LEU 134  20.885   0.591  -8.031
  334    HB2  LEU 134           HB2      LEU 134  21.682   2.843  -8.574
  335    HB3  LEU 134           HB3      LEU 134  22.407   2.267 -10.066
  336    HG   LEU 134           HG       LEU 134  20.395   3.672 -10.288
  337   HD11  LEU 134          HD11      LEU 134  20.016   0.982 -11.628
  338   HD12  LEU 134          HD12      LEU 134  19.434   2.566 -12.152
  339   HD13  LEU 134          HD13      LEU 134  21.170   2.229 -12.138
  340   HD21  LEU 134          HD21      LEU 134  19.046   2.710  -8.449
  341   HD22  LEU 134          HD22      LEU 134  18.201   2.750  -9.998
  342   HD23  LEU 134          HD23      LEU 134  18.842   1.225  -9.376
  343    H    ILE 135           H        ILE 135  19.636  -0.753  -9.016
  344    HA   ILE 135           HA       ILE 135  20.563  -2.186 -11.487
  345    HB   ILE 135           HB       ILE 135  19.654  -4.230 -10.746
  346   HG12  ILE 135          HG12      ILE 135  18.275  -2.580  -8.687
  347   HG13  ILE 135          HG13      ILE 135  17.724  -3.970  -9.600
  348   HG21  ILE 135          HG21      ILE 135  21.205  -4.786  -9.012
  349   HG22  ILE 135          HG22      ILE 135  21.950  -3.558 -10.040
  350   HG23  ILE 135          HG23      ILE 135  21.292  -3.103  -8.452
  351   HD11  ILE 135          HD11      ILE 135  19.014  -5.461  -8.079
  352   HD12  ILE 135          HD12      ILE 135  19.514  -4.016  -7.156
  353   HD13  ILE 135          HD13      ILE 135  17.808  -4.466  -7.235
  354    H    LYS 136           H        LYS 136  18.007  -0.180 -10.436
  355    HA   LYS 136           HA       LYS 136  16.451  -0.946 -12.876
  356    HB2  LYS 136           HB2      LYS 136  15.269  -0.649 -10.081
  357    HB3  LYS 136           HB3      LYS 136  14.333  -0.554 -11.574
  358    HG2  LYS 136           HG2      LYS 136  15.151  -2.896 -12.145
  359    HG3  LYS 136           HG3      LYS 136  15.861  -2.952 -10.521
  360    HD2  LYS 136           HD2      LYS 136  13.743  -3.998 -10.308
  361    HD3  LYS 136           HD3      LYS 136  13.556  -2.398  -9.594
  362    HE2  LYS 136           HE2      LYS 136  12.889  -2.057 -12.337
  363    HE3  LYS 136           HE3      LYS 136  12.221  -3.634 -11.920
  364    HZ1  LYS 136           HZ1      LYS 136  10.590  -1.940 -11.455
  365    HZ2  LYS 136           HZ2      LYS 136  11.096  -2.483 -10.000
  366    HZ3  LYS 136           HZ3      LYS 136  11.618  -1.028 -10.588
  367    H    GLU 137           H        GLU 137  15.775   1.419 -10.278
  368    HA   GLU 137           HA       GLU 137  15.839   3.653 -12.245
  369    HB2  GLU 137           HB2      GLU 137  13.506   4.087 -11.807
  370    HB3  GLU 137           HB3      GLU 137  13.700   2.388 -12.248
  371    HG2  GLU 137           HG2      GLU 137  13.773   1.987  -9.630
  372    HG3  GLU 137           HG3      GLU 137  12.986   3.561  -9.565
  373    H    LEU 138           H        LEU 138  15.588   5.787 -11.305
  374    HA   LEU 138           HA       LEU 138  16.413   5.980  -8.439
  375    HB2  LEU 138           HB2      LEU 138  17.412   7.512 -10.876
  376    HB3  LEU 138           HB3      LEU 138  17.792   7.968  -9.218
  377    HG   LEU 138           HG       LEU 138  18.591   5.321 -10.483
  378   HD11  LEU 138          HD11      LEU 138  19.774   7.246 -11.461
  379   HD12  LEU 138          HD12      LEU 138  20.239   7.796  -9.836
  380   HD13  LEU 138          HD13      LEU 138  20.859   6.254 -10.476
  381   HD21  LEU 138          HD21      LEU 138  18.388   5.070  -8.062
  382   HD22  LEU 138          HD22      LEU 138  20.107   5.189  -8.470
  383   HD23  LEU 138          HD23      LEU 138  19.265   6.598  -7.792
  384    H    GLU 139           H        GLU 139  13.761   6.158  -9.628
  385    HA   GLU 139           HA       GLU 139  12.683   8.827  -9.320
  386    HB2  GLU 139           HB2      GLU 139  11.531   6.962 -10.483
  387    HB3  GLU 139           HB3      GLU 139  11.326   6.129  -8.935
  388    HG2  GLU 139           HG2      GLU 139   9.959   8.019  -8.092
  389    HG3  GLU 139           HG3      GLU 139  10.241   8.907  -9.594
  Start of MODEL   16
    1    H1   ALA  91           H1       ALA  91  18.912 -13.806 -15.425
    2    H2   ALA  91           H2       ALA  91  19.298 -12.252 -15.091
    3    H3   ALA  91           H3       ALA  91  19.286 -13.367 -13.891
    4    HA   ALA  91           HA       ALA  91  16.931 -12.449 -15.410
    5    HB1  ALA  91           HB1      ALA  91  17.045 -14.397 -13.054
    6    HB2  ALA  91           HB2      ALA  91  15.577 -13.810 -13.866
    7    HB3  ALA  91           HB3      ALA  91  16.720 -14.828 -14.752
    8    H    ALA  92           H        ALA  92  15.393 -11.158 -14.221
    9    HA   ALA  92           HA       ALA  92  16.542  -9.118 -12.543
   10    HB1  ALA  92           HB1      ALA  92  14.684  -8.757 -14.149
   11    HB2  ALA  92           HB2      ALA  92  13.632  -9.806 -13.168
   12    HB3  ALA  92           HB3      ALA  92  14.229  -8.264 -12.512
   13    H    ARG  93           H        ARG  93  15.561  -8.446 -10.454
   14    HA   ARG  93           HA       ARG  93  14.587 -10.572  -8.654
   15    HB2  ARG  93           HB2      ARG  93  16.389 -10.105  -6.973
   16    HB3  ARG  93           HB3      ARG  93  16.917 -10.906  -8.435
   17    HG2  ARG  93           HG2      ARG  93  17.860  -8.755  -9.284
   18    HG3  ARG  93           HG3      ARG  93  17.347  -7.957  -7.780
   19    HD2  ARG  93           HD2      ARG  93  18.782  -9.445  -6.463
   20    HD3  ARG  93           HD3      ARG  93  19.157 -10.405  -7.896
   21    HE   ARG  93           HE       ARG  93  19.943  -7.514  -7.697
   22   HH11  ARG  93          HH11      ARG  93  20.995 -10.834  -8.276
   23   HH12  ARG  93          HH12      ARG  93  22.645 -10.326  -8.583
   24   HH21  ARG  93          HH21      ARG  93  22.118  -7.007  -8.065
   25   HH22  ARG  93          HH22      ARG  93  23.209  -8.292  -8.539
   26    HA   PRO  94           HA       PRO  94  12.172  -7.316  -7.076
   27    HB2  PRO  94           HB2      PRO  94  11.340  -8.189  -4.646
   28    HB3  PRO  94           HB3      PRO  94  11.011  -9.086  -6.148
   29    HG2  PRO  94           HG2      PRO  94  13.301  -9.553  -4.204
   30    HG3  PRO  94           HG3      PRO  94  12.104 -10.748  -4.799
   31    HD2  PRO  94           HD2      PRO  94  14.526 -10.477  -5.971
   32    HD3  PRO  94           HD3      PRO  94  13.065 -10.789  -6.946
   33    H    ALA  95           H        ALA  95  14.532  -6.151  -7.100
   34    HA   ALA  95           HA       ALA  95  14.652  -4.514  -4.624
   35    HB1  ALA  95           HB1      ALA  95  17.034  -6.034  -5.796
   36    HB2  ALA  95           HB2      ALA  95  17.116  -4.848  -4.474
   37    HB3  ALA  95           HB3      ALA  95  16.234  -6.375  -4.251
   38    H    LYS  96           H        LYS  96  16.165  -2.667  -4.894
   39    HA   LYS  96           HA       LYS  96  15.967  -1.491  -7.620
   40    HB2  LYS  96           HB2      LYS  96  14.471  -0.694  -5.753
   41    HB3  LYS  96           HB3      LYS  96  15.914  -0.096  -4.920
   42    HG2  LYS  96           HG2      LYS  96  16.387   1.416  -6.840
   43    HG3  LYS  96           HG3      LYS  96  14.928   0.832  -7.660
   44    HD2  LYS  96           HD2      LYS  96  14.980   2.182  -4.920
   45    HD3  LYS  96           HD3      LYS  96  14.646   3.035  -6.427
   46    HE2  LYS  96           HE2      LYS  96  12.570   1.959  -6.767
   47    HE3  LYS  96           HE3      LYS  96  12.955   0.636  -5.667
   48    HZ1  LYS  96           HZ1      LYS  96  12.419   3.438  -4.798
   49    HZ2  LYS  96           HZ2      LYS  96  11.420   2.166  -4.619
   50    HZ3  LYS  96           HZ3      LYS  96  12.841   2.188  -3.799
   51    H    TYR  97           H        TYR  97  18.081  -2.036  -4.891
   52    HA   TYR  97           HA       TYR  97  20.417  -1.308  -6.554
   53    HB2  TYR  97           HB2      TYR  97  20.291  -0.709  -3.583
   54    HB3  TYR  97           HB3      TYR  97  21.497  -0.177  -4.729
   55    HD1  TYR  97           HD1      TYR  97  20.995   1.686  -6.309
   56    HD2  TYR  97           HD2      TYR  97  18.217   0.486  -3.243
   57    HE1  TYR  97           HE1      TYR  97  19.673   3.754  -6.703
   58    HE2  TYR  97           HE2      TYR  97  16.958   2.612  -3.556
   59    HH   TYR  97           HH       TYR  97  16.784   4.594  -4.746
   60    H    SER  98           H        SER  98  22.348  -2.555  -5.986
   61    HA   SER  98           HA       SER  98  22.187  -4.545  -3.823
   62    HB2  SER  98           HB2      SER  98  22.638  -6.470  -5.349
   63    HB3  SER  98           HB3      SER  98  21.038  -5.746  -5.573
   64    HG   SER  98           HG       SER  98  23.217  -4.970  -7.220
   65    H    TYR  99           H        TYR  99  24.180  -5.602  -3.332
   66    HA   TYR  99           HA       TYR  99  26.604  -4.506  -4.651
   67    HB2  TYR  99           HB2      TYR  99  27.568  -3.760  -2.573
   68    HB3  TYR  99           HB3      TYR  99  26.076  -2.933  -2.905
   69    HD1  TYR  99           HD2      TYR  99  24.031  -3.370  -1.547
   70    HD2  TYR  99           HD1      TYR  99  27.825  -5.191  -0.605
   71    HE1  TYR  99           HE2      TYR  99  23.307  -3.646   0.819
   72    HE2  TYR  99           HE1      TYR  99  27.083  -5.524   1.745
   73    HH   TYR  99           HH       TYR  99  25.460  -5.054   3.330
   74    H    VAL 100           H        VAL 100  28.618  -5.362  -3.572
   75    HA   VAL 100           HA       VAL 100  28.439  -8.342  -3.606
   76    HB   VAL 100           HB       VAL 100  29.127  -6.998  -5.684
   77   HG11  VAL 100          HG11      VAL 100  31.419  -6.280  -5.897
   78   HG12  VAL 100          HG12      VAL 100  30.685  -5.411  -4.544
   79   HG13  VAL 100          HG13      VAL 100  31.793  -6.767  -4.233
   80   HG21  VAL 100          HG21      VAL 100  30.839  -8.588  -6.376
   81   HG22  VAL 100          HG22      VAL 100  30.980  -9.187  -4.710
   82   HG23  VAL 100          HG23      VAL 100  29.453  -9.359  -5.605
   83    H    ASP 101           H        ASP 101  30.241  -9.527  -2.758
   84    HA   ASP 101           HA       ASP 101  32.209  -8.181  -1.054
   85    HB2  ASP 101           HB2      ASP 101  30.117  -8.786   0.368
   86    HB3  ASP 101           HB3      ASP 101  30.615 -10.461   0.152
   87    H    GLU 102           H        GLU 102  33.517 -10.397  -0.022
   88    HA   GLU 102           HA       GLU 102  35.038 -11.125  -2.321
   89    HB2  GLU 102           HB2      GLU 102  35.030 -12.295   0.489
   90    HB3  GLU 102           HB3      GLU 102  36.248 -12.633  -0.747
   91    HG2  GLU 102           HG2      GLU 102  36.770 -10.188  -0.869
   92    HG3  GLU 102           HG3      GLU 102  35.644  -9.904   0.459
   93    H    ASN 103           H        ASN 103  32.359 -12.866  -0.830
   94    HA   ASN 103           HA       ASN 103  32.901 -15.357  -2.220
   95    HB2  ASN 103           HB2      ASN 103  30.521 -14.390  -0.584
   96    HB3  ASN 103           HB3      ASN 103  30.693 -16.023  -1.213
   97   HD21  ASN 103          HD22      ASN 103  30.812 -14.628   1.635
   98   HD22  ASN 103          HD21      ASN 103  32.169 -15.492   2.348
   99    H    GLY 104           H        GLY 104  31.376 -12.437  -3.231
  100    HA2  GLY 104           HA2      GLY 104  30.663 -12.627  -5.730
  101    HA3  GLY 104           HA3      GLY 104  29.494 -13.799  -5.116
  102    H    GLU 105           H        GLU 105  27.962 -12.199  -6.151
  103    HA   GLU 105           HA       GLU 105  27.328  -9.679  -4.968
  104    HB2  GLU 105           HB2      GLU 105  25.439 -11.733  -6.166
  105    HB3  GLU 105           HB3      GLU 105  25.046 -10.061  -5.713
  106    HG2  GLU 105           HG2      GLU 105  26.902  -9.311  -7.304
  107    HG3  GLU 105           HG3      GLU 105  26.957 -10.972  -7.903
  108    H    THR 106           H        THR 106  26.571  -9.147  -2.973
  109    HA   THR 106           HA       THR 106  26.156 -11.435  -1.190
  110    HB   THR 106           HB       THR 106  28.126 -10.081  -0.800
  111    HG1  THR 106           HG1      THR 106  27.831 -10.194   1.426
  112   HG21  THR 106          HG21      THR 106  27.207  -7.770  -1.110
  113   HG22  THR 106          HG22      THR 106  26.243  -7.983   0.367
  114   HG23  THR 106          HG23      THR 106  28.002  -7.990   0.442
  115    H    LYS 107           H        LYS 107  24.753  -8.160  -1.764
  116    HA   LYS 107           HA       LYS 107  22.218  -9.019  -0.472
  117    HB2  LYS 107           HB2      LYS 107  24.085  -6.910   0.688
  118    HB3  LYS 107           HB3      LYS 107  22.360  -6.915   1.045
  119    HG2  LYS 107           HG2      LYS 107  22.575  -9.273   1.880
  120    HG3  LYS 107           HG3      LYS 107  24.336  -9.122   1.725
  121    HD2  LYS 107           HD2      LYS 107  24.363  -7.264   3.312
  122    HD3  LYS 107           HD3      LYS 107  22.586  -7.312   3.441
  123    HE2  LYS 107           HE2      LYS 107  22.734  -9.664   4.275
  124    HE3  LYS 107           HE3      LYS 107  24.497  -9.592   4.165
  125    HZ1  LYS 107           HZ1      LYS 107  23.727  -9.135   6.425
  126    HZ2  LYS 107           HZ2      LYS 107  24.465  -7.804   5.838
  127    HZ3  LYS 107           HZ3      LYS 107  22.834  -7.863   5.931
  128    H    THR 108           H        THR 108  20.609  -7.341  -0.397
  129    HA   THR 108           HA       THR 108  20.551  -5.587  -2.817
  130    HB   THR 108           HB       THR 108  18.215  -6.387  -3.116
  131    HG1  THR 108           HG1      THR 108  17.621  -8.324  -2.045
  132   HG21  THR 108          HG21      THR 108  20.228  -8.675  -3.201
  133   HG22  THR 108          HG22      THR 108  18.718  -8.551  -4.127
  134   HG23  THR 108          HG23      THR 108  20.046  -7.429  -4.453
  135    H    TRP 109           H        TRP 109  18.921  -3.916  -2.781
  136    HA   TRP 109           HA       TRP 109  17.612  -3.259  -0.210
  137    HB2  TRP 109           HB2      TRP 109  19.920  -2.370  -0.041
  138    HB3  TRP 109           HB3      TRP 109  19.700  -1.479  -1.529
  139    HD1  TRP 109           HD1      TRP 109  17.431  -1.633   1.622
  140    HE1  TRP 109           HE1      TRP 109  17.071   0.743   2.520
  141    HE3  TRP 109           HE3      TRP 109  20.515   0.937  -1.577
  142    HZ2  TRP 109           HZ2      TRP 109  18.076   3.372   2.021
  143    HZ3  TRP 109           HZ3      TRP 109  20.839   3.386  -1.280
  144    HH2  TRP 109           HH2      TRP 109  19.635   4.610   0.506
  145    H    THR 110           H        THR 110  16.066  -1.558  -0.367
  146    HA   THR 110           HA       THR 110  14.861  -1.244  -3.091
  147    HB   THR 110           HB       THR 110  12.731  -1.095  -1.805
  148    HG1  THR 110           HG1      THR 110  12.897  -1.659   0.435
  149   HG21  THR 110          HG21      THR 110  14.325  -3.565  -0.989
  150   HG22  THR 110          HG22      THR 110  12.563  -3.408  -1.111
  151   HG23  THR 110          HG23      THR 110  13.555  -3.340  -2.573
  152    H    GLY 111           H        GLY 111  16.334   0.622  -0.629
  153    HA2  GLY 111           HA2      GLY 111  16.576   3.016  -0.707
  154    HA3  GLY 111           HA3      GLY 111  15.004   3.160  -1.485
  155    H    GLN 112           H        GLN 112  14.217   0.953   0.748
  156    HA   GLN 112           HA       GLN 112  13.012   2.855   2.591
  157    HB2  GLN 112           HB2      GLN 112  13.178  -0.193   2.578
  158    HB3  GLN 112           HB3      GLN 112  12.211   0.750   3.714
  159    HG2  GLN 112           HG2      GLN 112  10.860   1.683   1.888
  160    HG3  GLN 112           HG3      GLN 112  11.826   0.819   0.690
  161   HE21  GLN 112          HE22      GLN 112   9.123   0.541   2.875
  162   HE22  GLN 112          HE21      GLN 112   8.827  -1.164   2.558
  163    H    GLY 113           H        GLY 113  13.246   2.796   4.940
  164    HA2  GLY 113           HA2      GLY 113  14.435   2.797   6.930
  165    HA3  GLY 113           HA3      GLY 113  15.454   1.520   6.280
  166    H    ARG 114           H        ARG 114  17.541   2.036   6.070
  167    HA   ARG 114           HA       ARG 114  18.437   4.752   5.257
  168    HB2  ARG 114           HB2      ARG 114  19.463   3.248   7.714
  169    HB3  ARG 114           HB3      ARG 114  20.251   4.661   7.024
  170    HG2  ARG 114           HG2      ARG 114  17.456   4.637   8.243
  171    HG3  ARG 114           HG3      ARG 114  18.930   5.198   9.025
  172    HD2  ARG 114           HD2      ARG 114  19.221   6.956   7.330
  173    HD3  ARG 114           HD3      ARG 114  17.763   6.434   6.489
  174    HE   ARG 114           HE       ARG 114  17.948   7.889   9.052
  175   HH11  ARG 114          HH11      ARG 114  15.719   6.220   6.882
  176   HH12  ARG 114          HH12      ARG 114  14.341   7.062   7.547
  177   HH21  ARG 114          HH21      ARG 114  16.135   8.880   9.845
  178   HH22  ARG 114          HH22      ARG 114  14.573   8.510   9.176
  179    H    THR 115           H        THR 115  20.592   4.826   4.480
  180    HA   THR 115           HA       THR 115  21.197   3.024   2.511
  181    HB   THR 115           HB       THR 115  23.213   4.776   3.940
  182    HG1  THR 115           HG1      THR 115  22.471   6.363   2.483
  183   HG21  THR 115          HG21      THR 115  24.254   3.336   2.241
  184   HG22  THR 115          HG22      THR 115  23.015   3.811   1.050
  185   HG23  THR 115          HG23      THR 115  24.195   5.000   1.655
  186    HA   PRO 116           HA       PRO 116  22.942  -0.502   4.748
  187    HB2  PRO 116           HB2      PRO 116  24.012  -1.179   2.014
  188    HB3  PRO 116           HB3      PRO 116  23.171  -2.232   3.188
  189    HG2  PRO 116           HG2      PRO 116  21.868  -1.219   1.028
  190    HG3  PRO 116           HG3      PRO 116  21.060  -1.314   2.627
  191    HD2  PRO 116           HD2      PRO 116  22.285   1.091   1.284
  192    HD3  PRO 116           HD3      PRO 116  20.791   0.948   2.261
  193    H    ALA 117           H        ALA 117  24.986  -1.331   5.398
  194    HA   ALA 117           HA       ALA 117  26.924   0.572   5.907
  195    HB1  ALA 117           HB1      ALA 117  26.548  -1.452   7.227
  196    HB2  ALA 117           HB2      ALA 117  27.215  -2.459   5.924
  197    HB3  ALA 117           HB3      ALA 117  28.258  -1.308   6.788
  198    H    VAL 118           H        VAL 118  27.289  -2.010   3.370
  199    HA   VAL 118           HA       VAL 118  29.859  -0.956   2.595
  200    HB   VAL 118           HB       VAL 118  27.997  -2.822   1.074
  201   HG11  VAL 118          HG11      VAL 118  29.636  -1.912  -0.507
  202   HG12  VAL 118          HG12      VAL 118  30.961  -2.260   0.627
  203   HG13  VAL 118          HG13      VAL 118  30.046  -3.583  -0.132
  204   HG21  VAL 118          HG21      VAL 118  29.506  -4.621   1.923
  205   HG22  VAL 118          HG22      VAL 118  30.401  -3.412   2.865
  206   HG23  VAL 118          HG23      VAL 118  28.708  -3.776   3.249
  207    H    ILE 119           H        ILE 119  26.579  -0.323   1.427
  208    HA   ILE 119           HA       ILE 119  27.297   1.197  -0.904
  209    HB   ILE 119           HB       ILE 119  24.891   1.511   0.931
  210   HG12  ILE 119          HG12      ILE 119  25.015  -0.780   0.005
  211   HG13  ILE 119          HG13      ILE 119  23.619   0.127  -0.543
  212   HG21  ILE 119          HG21      ILE 119  25.373   2.540  -1.894
  213   HG22  ILE 119          HG22      ILE 119  23.792   2.519  -1.075
  214   HG23  ILE 119          HG23      ILE 119  25.109   3.503  -0.434
  215   HD11  ILE 119          HD11      ILE 119  24.698   0.510  -2.730
  216   HD12  ILE 119          HD12      ILE 119  26.140  -0.384  -2.169
  217   HD13  ILE 119          HD13      ILE 119  24.578  -1.203  -2.348
  218    H    LYS 120           H        LYS 120  26.679   2.279   2.495
  219    HA   LYS 120           HA       LYS 120  27.459   5.000   1.924
  220    HB2  LYS 120           HB2      LYS 120  27.349   5.440   4.231
  221    HB3  LYS 120           HB3      LYS 120  26.010   4.373   3.801
  222    HG2  LYS 120           HG2      LYS 120  27.220   2.467   4.766
  223    HG3  LYS 120           HG3      LYS 120  28.538   3.518   5.284
  224    HD2  LYS 120           HD2      LYS 120  25.632   3.596   6.194
  225    HD3  LYS 120           HD3      LYS 120  26.994   3.000   7.127
  226    HE2  LYS 120           HE2      LYS 120  26.556   5.906   6.274
  227    HE3  LYS 120           HE3      LYS 120  26.209   5.228   7.861
  228    HZ1  LYS 120           HZ1      LYS 120  28.340   6.289   7.948
  229    HZ2  LYS 120           HZ2      LYS 120  28.638   4.688   8.039
  230    HZ3  LYS 120           HZ3      LYS 120  28.921   5.521   6.641
  231    H    LYS 121           H        LYS 121  29.381   2.279   3.258
  232    HA   LYS 121           HA       LYS 121  31.738   3.848   3.661
  233    HB2  LYS 121           HB2      LYS 121  31.310   0.861   3.326
  234    HB3  LYS 121           HB3      LYS 121  32.898   1.569   3.652
  235    HG2  LYS 121           HG2      LYS 121  32.178   2.532   5.745
  236    HG3  LYS 121           HG3      LYS 121  30.486   2.193   5.405
  237    HD2  LYS 121           HD2      LYS 121  31.230   0.645   7.043
  238    HD3  LYS 121           HD3      LYS 121  30.896  -0.226   5.548
  239    HE2  LYS 121           HE2      LYS 121  33.335  -0.287   5.025
  240    HE3  LYS 121           HE3      LYS 121  33.676   0.664   6.478
  241    HZ1  LYS 121           HZ1      LYS 121  32.804  -1.193   7.817
  242    HZ2  LYS 121           HZ2      LYS 121  32.495  -2.075   6.473
  243    HZ3  LYS 121           HZ3      LYS 121  34.033  -1.705   6.882
  244    H    ALA 122           H        ALA 122  30.623   2.135   0.733
  245    HA   ALA 122           HA       ALA 122  32.957   2.693  -0.822
  246    HB1  ALA 122           HB1      ALA 122  31.238   1.033  -1.429
  247    HB2  ALA 122           HB2      ALA 122  30.057   2.335  -1.691
  248    HB3  ALA 122           HB3      ALA 122  31.495   2.209  -2.729
  249    H    MET 123           H        MET 123  29.989   4.681  -0.254
  250    HA   MET 123           HA       MET 123  30.771   6.849  -1.964
  251    HB2  MET 123           HB2      MET 123  29.007   6.810   0.517
  252    HB3  MET 123           HB3      MET 123  29.175   8.185  -0.568
  253    HG2  MET 123           HG2      MET 123  28.136   7.040  -2.368
  254    HG3  MET 123           HG3      MET 123  28.267   5.472  -1.577
  255    HE1  MET 123           HE1      MET 123  25.570   6.665  -2.939
  256    HE2  MET 123           HE2      MET 123  25.807   5.028  -2.284
  257    HE3  MET 123           HE3      MET 123  24.411   6.002  -1.762
  258    H    GLU 124           H        GLU 124  31.262   6.299   1.548
  259    HA   GLU 124           HA       GLU 124  32.584   8.772   2.044
  260    HB2  GLU 124           HB2      GLU 124  32.395   6.162   3.591
  261    HB3  GLU 124           HB3      GLU 124  33.175   7.612   4.227
  262    HG2  GLU 124           HG2      GLU 124  31.118   8.894   4.067
  263    HG3  GLU 124           HG3      GLU 124  30.278   7.562   3.297
  264    H    GLU 125           H        GLU 125  33.943   5.495   1.476
  265    HA   GLU 125           HA       GLU 125  36.700   6.576   1.839
  266    HB2  GLU 125           HB2      GLU 125  35.688   3.713   1.920
  267    HB3  GLU 125           HB3      GLU 125  37.316   4.247   2.274
  268    HG2  GLU 125           HG2      GLU 125  34.818   4.922   3.882
  269    HG3  GLU 125           HG3      GLU 125  36.078   3.781   4.321
  270    H    GLN 126           H        GLN 126  34.693   5.352  -0.730
  271    HA   GLN 126           HA       GLN 126  37.109   5.131  -2.500
  272    HB2  GLN 126           HB2      GLN 126  34.556   3.481  -2.668
  273    HB3  GLN 126           HB3      GLN 126  35.933   3.377  -3.753
  274    HG2  GLN 126           HG2      GLN 126  35.956   2.675  -0.792
  275    HG3  GLN 126           HG3      GLN 126  35.889   1.535  -2.122
  276   HE21  GLN 126          HE22      GLN 126  37.959   1.683  -0.017
  277   HE22  GLN 126          HE21      GLN 126  39.465   1.957  -0.880
  278    H    GLY 127           H        GLY 127  34.574   7.130  -1.904
  279    HA2  GLY 127           HA2      GLY 127  33.743   8.923  -3.055
  280    HA3  GLY 127           HA3      GLY 127  34.936   8.602  -4.314
  281    H    LYS 128           H        LYS 128  32.652   6.045  -3.633
  282    HA   LYS 128           HA       LYS 128  31.537   6.135  -6.324
  283    HB2  LYS 128           HB2      LYS 128  30.823   4.523  -3.821
  284    HB3  LYS 128           HB3      LYS 128  29.990   4.304  -5.349
  285    HG2  LYS 128           HG2      LYS 128  32.957   3.801  -4.904
  286    HG3  LYS 128           HG3      LYS 128  31.663   2.601  -5.049
  287    HD2  LYS 128           HD2      LYS 128  31.185   3.652  -7.381
  288    HD3  LYS 128           HD3      LYS 128  32.778   4.419  -7.212
  289    HE2  LYS 128           HE2      LYS 128  33.803   2.178  -6.865
  290    HE3  LYS 128           HE3      LYS 128  32.187   1.443  -6.999
  291    HZ1  LYS 128           HZ1      LYS 128  33.460   1.348  -9.103
  292    HZ2  LYS 128           HZ2      LYS 128  32.041   2.140  -9.276
  293    HZ3  LYS 128           HZ3      LYS 128  33.465   2.977  -9.205
  294    H    GLN 129           H        GLN 129  29.221   5.994  -6.738
  295    HA   GLN 129           HA       GLN 129  27.449   7.671  -5.020
  296    HB2  GLN 129           HB2      GLN 129  27.682   7.832  -8.064
  297    HB3  GLN 129           HB3      GLN 129  26.414   8.596  -7.089
  298    HG2  GLN 129           HG2      GLN 129  28.159   9.925  -5.889
  299    HG3  GLN 129           HG3      GLN 129  29.395   9.220  -6.933
  300   HE21  GLN 129          HE22      GLN 129  29.739  10.175  -8.993
  301   HE22  GLN 129          HE21      GLN 129  28.720  11.471  -9.598
  302    H    LEU 130           H        LEU 130  25.103   7.148  -5.476
  303    HA   LEU 130           HA       LEU 130  24.815   4.387  -4.983
  304    HB2  LEU 130           HB2      LEU 130  23.422   6.274  -4.117
  305    HB3  LEU 130           HB3      LEU 130  22.711   6.460  -5.722
  306    HG   LEU 130           HG       LEU 130  21.664   4.278  -5.568
  307   HD11  LEU 130          HD11      LEU 130  21.698   2.960  -3.456
  308   HD12  LEU 130          HD12      LEU 130  23.266   2.980  -4.241
  309   HD13  LEU 130          HD13      LEU 130  22.979   4.024  -2.828
  310   HD21  LEU 130          HD21      LEU 130  20.120   4.727  -3.666
  311   HD22  LEU 130          HD22      LEU 130  21.262   5.928  -3.034
  312   HD23  LEU 130          HD23      LEU 130  20.461   6.191  -4.602
  313    H    GLU 131           H        GLU 131  24.551   6.114  -8.013
  314    HA   GLU 131           HA       GLU 131  23.183   4.161  -9.575
  315    HB2  GLU 131           HB2      GLU 131  25.320   6.192 -10.361
  316    HB3  GLU 131           HB3      GLU 131  24.380   5.232 -11.506
  317    HG2  GLU 131           HG2      GLU 131  22.279   6.184 -10.579
  318    HG3  GLU 131           HG3      GLU 131  23.221   7.231  -9.522
  319    H    ASP 132           H        ASP 132  26.487   4.055  -8.314
  320    HA   ASP 132           HA       ASP 132  27.503   2.075 -10.118
  321    HB2  ASP 132           HB2      ASP 132  28.799   3.506  -8.429
  322    HB3  ASP 132           HB3      ASP 132  28.285   2.361  -7.193
  323    H    PHE 133           H        PHE 133  25.187   1.915  -7.564
  324    HA   PHE 133           HA       PHE 133  25.227  -1.079  -7.445
  325    HB2  PHE 133           HB2      PHE 133  24.220   0.932  -5.400
  326    HB3  PHE 133           HB3      PHE 133  24.339  -0.805  -5.194
  327    HD1  PHE 133           HD1      PHE 133  26.671  -1.901  -5.242
  328    HD2  PHE 133           HD2      PHE 133  26.089   2.355  -4.913
  329    HE1  PHE 133           HE1      PHE 133  28.963  -1.656  -4.313
  330    HE2  PHE 133           HE2      PHE 133  28.378   2.599  -3.975
  331    HZ   PHE 133           HZ       PHE 133  29.814   0.587  -3.688
  332    H    LEU 134           H        LEU 134  23.311   1.623  -8.373
  333    HA   LEU 134           HA       LEU 134  20.646   0.707  -8.216
  334    HB2  LEU 134           HB2      LEU 134  21.417   2.977  -8.770
  335    HB3  LEU 134           HB3      LEU 134  22.188   2.392 -10.231
  336    HG   LEU 134           HG       LEU 134  20.144   3.738 -10.533
  337   HD11  LEU 134          HD11      LEU 134  20.982   2.227 -12.323
  338   HD12  LEU 134          HD12      LEU 134  19.802   1.008 -11.806
  339   HD13  LEU 134          HD13      LEU 134  19.253   2.578 -12.389
  340   HD21  LEU 134          HD21      LEU 134  18.646   1.287  -9.543
  341   HD22  LEU 134          HD22      LEU 134  18.758   2.843  -8.722
  342   HD23  LEU 134          HD23      LEU 134  17.960   2.739 -10.289
  343    H    ILE 135           H        ILE 135  19.500  -0.716  -9.154
  344    HA   ILE 135           HA       ILE 135  20.372  -1.979 -11.730
  345    HB   ILE 135           HB       ILE 135  19.603  -4.137 -11.050
  346   HG12  ILE 135          HG12      ILE 135  18.450  -2.690  -8.727
  347   HG13  ILE 135          HG13      ILE 135  17.852  -4.068  -9.619
  348   HG21  ILE 135          HG21      ILE 135  21.513  -3.061  -8.955
  349   HG22  ILE 135          HG22      ILE 135  21.402  -4.713  -9.591
  350   HG23  ILE 135          HG23      ILE 135  21.942  -3.406 -10.641
  351   HD11  ILE 135          HD11      ILE 135  18.316  -4.661  -7.313
  352   HD12  ILE 135          HD12      ILE 135  19.456  -5.518  -8.376
  353   HD13  ILE 135          HD13      ILE 135  19.979  -4.080  -7.456
  354    H    LYS 136           H        LYS 136  17.764  -0.257 -10.339
  355    HA   LYS 136           HA       LYS 136  16.126  -0.950 -12.746
  356    HB2  LYS 136           HB2      LYS 136  15.031  -0.889  -9.904
  357    HB3  LYS 136           HB3      LYS 136  14.051  -0.870 -11.374
  358    HG2  LYS 136           HG2      LYS 136  15.162  -3.052 -12.050
  359    HG3  LYS 136           HG3      LYS 136  15.876  -3.101 -10.424
  360    HD2  LYS 136           HD2      LYS 136  13.559  -2.955  -9.453
  361    HD3  LYS 136           HD3      LYS 136  12.905  -3.009 -11.105
  362    HE2  LYS 136           HE2      LYS 136  14.133  -5.206 -11.439
  363    HE3  LYS 136           HE3      LYS 136  14.577  -5.162  -9.723
  364    HZ1  LYS 136           HZ1      LYS 136  11.798  -5.282 -10.809
  365    HZ2  LYS 136           HZ2      LYS 136  12.578  -6.479 -10.015
  366    HZ3  LYS 136           HZ3      LYS 136  12.145  -5.119  -9.216
  367    H    GLU 137           H        GLU 137  15.503   1.276  -9.986
  368    HA   GLU 137           HA       GLU 137  15.294   3.559 -11.902
  369    HB2  GLU 137           HB2      GLU 137  13.100   2.480 -10.079
  370    HB3  GLU 137           HB3      GLU 137  13.033   4.057 -10.840
  371    HG2  GLU 137           HG2      GLU 137  13.092   1.392 -12.298
  372    HG3  GLU 137           HG3      GLU 137  11.680   2.400 -12.019
  373    H    LEU 138           H        LEU 138  14.846   5.635 -10.792
  374    HA   LEU 138           HA       LEU 138  16.153   5.841  -8.105
  375    HB2  LEU 138           HB2      LEU 138  16.653   7.474 -10.624
  376    HB3  LEU 138           HB3      LEU 138  17.267   7.911  -9.037
  377    HG   LEU 138           HG       LEU 138  17.995   5.306 -10.442
  378   HD11  LEU 138          HD11      LEU 138  18.767   7.308 -11.695
  379   HD12  LEU 138          HD12      LEU 138  19.606   7.873 -10.235
  380   HD13  LEU 138          HD13      LEU 138  20.087   6.352 -11.026
  381   HD21  LEU 138          HD21      LEU 138  18.304   5.190  -8.012
  382   HD22  LEU 138          HD22      LEU 138  19.886   5.316  -8.802
  383   HD23  LEU 138          HD23      LEU 138  19.169   6.742  -8.018
  384    H    GLU 139           H        GLU 139  15.760   7.845  -7.004
  385    HA   GLU 139           HA       GLU 139  13.189   9.239  -7.580
  386    HB2  GLU 139           HB2      GLU 139  13.870   7.700  -5.040
  387    HB3  GLU 139           HB3      GLU 139  12.547   8.852  -5.190
  388    HG2  GLU 139           HG2      GLU 139  11.480   7.465  -6.924
  389    HG3  GLU 139           HG3      GLU 139  12.816   6.307  -6.854
  Start of MODEL   17
    1    H1   ALA  91           H1       ALA  91   9.268 -17.910  -1.979
    2    H2   ALA  91           H2       ALA  91   7.795 -18.351  -2.542
    3    H3   ALA  91           H3       ALA  91   8.994 -17.981  -3.591
    4    HA   ALA  91           HA       ALA  91   7.421 -16.178  -3.490
    5    HB1  ALA  91           HB1      ALA  91   6.595 -16.605  -1.200
    6    HB2  ALA  91           HB2      ALA  91   8.146 -16.058  -0.524
    7    HB3  ALA  91           HB3      ALA  91   7.098 -14.919  -1.392
    8    H    ALA  92           H        ALA  92   8.062 -13.911  -3.613
    9    HA   ALA  92           HA       ALA  92  10.887 -13.206  -3.140
   10    HB1  ALA  92           HB1      ALA  92  10.886 -14.323  -5.363
   11    HB2  ALA  92           HB2      ALA  92   9.620 -13.211  -5.927
   12    HB3  ALA  92           HB3      ALA  92  11.238 -12.595  -5.520
   13    H    ARG  93           H        ARG  93  11.295 -10.908  -3.788
   14    HA   ARG  93           HA       ARG  93   8.940  -9.087  -3.696
   15    HB2  ARG  93           HB2      ARG  93  11.303  -9.070  -1.759
   16    HB3  ARG  93           HB3      ARG  93  10.212  -7.701  -1.965
   17    HG2  ARG  93           HG2      ARG  93   8.285  -9.143  -1.300
   18    HG3  ARG  93           HG3      ARG  93   9.416 -10.475  -0.989
   19    HD2  ARG  93           HD2      ARG  93  10.596  -9.092   0.689
   20    HD3  ARG  93           HD3      ARG  93   9.467  -7.757   0.387
   21    HE   ARG  93           HE       ARG  93   7.947 -10.075   1.039
   22   HH11  ARG  93          HH11      ARG  93  10.105  -7.857   2.691
   23   HH12  ARG  93          HH12      ARG  93   9.368  -8.150   4.240
   24   HH21  ARG  93          HH21      ARG  93   7.046 -10.396   3.046
   25   HH22  ARG  93          HH22      ARG  93   7.675  -9.551   4.429
   26    HA   PRO  94           HA       PRO  94  11.369  -6.825  -6.651
   27    HB2  PRO  94           HB2      PRO  94  10.371  -4.282  -6.451
   28    HB3  PRO  94           HB3      PRO  94   9.418  -5.659  -7.095
   29    HG2  PRO  94           HG2      PRO  94   9.391  -4.538  -4.270
   30    HG3  PRO  94           HG3      PRO  94   7.988  -4.881  -5.336
   31    HD2  PRO  94           HD2      PRO  94   8.817  -6.654  -3.451
   32    HD3  PRO  94           HD3      PRO  94   8.214  -7.214  -5.044
   33    H    ALA  95           H        ALA  95  12.914  -5.069  -6.929
   34    HA   ALA  95           HA       ALA  95  14.069  -3.696  -4.613
   35    HB1  ALA  95           HB1      ALA  95  15.106  -5.946  -4.446
   36    HB2  ALA  95           HB2      ALA  95  15.645  -5.833  -6.138
   37    HB3  ALA  95           HB3      ALA  95  16.308  -4.735  -4.907
   38    H    LYS  96           H        LYS  96  16.039  -2.402  -5.349
   39    HA   LYS  96           HA       LYS  96  16.132  -1.797  -8.231
   40    HB2  LYS  96           HB2      LYS  96  14.522  -0.219  -7.351
   41    HB3  LYS  96           HB3      LYS  96  15.632   0.285  -6.071
   42    HG2  LYS  96           HG2      LYS  96  17.067   1.409  -7.602
   43    HG3  LYS  96           HG3      LYS  96  16.363   0.597  -9.005
   44    HD2  LYS  96           HD2      LYS  96  15.721   2.953  -8.883
   45    HD3  LYS  96           HD3      LYS  96  14.326   1.876  -8.835
   46    HE2  LYS  96           HE2      LYS  96  14.152   2.160  -6.374
   47    HE3  LYS  96           HE3      LYS  96  15.594   3.180  -6.375
   48    HZ1  LYS  96           HZ1      LYS  96  13.039   3.849  -7.766
   49    HZ2  LYS  96           HZ2      LYS  96  13.556   4.516  -6.368
   50    HZ3  LYS  96           HZ3      LYS  96  14.372   4.795  -7.753
   51    H    TYR  97           H        TYR  97  17.845  -2.141  -5.285
   52    HA   TYR  97           HA       TYR  97  20.380  -1.398  -6.671
   53    HB2  TYR  97           HB2      TYR  97  19.844  -1.125  -3.705
   54    HB3  TYR  97           HB3      TYR  97  21.221  -0.510  -4.600
   55    HD1  TYR  97           HD1      TYR  97  21.018   1.589  -5.917
   56    HD2  TYR  97           HD2      TYR  97  17.691   0.010  -3.682
   57    HE1  TYR  97           HE1      TYR  97  19.773   3.721  -6.249
   58    HE2  TYR  97           HE2      TYR  97  16.477   2.172  -3.972
   59    HH   TYR  97           HH       TYR  97  17.874   4.938  -5.763
   60    H    SER  98           H        SER  98  22.287  -2.625  -5.963
   61    HA   SER  98           HA       SER  98  21.889  -4.997  -4.250
   62    HB2  SER  98           HB2      SER  98  21.248  -5.672  -6.609
   63    HB3  SER  98           HB3      SER  98  22.919  -5.310  -7.089
   64    HG   SER  98           HG       SER  98  22.659  -7.536  -6.545
   65    H    TYR  99           H        TYR  99  23.795  -5.809  -3.375
   66    HA   TYR  99           HA       TYR  99  26.355  -4.546  -4.184
   67    HB2  TYR  99           HB2      TYR  99  26.843  -3.678  -2.024
   68    HB3  TYR  99           HB3      TYR  99  25.297  -3.056  -2.527
   69    HD1  TYR  99           HD1      TYR  99  23.200  -3.791  -1.395
   70    HD2  TYR  99           HD2      TYR  99  27.059  -5.256  -0.152
   71    HE1  TYR  99           HE1      TYR  99  22.279  -4.325   0.865
   72    HE2  TYR  99           HE2      TYR  99  26.134  -5.815   2.085
   73    HH   TYR  99           HH       TYR  99  24.313  -5.715   3.480
   74    H    VAL 100           H        VAL 100  28.146  -5.168  -2.915
   75    HA   VAL 100           HA       VAL 100  28.482  -8.130  -2.625
   76    HB   VAL 100           HB       VAL 100  30.055  -5.942  -4.073
   77   HG11  VAL 100          HG11      VAL 100  31.071  -8.749  -3.519
   78   HG12  VAL 100          HG12      VAL 100  31.774  -7.608  -4.678
   79   HG13  VAL 100          HG13      VAL 100  31.784  -7.224  -2.969
   80   HG21  VAL 100          HG21      VAL 100  29.102  -8.604  -5.169
   81   HG22  VAL 100          HG22      VAL 100  28.209  -7.070  -5.350
   82   HG23  VAL 100          HG23      VAL 100  29.815  -7.253  -6.058
   83    H    ASP 101           H        ASP 101  29.343  -8.626  -0.629
   84    HA   ASP 101           HA       ASP 101  30.430  -6.573   1.123
   85    HB2  ASP 101           HB2      ASP 101  29.208  -8.509   1.983
   86    HB3  ASP 101           HB3      ASP 101  30.435  -9.605   1.348
   87    H    GLU 102           H        GLU 102  32.020  -9.458  -0.406
   88    HA   GLU 102           HA       GLU 102  34.335  -7.900  -1.190
   89    HB2  GLU 102           HB2      GLU 102  34.928  -8.278   1.158
   90    HB3  GLU 102           HB3      GLU 102  34.565 -10.002   1.017
   91    HG2  GLU 102           HG2      GLU 102  36.397 -10.307  -0.543
   92    HG3  GLU 102           HG3      GLU 102  36.680  -8.564  -0.610
   93    H    ASN 103           H        ASN 103  33.487 -11.356  -0.502
   94    HA   ASN 103           HA       ASN 103  35.039 -12.305  -2.685
   95    HB2  ASN 103           HB2      ASN 103  34.570 -13.527  -0.564
   96    HB3  ASN 103           HB3      ASN 103  32.875 -13.696  -1.038
   97   HD21  ASN 103          HD21      ASN 103  36.229 -14.611  -1.973
   98   HD22  ASN 103          HD22      ASN 103  35.726 -16.070  -2.813
   99    H    GLY 104           H        GLY 104  31.696 -11.308  -2.610
  100    HA2  GLY 104           HA2      GLY 104  31.191 -11.402  -5.384
  101    HA3  GLY 104           HA3      GLY 104  30.622 -12.927  -4.705
  102    H    GLU 105           H        GLU 105  28.619 -11.812  -5.707
  103    HA   GLU 105           HA       GLU 105  27.277  -9.644  -4.535
  104    HB2  GLU 105           HB2      GLU 105  25.246 -10.513  -5.488
  105    HB3  GLU 105           HB3      GLU 105  26.588 -10.624  -6.622
  106    HG2  GLU 105           HG2      GLU 105  26.808 -13.072  -6.075
  107    HG3  GLU 105           HG3      GLU 105  25.395 -12.934  -5.023
  108    H    THR 106           H        THR 106  26.005  -9.254  -2.856
  109    HA   THR 106           HA       THR 106  25.920 -11.294  -0.721
  110    HB   THR 106           HB       THR 106  26.414  -8.314  -0.693
  111    HG1  THR 106           HG1      THR 106  27.809 -10.572   0.346
  112   HG21  THR 106          HG21      THR 106  25.787 -10.064   1.699
  113   HG22  THR 106          HG22      THR 106  26.598  -8.474   1.759
  114   HG23  THR 106          HG23      THR 106  24.945  -8.587   1.154
  115    H    LYS 107           H        LYS 107  24.124  -8.284  -1.667
  116    HA   LYS 107           HA       LYS 107  21.669  -9.778  -1.851
  117    HB2  LYS 107           HB2      LYS 107  20.353  -8.972  -0.034
  118    HB3  LYS 107           HB3      LYS 107  21.774  -9.722   0.647
  119    HG2  LYS 107           HG2      LYS 107  22.804  -7.516   1.025
  120    HG3  LYS 107           HG3      LYS 107  21.379  -6.716   0.343
  121    HD2  LYS 107           HD2      LYS 107  21.358  -8.521   2.805
  122    HD3  LYS 107           HD3      LYS 107  21.406  -6.754   2.838
  123    HE2  LYS 107           HE2      LYS 107  19.235  -6.671   1.610
  124    HE3  LYS 107           HE3      LYS 107  19.151  -8.434   1.656
  125    HZ1  LYS 107           HZ1      LYS 107  19.212  -6.677   4.060
  126    HZ2  LYS 107           HZ2      LYS 107  17.889  -7.448   3.486
  127    HZ3  LYS 107           HZ3      LYS 107  19.131  -8.309   4.102
  128    H    THR 108           H        THR 108  19.701  -8.431  -2.056
  129    HA   THR 108           HA       THR 108  20.191  -5.951  -3.620
  130    HB   THR 108           HB       THR 108  17.852  -6.306  -4.388
  131    HG1  THR 108           HG1      THR 108  16.958  -8.393  -3.990
  132   HG21  THR 108          HG21      THR 108  19.730  -7.127  -5.747
  133   HG22  THR 108          HG22      THR 108  19.684  -8.685  -4.890
  134   HG23  THR 108          HG23      THR 108  18.313  -8.172  -5.898
  135    H    TRP 109           H        TRP 109  18.584  -4.224  -3.408
  136    HA   TRP 109           HA       TRP 109  17.220  -3.916  -0.798
  137    HB2  TRP 109           HB2      TRP 109  19.555  -3.273  -0.378
  138    HB3  TRP 109           HB3      TRP 109  19.543  -2.198  -1.756
  139    HD1  TRP 109           HD1      TRP 109  17.148  -2.448   1.299
  140    HE1  TRP 109           HE1      TRP 109  16.957  -0.125   2.395
  141    HE3  TRP 109           HE3      TRP 109  20.474   0.153  -1.635
  142    HZ2  TRP 109           HZ2      TRP 109  18.164   2.449   2.134
  143    HZ3  TRP 109           HZ3      TRP 109  20.962   2.534  -1.131
  144    HH2  TRP 109           HH2      TRP 109  19.814   3.696   0.732
  145    H    THR 110           H        THR 110  15.828  -2.062  -0.701
  146    HA   THR 110           HA       THR 110  14.591  -1.397  -3.320
  147    HB   THR 110           HB       THR 110  12.649  -0.804  -1.830
  148    HG1  THR 110           HG1      THR 110  12.931  -1.492   0.388
  149   HG21  THR 110          HG21      THR 110  12.820  -3.125  -2.668
  150   HG22  THR 110          HG22      THR 110  13.789  -3.576  -1.241
  151   HG23  THR 110          HG23      THR 110  12.103  -3.065  -1.057
  152    H    GLY 111           H        GLY 111  16.459   0.164  -0.865
  153    HA2  GLY 111           HA2      GLY 111  17.137   2.462  -0.909
  154    HA3  GLY 111           HA3      GLY 111  15.677   2.898  -1.777
  155    H    GLN 112           H        GLN 112  14.506   0.828   0.523
  156    HA   GLN 112           HA       GLN 112  13.524   2.992   2.234
  157    HB2  GLN 112           HB2      GLN 112  13.143  -0.029   2.318
  158    HB3  GLN 112           HB3      GLN 112  12.311   1.122   3.367
  159    HG2  GLN 112           HG2      GLN 112  11.233   2.192   1.432
  160    HG3  GLN 112           HG3      GLN 112  12.091   1.124   0.320
  161   HE21  GLN 112          HE22      GLN 112   9.191   1.454   2.153
  162   HE22  GLN 112          HE21      GLN 112   8.656  -0.209   1.949
  163    H    GLY 113           H        GLY 113  13.939   3.316   4.427
  164    HA2  GLY 113           HA2      GLY 113  15.087   3.260   6.437
  165    HA3  GLY 113           HA3      GLY 113  15.696   1.658   6.033
  166    H    ARG 114           H        ARG 114  17.622   2.599   7.158
  167    HA   ARG 114           HA       ARG 114  19.267   4.655   5.942
  168    HB2  ARG 114           HB2      ARG 114  19.921   2.401   7.900
  169    HB3  ARG 114           HB3      ARG 114  21.074   3.637   7.391
  170    HG2  ARG 114           HG2      ARG 114  19.540   5.421   8.225
  171    HG3  ARG 114           HG3      ARG 114  18.461   4.179   8.875
  172    HD2  ARG 114           HD2      ARG 114  21.408   4.469   9.582
  173    HD3  ARG 114           HD3      ARG 114  20.085   5.180  10.530
  174    HE   ARG 114           HE       ARG 114  19.487   2.436  10.286
  175   HH11  ARG 114          HH11      ARG 114  21.958   4.356  11.863
  176   HH12  ARG 114          HH12      ARG 114  22.237   3.159  13.100
  177   HH21  ARG 114          HH21      ARG 114  19.902   0.934  11.882
  178   HH22  ARG 114          HH22      ARG 114  21.101   1.264  13.096
  179    H    THR 115           H        THR 115  21.108   4.520   4.717
  180    HA   THR 115           HA       THR 115  21.247   2.662   2.629
  181    HB   THR 115           HB       THR 115  23.484   4.431   3.675
  182    HG1  THR 115           HG1      THR 115  22.604   5.953   2.260
  183   HG21  THR 115          HG21      THR 115  24.308   2.866   1.964
  184   HG22  THR 115          HG22      THR 115  22.947   3.291   0.893
  185   HG23  THR 115          HG23      THR 115  24.198   4.494   1.291
  186    HA   PRO 116           HA       PRO 116  23.322  -0.903   4.493
  187    HB2  PRO 116           HB2      PRO 116  24.322  -1.171   1.644
  188    HB3  PRO 116           HB3      PRO 116  23.743  -2.448   2.762
  189    HG2  PRO 116           HG2      PRO 116  22.080  -1.474   0.862
  190    HG3  PRO 116           HG3      PRO 116  21.475  -1.719   2.532
  191    HD2  PRO 116           HD2      PRO 116  22.356   0.858   1.220
  192    HD3  PRO 116           HD3      PRO 116  20.955   0.541   2.287
  193    H    ALA 117           H        ALA 117  25.336  -1.365   5.340
  194    HA   ALA 117           HA       ALA 117  27.020   0.772   5.769
  195    HB1  ALA 117           HB1      ALA 117  26.776  -1.166   7.252
  196    HB2  ALA 117           HB2      ALA 117  27.651  -2.196   6.099
  197    HB3  ALA 117           HB3      ALA 117  28.486  -0.850   6.911
  198    H    VAL 118           H        VAL 118  27.872  -1.969   3.537
  199    HA   VAL 118           HA       VAL 118  30.334  -0.715   2.796
  200    HB   VAL 118           HB       VAL 118  29.899  -3.139   2.659
  201   HG11  VAL 118          HG11      VAL 118  28.435  -2.549   0.046
  202   HG12  VAL 118          HG12      VAL 118  28.850  -4.132   0.728
  203   HG13  VAL 118          HG13      VAL 118  27.666  -3.110   1.552
  204   HG21  VAL 118          HG21      VAL 118  31.248  -3.562   0.688
  205   HG22  VAL 118          HG22      VAL 118  30.891  -1.957   0.033
  206   HG23  VAL 118          HG23      VAL 118  31.844  -2.123   1.527
  207    H    ILE 119           H        ILE 119  27.096  -0.349   1.433
  208    HA   ILE 119           HA       ILE 119  27.906   1.107  -0.953
  209    HB   ILE 119           HB       ILE 119  25.305   1.160   0.637
  210   HG12  ILE 119          HG12      ILE 119  26.166  -0.274  -1.904
  211   HG13  ILE 119          HG13      ILE 119  25.754  -1.016  -0.363
  212   HG21  ILE 119          HG21      ILE 119  24.306   2.324  -1.276
  213   HG22  ILE 119          HG22      ILE 119  25.587   3.296  -0.594
  214   HG23  ILE 119          HG23      ILE 119  25.892   2.388  -2.090
  215   HD11  ILE 119          HD11      ILE 119  23.883  -1.356  -1.800
  216   HD12  ILE 119          HD12      ILE 119  23.391  -0.099  -0.657
  217   HD13  ILE 119          HD13      ILE 119  23.858   0.330  -2.322
  218    H    LYS 120           H        LYS 120  27.009   2.146   2.374
  219    HA   LYS 120           HA       LYS 120  27.659   4.931   2.030
  220    HB2  LYS 120           HB2      LYS 120  26.346   4.148   3.913
  221    HB3  LYS 120           HB3      LYS 120  27.678   3.152   4.510
  222    HG2  LYS 120           HG2      LYS 120  29.031   5.132   4.983
  223    HG3  LYS 120           HG3      LYS 120  27.837   6.180   4.195
  224    HD2  LYS 120           HD2      LYS 120  27.609   6.429   6.557
  225    HD3  LYS 120           HD3      LYS 120  26.179   5.583   5.958
  226    HE2  LYS 120           HE2      LYS 120  27.096   3.423   6.734
  227    HE3  LYS 120           HE3      LYS 120  28.605   4.209   7.223
  228    HZ1  LYS 120           HZ1      LYS 120  25.932   4.780   8.433
  229    HZ2  LYS 120           HZ2      LYS 120  27.112   3.895   9.130
  230    HZ3  LYS 120           HZ3      LYS 120  27.337   5.490   8.875
  231    H    LYS 121           H        LYS 121  29.745   2.185   3.059
  232    HA   LYS 121           HA       LYS 121  32.006   3.876   3.448
  233    HB2  LYS 121           HB2      LYS 121  31.490   1.268   4.112
  234    HB3  LYS 121           HB3      LYS 121  32.549   1.015   2.728
  235    HG2  LYS 121           HG2      LYS 121  33.971   1.094   4.656
  236    HG3  LYS 121           HG3      LYS 121  34.175   2.653   3.845
  237    HD2  LYS 121           HD2      LYS 121  32.288   3.491   5.496
  238    HD3  LYS 121           HD3      LYS 121  32.613   2.011   6.390
  239    HE2  LYS 121           HE2      LYS 121  34.918   2.679   6.798
  240    HE3  LYS 121           HE3      LYS 121  34.798   3.987   5.611
  241    HZ1  LYS 121           HZ1      LYS 121  33.138   5.074   7.038
  242    HZ2  LYS 121           HZ2      LYS 121  33.318   3.908   8.188
  243    HZ3  LYS 121           HZ3      LYS 121  34.571   4.894   7.828
  244    H    ALA 122           H        ALA 122  30.949   2.226   0.503
  245    HA   ALA 122           HA       ALA 122  33.186   2.979  -1.097
  246    HB1  ALA 122           HB1      ALA 122  31.672   2.549  -2.982
  247    HB2  ALA 122           HB2      ALA 122  31.500   1.302  -1.735
  248    HB3  ALA 122           HB3      ALA 122  30.270   2.574  -1.887
  249    H    MET 123           H        MET 123  30.221   4.833  -0.224
  250    HA   MET 123           HA       MET 123  30.878   7.155  -1.794
  251    HB2  MET 123           HB2      MET 123  29.200   6.909   0.729
  252    HB3  MET 123           HB3      MET 123  29.284   8.328  -0.298
  253    HG2  MET 123           HG2      MET 123  28.196   7.247  -2.098
  254    HG3  MET 123           HG3      MET 123  28.440   5.640  -1.417
  255    HE1  MET 123           HE1      MET 123  25.976   5.158  -2.076
  256    HE2  MET 123           HE2      MET 123  24.563   6.005  -1.407
  257    HE3  MET 123           HE3      MET 123  25.627   6.830  -2.572
  258    H    GLU 124           H        GLU 124  31.527   6.329   1.659
  259    HA   GLU 124           HA       GLU 124  32.824   8.799   2.269
  260    HB2  GLU 124           HB2      GLU 124  32.904   6.085   3.637
  261    HB3  GLU 124           HB3      GLU 124  33.652   7.546   4.287
  262    HG2  GLU 124           HG2      GLU 124  31.416   8.679   4.218
  263    HG3  GLU 124           HG3      GLU 124  30.681   7.128   3.807
  264    H    GLU 125           H        GLU 125  34.235   5.638   1.338
  265    HA   GLU 125           HA       GLU 125  36.979   6.778   1.646
  266    HB2  GLU 125           HB2      GLU 125  36.045   3.895   1.480
  267    HB3  GLU 125           HB3      GLU 125  37.678   4.427   1.798
  268    HG2  GLU 125           HG2      GLU 125  35.255   4.877   3.588
  269    HG3  GLU 125           HG3      GLU 125  36.558   3.726   3.859
  270    H    GLN 126           H        GLN 126  34.885   5.717  -0.928
  271    HA   GLN 126           HA       GLN 126  37.209   5.803  -2.824
  272    HB2  GLN 126           HB2      GLN 126  34.785   3.971  -2.923
  273    HB3  GLN 126           HB3      GLN 126  36.018   4.084  -4.169
  274    HG2  GLN 126           HG2      GLN 126  36.469   3.145  -1.307
  275    HG3  GLN 126           HG3      GLN 126  36.332   2.114  -2.721
  276   HE21  GLN 126          HE22      GLN 126  38.620   2.250  -0.880
  277   HE22  GLN 126          HE21      GLN 126  39.986   2.742  -1.871
  278    H    GLY 127           H        GLY 127  34.516   7.514  -1.939
  279    HA2  GLY 127           HA2      GLY 127  33.495   9.320  -2.886
  280    HA3  GLY 127           HA3      GLY 127  34.686   9.251  -4.187
  281    H    LYS 128           H        LYS 128  32.648   6.431  -3.729
  282    HA   LYS 128           HA       LYS 128  31.491   6.744  -6.410
  283    HB2  LYS 128           HB2      LYS 128  30.683   4.704  -4.290
  284    HB3  LYS 128           HB3      LYS 128  30.429   4.590  -6.021
  285    HG2  LYS 128           HG2      LYS 128  33.002   4.300  -4.480
  286    HG3  LYS 128           HG3      LYS 128  32.169   3.097  -5.449
  287    HD2  LYS 128           HD2      LYS 128  33.577   5.571  -6.554
  288    HD3  LYS 128           HD3      LYS 128  34.303   3.986  -6.440
  289    HE2  LYS 128           HE2      LYS 128  31.794   4.595  -8.083
  290    HE3  LYS 128           HE3      LYS 128  33.440   4.639  -8.713
  291    HZ1  LYS 128           HZ1      LYS 128  32.052   2.218  -7.661
  292    HZ2  LYS 128           HZ2      LYS 128  32.516   2.501  -9.192
  293    HZ3  LYS 128           HZ3      LYS 128  33.659   2.256  -8.048
  294    H    GLN 129           H        GLN 129  29.095   6.303  -6.697
  295    HA   GLN 129           HA       GLN 129  27.367   7.774  -4.747
  296    HB2  GLN 129           HB2      GLN 129  27.385   8.035  -7.785
  297    HB3  GLN 129           HB3      GLN 129  26.111   8.672  -6.746
  298    HG2  GLN 129           HG2      GLN 129  29.039   9.525  -6.695
  299    HG3  GLN 129           HG3      GLN 129  27.724  10.413  -7.440
  300   HE21  GLN 129          HE22      GLN 129  29.492  11.417  -5.316
  301   HE22  GLN 129          HE21      GLN 129  28.436  11.764  -3.956
  302    H    LEU 130           H        LEU 130  25.009   7.196  -5.087
  303    HA   LEU 130           HA       LEU 130  24.835   4.421  -4.642
  304    HB2  LEU 130           HB2      LEU 130  23.375   6.177  -3.661
  305    HB3  LEU 130           HB3      LEU 130  22.638   6.438  -5.245
  306    HG   LEU 130           HG       LEU 130  21.688   4.187  -5.212
  307   HD11  LEU 130          HD11      LEU 130  21.761   2.756  -3.233
  308   HD12  LEU 130          HD12      LEU 130  23.382   2.961  -3.879
  309   HD13  LEU 130          HD13      LEU 130  22.886   3.883  -2.434
  310   HD21  LEU 130          HD21      LEU 130  20.409   6.031  -4.194
  311   HD22  LEU 130          HD22      LEU 130  20.089   4.506  -3.350
  312   HD23  LEU 130          HD23      LEU 130  21.178   5.704  -2.622
  313    H    GLU 131           H        GLU 131  24.363   6.166  -7.632
  314    HA   GLU 131           HA       GLU 131  23.089   4.140  -9.189
  315    HB2  GLU 131           HB2      GLU 131  23.919   5.308 -11.129
  316    HB3  GLU 131           HB3      GLU 131  23.317   6.452  -9.931
  317    HG2  GLU 131           HG2      GLU 131  25.679   6.899  -9.209
  318    HG3  GLU 131           HG3      GLU 131  26.252   5.782 -10.448
  319    H    ASP 132           H        ASP 132  26.382   4.178  -7.943
  320    HA   ASP 132           HA       ASP 132  27.459   2.227  -9.749
  321    HB2  ASP 132           HB2      ASP 132  28.704   3.784  -8.161
  322    HB3  ASP 132           HB3      ASP 132  28.221   2.703  -6.851
  323    H    PHE 133           H        PHE 133  25.093   1.997  -7.313
  324    HA   PHE 133           HA       PHE 133  25.245  -0.991  -7.157
  325    HB2  PHE 133           HB2      PHE 133  24.214   0.981  -5.087
  326    HB3  PHE 133           HB3      PHE 133  24.258  -0.765  -4.927
  327    HD1  PHE 133           HD1      PHE 133  26.447  -1.969  -4.705
  328    HD2  PHE 133           HD2      PHE 133  26.226   2.334  -4.754
  329    HE1  PHE 133           HE1      PHE 133  28.735  -1.840  -3.744
  330    HE2  PHE 133           HE2      PHE 133  28.516   2.462  -3.804
  331    HZ   PHE 133           HZ       PHE 133  29.768   0.372  -3.298
  332    H    LEU 134           H        LEU 134  23.276   1.735  -8.019
  333    HA   LEU 134           HA       LEU 134  20.679   0.488  -7.994
  334    HB2  LEU 134           HB2      LEU 134  21.390   2.975  -8.145
  335    HB3  LEU 134           HB3      LEU 134  21.616   2.679  -9.869
  336    HG   LEU 134           HG       LEU 134  19.031   2.346  -8.307
  337   HD11  LEU 134          HD11      LEU 134  18.297   4.386  -9.425
  338   HD12  LEU 134          HD12      LEU 134  19.787   4.704  -8.525
  339   HD13  LEU 134          HD13      LEU 134  19.841   4.506 -10.290
  340   HD21  LEU 134          HD21      LEU 134  17.964   2.360 -10.612
  341   HD22  LEU 134          HD22      LEU 134  19.587   2.080 -11.277
  342   HD23  LEU 134          HD23      LEU 134  18.829   0.893 -10.182
  343    H    ILE 135           H        ILE 135  20.011  -1.127  -9.213
  344    HA   ILE 135           HA       ILE 135  21.387  -1.742 -11.804
  345    HB   ILE 135           HB       ILE 135  21.127  -4.181 -11.208
  346   HG12  ILE 135          HG12      ILE 135  21.177  -4.802  -8.850
  347   HG13  ILE 135          HG13      ILE 135  20.832  -3.154  -8.351
  348   HG21  ILE 135          HG21      ILE 135  23.213  -4.194  -9.939
  349   HG22  ILE 135          HG22      ILE 135  23.264  -2.971 -11.211
  350   HG23  ILE 135          HG23      ILE 135  23.006  -2.482  -9.524
  351   HD11  ILE 135          HD11      ILE 135  18.573  -3.315  -9.284
  352   HD12  ILE 135          HD12      ILE 135  18.952  -4.898 -10.002
  353   HD13  ILE 135          HD13      ILE 135  18.877  -4.705  -8.238
  354    H    LYS 136           H        LYS 136  18.215  -1.225 -10.584
  355    HA   LYS 136           HA       LYS 136  16.835  -3.073 -12.316
  356    HB2  LYS 136           HB2      LYS 136  15.805  -2.044 -10.346
  357    HB3  LYS 136           HB3      LYS 136  15.840  -0.450 -11.123
  358    HG2  LYS 136           HG2      LYS 136  14.321  -1.285 -12.895
  359    HG3  LYS 136           HG3      LYS 136  14.349  -2.903 -12.168
  360    HD2  LYS 136           HD2      LYS 136  13.314  -1.987 -10.104
  361    HD3  LYS 136           HD3      LYS 136  13.294  -0.365 -10.834
  362    HE2  LYS 136           HE2      LYS 136  11.867  -1.245 -12.692
  363    HE3  LYS 136           HE3      LYS 136  11.879  -2.845 -11.946
  364    HZ1  LYS 136           HZ1      LYS 136   9.865  -1.616 -11.363
  365    HZ2  LYS 136           HZ2      LYS 136  10.735  -1.877 -10.007
  366    HZ3  LYS 136           HZ3      LYS 136  10.717  -0.391 -10.704
  367    H    GLU 137           H        GLU 137  17.503   0.405 -12.761
  368    HA   GLU 137           HA       GLU 137  17.751   0.130 -15.654
  369    HB2  GLU 137           HB2      GLU 137  15.237   0.251 -15.236
  370    HB3  GLU 137           HB3      GLU 137  15.489   1.821 -14.482
  371    HG2  GLU 137           HG2      GLU 137  14.701   2.152 -16.722
  372    HG3  GLU 137           HG3      GLU 137  16.368   2.689 -16.663
  373    H    LEU 138           H        LEU 138  18.835   1.916 -16.564
  374    HA   LEU 138           HA       LEU 138  19.345   4.357 -14.988
  375    HB2  LEU 138           HB2      LEU 138  21.525   2.434 -15.924
  376    HB3  LEU 138           HB3      LEU 138  21.837   4.124 -15.554
  377    HG   LEU 138           HG       LEU 138  20.824   2.070 -13.534
  378   HD11  LEU 138          HD11      LEU 138  23.141   1.671 -14.257
  379   HD12  LEU 138          HD12      LEU 138  23.557   3.363 -13.914
  380   HD13  LEU 138          HD13      LEU 138  23.084   2.273 -12.593
  381   HD21  LEU 138          HD21      LEU 138  21.462   3.854 -11.880
  382   HD22  LEU 138          HD22      LEU 138  21.693   4.989 -13.223
  383   HD23  LEU 138          HD23      LEU 138  20.084   4.314 -12.873
  384    H    GLU 139           H        GLU 139  20.275   6.056 -16.243
  385    HA   GLU 139           HA       GLU 139  20.212   5.860 -19.210
  386    HB2  GLU 139           HB2      GLU 139  18.559   7.831 -17.576
  387    HB3  GLU 139           HB3      GLU 139  18.875   7.959 -19.306
  388    HG2  GLU 139           HG2      GLU 139  17.758   5.749 -19.662
  389    HG3  GLU 139           HG3      GLU 139  17.350   5.696 -17.944
  Start of MODEL   18
    1    H1   ALA  91           H1       ALA  91   3.394   3.313  -5.260
    2    H2   ALA  91           H2       ALA  91   2.103   2.387  -4.857
    3    H3   ALA  91           H3       ALA  91   2.472   3.715  -3.970
    4    HA   ALA  91           HA       ALA  91   4.541   2.740  -3.230
    5    HB1  ALA  91           HB1      ALA  91   3.602   1.030  -1.718
    6    HB2  ALA  91           HB2      ALA  91   2.532   2.432  -1.813
    7    HB3  ALA  91           HB3      ALA  91   2.124   0.940  -2.691
    8    H    ALA  92           H        ALA  92   5.886   0.819  -3.020
    9    HA   ALA  92           HA       ALA  92   5.586  -1.340  -5.009
   10    HB1  ALA  92           HB1      ALA  92   6.754   0.467  -6.244
   11    HB2  ALA  92           HB2      ALA  92   7.980   0.567  -4.960
   12    HB3  ALA  92           HB3      ALA  92   7.845  -0.896  -5.956
   13    H    ARG  93           H        ARG  93   7.244  -3.010  -4.737
   14    HA   ARG  93           HA       ARG  93   8.439  -3.207  -2.008
   15    HB2  ARG  93           HB2      ARG  93   6.718  -5.329  -3.337
   16    HB3  ARG  93           HB3      ARG  93   7.691  -5.575  -1.884
   17    HG2  ARG  93           HG2      ARG  93   6.397  -3.809  -0.706
   18    HG3  ARG  93           HG3      ARG  93   5.397  -3.591  -2.150
   19    HD2  ARG  93           HD2      ARG  93   4.176  -4.989  -0.618
   20    HD3  ARG  93           HD3      ARG  93   4.661  -5.954  -2.006
   21    HE   ARG  93           HE       ARG  93   6.029  -7.262  -0.668
   22   HH11  ARG  93          HH21      ARG  93   5.023  -4.537   1.306
   23   HH12  ARG  93          HH22      ARG  93   5.638  -5.261   2.766
   24   HH21  ARG  93          HH11      ARG  93   6.819  -8.096   1.213
   25   HH22  ARG  93          HH12      ARG  93   6.638  -7.220   2.706
   26    HA   PRO  94           HA       PRO  94  10.988  -6.175  -4.916
   27    HB2  PRO  94           HB2      PRO  94  10.814  -4.388  -7.350
   28    HB3  PRO  94           HB3      PRO  94  11.088  -6.160  -7.277
   29    HG2  PRO  94           HG2      PRO  94   8.630  -5.213  -7.869
   30    HG3  PRO  94           HG3      PRO  94   8.792  -6.555  -6.684
   31    HD2  PRO  94           HD2      PRO  94   8.433  -3.597  -6.127
   32    HD3  PRO  94           HD3      PRO  94   7.602  -4.996  -5.375
   33    H    ALA  95           H        ALA  95  13.256  -5.934  -5.358
   34    HA   ALA  95           HA       ALA  95  14.544  -3.706  -4.096
   35    HB1  ALA  95           HB1      ALA  95  15.677  -5.925  -5.856
   36    HB2  ALA  95           HB2      ALA  95  16.617  -4.858  -4.795
   37    HB3  ALA  95           HB3      ALA  95  15.459  -5.999  -4.095
   38    H    LYS  96           H        LYS  96  16.175  -2.358  -4.995
   39    HA   LYS  96           HA       LYS  96  16.046  -1.692  -7.878
   40    HB2  LYS  96           HB2      LYS  96  14.609  -0.156  -6.549
   41    HB3  LYS  96           HB3      LYS  96  16.018   0.348  -5.613
   42    HG2  LYS  96           HG2      LYS  96  17.070   1.248  -7.651
   43    HG3  LYS  96           HG3      LYS  96  15.704   0.700  -8.626
   44    HD2  LYS  96           HD2      LYS  96  15.692   2.834  -6.447
   45    HD3  LYS  96           HD3      LYS  96  15.646   3.106  -8.196
   46    HE2  LYS  96           HE2      LYS  96  13.450   1.844  -8.284
   47    HE3  LYS  96           HE3      LYS  96  13.489   1.727  -6.513
   48    HZ1  LYS  96           HZ1      LYS  96  12.153   3.625  -7.231
   49    HZ2  LYS  96           HZ2      LYS  96  13.471   4.194  -6.446
   50    HZ3  LYS  96           HZ3      LYS  96  13.393   4.259  -8.089
   51    H    TYR  97           H        TYR  97  17.986  -2.478  -5.223
   52    HA   TYR  97           HA       TYR  97  20.465  -1.636  -6.645
   53    HB2  TYR  97           HB2      TYR  97  19.831  -1.502  -3.673
   54    HB3  TYR  97           HB3      TYR  97  21.412  -1.182  -4.364
   55    HD1  TYR  97           HD1      TYR  97  17.925   0.094  -4.058
   56    HD2  TYR  97           HD2      TYR  97  21.967   0.940  -5.283
   57    HE1  TYR  97           HE1      TYR  97  17.339   2.498  -4.328
   58    HE2  TYR  97           HE2      TYR  97  21.398   3.340  -5.499
   59    HH   TYR  97           HH       TYR  97  18.105   4.613  -4.871
   60    H    SER  98           H        SER  98  22.293  -2.964  -6.297
   61    HA   SER  98           HA       SER  98  22.088  -5.381  -4.604
   62    HB2  SER  98           HB2      SER  98  21.316  -6.120  -6.836
   63    HB3  SER  98           HB3      SER  98  22.845  -5.528  -7.542
   64    HG   SER  98           HG       SER  98  22.872  -7.806  -7.039
   65    H    TYR  99           H        TYR  99  24.019  -6.056  -3.813
   66    HA   TYR  99           HA       TYR  99  26.544  -4.730  -4.627
   67    HB2  TYR  99           HB2      TYR  99  26.903  -3.757  -2.420
   68    HB3  TYR  99           HB3      TYR  99  25.459  -3.131  -3.169
   69    HD1  TYR  99           HD2      TYR  99  23.209  -3.718  -2.330
   70    HD2  TYR  99           HD1      TYR  99  26.788  -5.113  -0.368
   71    HE1  TYR  99           HE2      TYR  99  21.909  -4.107  -0.233
   72    HE2  TYR  99           HE1      TYR  99  25.492  -5.513   1.715
   73    HH   TYR  99           HH       TYR  99  21.997  -4.755   1.986
   74    H    VAL 100           H        VAL 100  28.325  -5.300  -3.018
   75    HA   VAL 100           HA       VAL 100  28.397  -8.250  -2.546
   76    HB   VAL 100           HB       VAL 100  29.279  -7.951  -4.707
   77   HG11  VAL 100          HG11      VAL 100  30.986  -5.643  -3.698
   78   HG12  VAL 100          HG12      VAL 100  31.124  -6.407  -5.296
   79   HG13  VAL 100          HG13      VAL 100  29.642  -5.553  -4.866
   80   HG21  VAL 100          HG21      VAL 100  30.742  -9.306  -3.103
   81   HG22  VAL 100          HG22      VAL 100  31.505  -8.737  -4.596
   82   HG23  VAL 100          HG23      VAL 100  31.824  -7.914  -3.055
   83    H    ASP 101           H        ASP 101  30.023  -8.976  -1.114
   84    HA   ASP 101           HA       ASP 101  31.248  -6.898   0.679
   85    HB2  ASP 101           HB2      ASP 101  29.405  -8.040   1.799
   86    HB3  ASP 101           HB3      ASP 101  30.142  -9.612   1.455
   87    H    GLU 102           H        GLU 102  31.743 -10.331  -0.512
   88    HA   GLU 102           HA       GLU 102  34.557  -9.610  -1.011
   89    HB2  GLU 102           HB2      GLU 102  34.567 -10.407   1.302
   90    HB3  GLU 102           HB3      GLU 102  33.691 -11.872   0.843
   91    HG2  GLU 102           HG2      GLU 102  35.555 -12.616  -0.518
   92    HG3  GLU 102           HG3      GLU 102  36.407 -11.088  -0.264
   93    H    ASN 103           H        ASN 103  32.484 -12.597  -1.004
   94    HA   ASN 103           HA       ASN 103  33.980 -13.727  -3.134
   95    HB2  ASN 103           HB2      ASN 103  32.502 -15.599  -2.921
   96    HB3  ASN 103           HB3      ASN 103  32.835 -14.987  -1.310
   97   HD21  ASN 103          HD22      ASN 103  30.381 -16.194  -3.200
   98   HD22  ASN 103          HD21      ASN 103  29.029 -15.403  -2.399
   99    H    GLY 104           H        GLY 104  31.210 -11.664  -3.289
  100    HA2  GLY 104           HA2      GLY 104  30.983 -11.052  -5.943
  101    HA3  GLY 104           HA3      GLY 104  30.173 -12.621  -5.862
  102    H    GLU 105           H        GLU 105  28.464 -10.876  -6.651
  103    HA   GLU 105           HA       GLU 105  27.167  -9.103  -4.926
  104    HB2  GLU 105           HB2      GLU 105  25.146  -9.437  -6.238
  105    HB3  GLU 105           HB3      GLU 105  26.586  -9.180  -7.211
  106    HG2  GLU 105           HG2      GLU 105  26.689 -11.679  -7.622
  107    HG3  GLU 105           HG3      GLU 105  25.145 -11.827  -6.783
  108    H    THR 106           H        THR 106  26.366  -9.274  -3.008
  109    HA   THR 106           HA       THR 106  25.779 -11.940  -1.943
  110    HB   THR 106           HB       THR 106  27.746 -10.790  -1.091
  111    HG1  THR 106           HG1      THR 106  27.313 -11.431   1.008
  112   HG21  THR 106          HG21      THR 106  27.604  -9.034   0.552
  113   HG22  THR 106          HG22      THR 106  26.799  -8.441  -0.903
  114   HG23  THR 106          HG23      THR 106  25.839  -9.005   0.477
  115    H    LYS 107           H        LYS 107  24.484  -8.621  -2.019
  116    HA   LYS 107           HA       LYS 107  21.856  -9.497  -0.937
  117    HB2  LYS 107           HB2      LYS 107  23.762  -7.544   0.409
  118    HB3  LYS 107           HB3      LYS 107  22.025  -7.477   0.690
  119    HG2  LYS 107           HG2      LYS 107  22.039  -9.815   1.507
  120    HG3  LYS 107           HG3      LYS 107  23.805  -9.860   1.329
  121    HD2  LYS 107           HD2      LYS 107  24.021  -7.960   2.908
  122    HD3  LYS 107           HD3      LYS 107  22.256  -7.939   3.116
  123    HE2  LYS 107           HE2      LYS 107  22.331 -10.292   3.933
  124    HE3  LYS 107           HE3      LYS 107  24.085 -10.308   3.729
  125    HZ1  LYS 107           HZ1      LYS 107  24.228  -8.529   5.408
  126    HZ2  LYS 107           HZ2      LYS 107  22.601  -8.514   5.592
  127    HZ3  LYS 107           HZ3      LYS 107  23.464  -9.823   6.038
  128    H    THR 108           H        THR 108  20.274  -7.778  -0.937
  129    HA   THR 108           HA       THR 108  20.646  -5.678  -3.024
  130    HB   THR 108           HB       THR 108  18.384  -6.212  -3.866
  131    HG1  THR 108           HG1      THR 108  17.445  -8.197  -3.202
  132   HG21  THR 108          HG21      THR 108  18.915  -8.217  -5.103
  133   HG22  THR 108          HG22      THR 108  20.400  -7.268  -4.925
  134   HG23  THR 108          HG23      THR 108  20.142  -8.702  -3.910
  135    H    TRP 109           H        TRP 109  18.895  -4.048  -3.040
  136    HA   TRP 109           HA       TRP 109  17.516  -3.544  -0.470
  137    HB2  TRP 109           HB2      TRP 109  19.737  -2.753   0.018
  138    HB3  TRP 109           HB3      TRP 109  19.859  -1.908  -1.502
  139    HD1  TRP 109           HD1      TRP 109  17.297  -1.634   1.423
  140    HE1  TRP 109           HE1      TRP 109  17.100   0.843   2.102
  141    HE3  TRP 109           HE3      TRP 109  20.737   0.385  -1.806
  142    HZ2  TRP 109           HZ2      TRP 109  18.379   3.327   1.453
  143    HZ3  TRP 109           HZ3      TRP 109  21.262   2.800  -1.709
  144    HH2  TRP 109           HH2      TRP 109  20.097   4.284  -0.092
  145    H    THR 110           H        THR 110  16.030  -1.736  -0.583
  146    HA   THR 110           HA       THR 110  14.790  -1.473  -3.265
  147    HB   THR 110           HB       THR 110  12.840  -0.679  -1.905
  148    HG1  THR 110           HG1      THR 110  13.144  -0.957   0.404
  149   HG21  THR 110          HG21      THR 110  14.016  -3.260  -0.763
  150   HG22  THR 110          HG22      THR 110  12.313  -2.763  -0.763
  151   HG23  THR 110          HG23      THR 110  13.122  -3.142  -2.292
  152    H    GLY 111           H        GLY 111  16.632   0.486  -1.088
  153    HA2  GLY 111           HA2      GLY 111  17.305   2.749  -1.503
  154    HA3  GLY 111           HA3      GLY 111  15.850   3.021  -2.460
  155    H    GLN 112           H        GLN 112  14.639   1.354   0.119
  156    HA   GLN 112           HA       GLN 112  13.601   3.766   1.420
  157    HB2  GLN 112           HB2      GLN 112  13.199   0.796   1.976
  158    HB3  GLN 112           HB3      GLN 112  12.321   2.104   2.772
  159    HG2  GLN 112           HG2      GLN 112  11.341   2.829   0.647
  160    HG3  GLN 112           HG3      GLN 112  12.243   1.600  -0.237
  161   HE21  GLN 112          HE22      GLN 112   9.233   2.213   1.220
  162   HE22  GLN 112          HE21      GLN 112   8.713   0.538   1.329
  163    H    GLY 113           H        GLY 113  13.849   4.339   3.603
  164    HA2  GLY 113           HA2      GLY 113  14.908   4.596   5.651
  165    HA3  GLY 113           HA3      GLY 113  15.556   2.969   5.484
  166    H    ARG 114           H        ARG 114  17.342   4.191   6.636
  167    HA   ARG 114           HA       ARG 114  19.074   5.995   5.224
  168    HB2  ARG 114           HB2      ARG 114  20.693   5.580   6.950
  169    HB3  ARG 114           HB3      ARG 114  19.095   5.761   7.666
  170    HG2  ARG 114           HG2      ARG 114  18.937   3.265   7.895
  171    HG3  ARG 114           HG3      ARG 114  20.568   3.119   7.215
  172    HD2  ARG 114           HD2      ARG 114  21.483   4.480   9.055
  173    HD3  ARG 114           HD3      ARG 114  19.878   4.653   9.760
  174    HE   ARG 114           HE       ARG 114  21.619   2.266   9.759
  175   HH11  ARG 114          HH11      ARG 114  18.400   3.424  10.555
  176   HH12  ARG 114          HH12      ARG 114  18.073   2.058  11.585
  177   HH21  ARG 114          HH21      ARG 114  21.132   0.569  11.091
  178   HH22  ARG 114          HH22      ARG 114  19.583   0.482  11.874
  179    H    THR 115           H        THR 115  21.060   5.706   4.230
  180    HA   THR 115           HA       THR 115  21.399   3.665   2.350
  181    HB   THR 115           HB       THR 115  23.536   5.420   3.606
  182    HG1  THR 115           HG1      THR 115  22.974   6.841   1.959
  183   HG21  THR 115          HG21      THR 115  23.406   4.019   0.900
  184   HG22  THR 115          HG22      THR 115  24.620   5.237   1.366
  185   HG23  THR 115          HG23      THR 115  24.560   3.698   2.221
  186    HA   PRO 116           HA       PRO 116  22.881   0.248   4.949
  187    HB2  PRO 116           HB2      PRO 116  24.020  -0.739   2.344
  188    HB3  PRO 116           HB3      PRO 116  23.065  -1.625   3.559
  189    HG2  PRO 116           HG2      PRO 116  21.912  -0.752   1.257
  190    HG3  PRO 116           HG3      PRO 116  21.034  -0.630   2.817
  191    HD2  PRO 116           HD2      PRO 116  22.509   1.539   1.325
  192    HD3  PRO 116           HD3      PRO 116  20.941   1.598   2.187
  193    H    ALA 117           H        ALA 117  24.845  -0.411   5.904
  194    HA   ALA 117           HA       ALA 117  26.772   1.558   6.117
  195    HB1  ALA 117           HB1      ALA 117  27.030  -1.402   6.814
  196    HB2  ALA 117           HB2      ALA 117  28.026  -0.087   7.469
  197    HB3  ALA 117           HB3      ALA 117  26.293  -0.141   7.823
  198    H    VAL 118           H        VAL 118  27.236  -1.486   4.202
  199    HA   VAL 118           HA       VAL 118  29.857  -0.774   3.341
  200    HB   VAL 118           HB       VAL 118  28.965  -3.047   3.294
  201   HG11  VAL 118          HG11      VAL 118  27.599  -3.888   1.506
  202   HG12  VAL 118          HG12      VAL 118  26.700  -2.612   2.327
  203   HG13  VAL 118          HG13      VAL 118  27.463  -2.292   0.752
  204   HG21  VAL 118          HG21      VAL 118  29.974  -2.161   0.561
  205   HG22  VAL 118          HG22      VAL 118  30.984  -2.459   1.999
  206   HG23  VAL 118          HG23      VAL 118  30.072  -3.785   1.268
  207    H    ILE 119           H        ILE 119  26.720   0.090   1.957
  208    HA   ILE 119           HA       ILE 119  27.748   1.265  -0.498
  209    HB   ILE 119           HB       ILE 119  25.166   1.875   0.995
  210   HG12  ILE 119          HG12      ILE 119  25.260  -0.527   0.478
  211   HG13  ILE 119          HG13      ILE 119  24.003   0.321  -0.395
  212   HG21  ILE 119          HG21      ILE 119  26.008   2.432  -1.877
  213   HG22  ILE 119          HG22      ILE 119  24.346   2.589  -1.263
  214   HG23  ILE 119          HG23      ILE 119  25.629   3.618  -0.614
  215   HD11  ILE 119          HD11      ILE 119  25.329   0.254  -2.453
  216   HD12  ILE 119          HD12      ILE 119  26.677  -0.533  -1.583
  217   HD13  ILE 119          HD13      ILE 119  25.115  -1.361  -1.772
  218    H    LYS 120           H        LYS 120  26.907   2.573   2.739
  219    HA   LYS 120           HA       LYS 120  27.724   5.293   2.286
  220    HB2  LYS 120           HB2      LYS 120  26.375   4.775   4.176
  221    HB3  LYS 120           HB3      LYS 120  27.486   3.535   4.761
  222    HG2  LYS 120           HG2      LYS 120  29.161   5.165   5.352
  223    HG3  LYS 120           HG3      LYS 120  28.231   6.480   4.596
  224    HD2  LYS 120           HD2      LYS 120  26.410   6.145   6.261
  225    HD3  LYS 120           HD3      LYS 120  27.353   4.830   7.011
  226    HE2  LYS 120           HE2      LYS 120  29.201   6.434   7.482
  227    HE3  LYS 120           HE3      LYS 120  28.266   7.737   6.735
  228    HZ1  LYS 120           HZ1      LYS 120  28.035   7.751   9.159
  229    HZ2  LYS 120           HZ2      LYS 120  26.578   7.438   8.490
  230    HZ3  LYS 120           HZ3      LYS 120  27.447   6.233   9.178
  231    H    LYS 121           H        LYS 121  29.623   2.493   3.489
  232    HA   LYS 121           HA       LYS 121  32.086   3.939   3.750
  233    HB2  LYS 121           HB2      LYS 121  31.265   1.066   3.748
  234    HB3  LYS 121           HB3      LYS 121  32.930   1.383   3.262
  235    HG2  LYS 121           HG2      LYS 121  32.964   0.988   5.590
  236    HG3  LYS 121           HG3      LYS 121  33.294   2.699   5.335
  237    HD2  LYS 121           HD2      LYS 121  30.867   3.181   5.890
  238    HD3  LYS 121           HD3      LYS 121  30.659   1.471   6.285
  239    HE2  LYS 121           HE2      LYS 121  32.635   3.393   7.615
  240    HE3  LYS 121           HE3      LYS 121  31.045   2.975   8.256
  241    HZ1  LYS 121           HZ1      LYS 121  33.293   1.050   7.878
  242    HZ2  LYS 121           HZ2      LYS 121  32.753   1.627   9.296
  243    HZ3  LYS 121           HZ3      LYS 121  31.802   0.637   8.417
  244    H    ALA 122           H        ALA 122  30.742   2.199   0.917
  245    HA   ALA 122           HA       ALA 122  32.979   2.694  -0.783
  246    HB1  ALA 122           HB1      ALA 122  30.032   2.364  -1.510
  247    HB2  ALA 122           HB2      ALA 122  31.423   2.192  -2.601
  248    HB3  ALA 122           HB3      ALA 122  31.202   1.048  -1.268
  249    H    MET 123           H        MET 123  30.093   4.746  -0.098
  250    HA   MET 123           HA       MET 123  30.793   6.866  -1.885
  251    HB2  MET 123           HB2      MET 123  29.216   6.890   0.715
  252    HB3  MET 123           HB3      MET 123  29.357   8.269  -0.369
  253    HG2  MET 123           HG2      MET 123  28.180   7.180  -2.111
  254    HG3  MET 123           HG3      MET 123  28.304   5.598  -1.346
  255    HE1  MET 123           HE1      MET 123  25.569   7.142  -2.531
  256    HE2  MET 123           HE2      MET 123  25.750   5.429  -2.074
  257    HE3  MET 123           HE3      MET 123  24.447   6.413  -1.362
  258    H    GLU 124           H        GLU 124  31.600   6.390   1.598
  259    HA   GLU 124           HA       GLU 124  33.069   8.835   1.817
  260    HB2  GLU 124           HB2      GLU 124  32.946   6.351   3.560
  261    HB3  GLU 124           HB3      GLU 124  33.857   7.803   3.986
  262    HG2  GLU 124           HG2      GLU 124  31.767   9.156   3.780
  263    HG3  GLU 124           HG3      GLU 124  30.845   7.670   3.560
  264    H    GLU 125           H        GLU 125  34.215   5.495   1.229
  265    HA   GLU 125           HA       GLU 125  37.040   6.449   1.330
  266    HB2  GLU 125           HB2      GLU 125  35.935   3.632   1.523
  267    HB3  GLU 125           HB3      GLU 125  37.612   4.130   1.729
  268    HG2  GLU 125           HG2      GLU 125  36.847   5.615   3.649
  269    HG3  GLU 125           HG3      GLU 125  35.275   4.816   3.555
  270    H    GLN 126           H        GLN 126  34.782   5.325  -1.050
  271    HA   GLN 126           HA       GLN 126  37.028   5.057  -3.025
  272    HB2  GLN 126           HB2      GLN 126  34.371   3.576  -3.073
  273    HB3  GLN 126           HB3      GLN 126  35.680   3.439  -4.245
  274    HG2  GLN 126           HG2      GLN 126  37.175   2.559  -2.455
  275    HG3  GLN 126           HG3      GLN 126  35.822   2.593  -1.319
  276   HE21  GLN 126          HE22      GLN 126  37.302   0.196  -2.077
  277   HE22  GLN 126          HE21      GLN 126  36.135  -0.852  -2.871
  278    H    GLY 127           H        GLY 127  34.612   7.137  -2.144
  279    HA2  GLY 127           HA2      GLY 127  33.658   8.948  -3.165
  280    HA3  GLY 127           HA3      GLY 127  34.725   8.680  -4.545
  281    H    LYS 128           H        LYS 128  32.615   6.025  -3.738
  282    HA   LYS 128           HA       LYS 128  31.254   6.190  -6.315
  283    HB2  LYS 128           HB2      LYS 128  31.000   4.293  -3.936
  284    HB3  LYS 128           HB3      LYS 128  30.010   4.161  -5.388
  285    HG2  LYS 128           HG2      LYS 128  32.178   4.187  -6.740
  286    HG3  LYS 128           HG3      LYS 128  33.042   3.920  -5.223
  287    HD2  LYS 128           HD2      LYS 128  31.873   1.813  -4.852
  288    HD3  LYS 128           HD3      LYS 128  30.782   2.108  -6.195
  289    HE2  LYS 128           HE2      LYS 128  33.754   1.478  -6.347
  290    HE3  LYS 128           HE3      LYS 128  32.397   0.450  -6.819
  291    HZ1  LYS 128           HZ1      LYS 128  31.850   2.289  -8.509
  292    HZ2  LYS 128           HZ2      LYS 128  33.345   2.883  -8.218
  293    HZ3  LYS 128           HZ3      LYS 128  33.187   1.385  -8.823
  294    H    GLN 129           H        GLN 129  28.866   5.815  -6.453
  295    HA   GLN 129           HA       GLN 129  27.264   7.502  -4.567
  296    HB2  GLN 129           HB2      GLN 129  27.372   7.710  -7.610
  297    HB3  GLN 129           HB3      GLN 129  26.131   8.479  -6.623
  298    HG2  GLN 129           HG2      GLN 129  29.109   9.107  -6.393
  299    HG3  GLN 129           HG3      GLN 129  27.949  10.014  -7.346
  300   HE21  GLN 129          HE22      GLN 129  28.962   9.281  -4.003
  301   HE22  GLN 129          HE21      GLN 129  28.017  10.598  -3.302
  302    H    LEU 130           H        LEU 130  24.805   7.241  -5.310
  303    HA   LEU 130           HA       LEU 130  24.067   4.569  -4.722
  304    HB2  LEU 130           HB2      LEU 130  22.593   6.929  -5.963
  305    HB3  LEU 130           HB3      LEU 130  21.761   5.432  -5.639
  306    HG   LEU 130           HG       LEU 130  23.185   7.054  -3.504
  307   HD11  LEU 130          HD11      LEU 130  20.223   6.868  -4.183
  308   HD12  LEU 130          HD12      LEU 130  20.926   7.742  -2.802
  309   HD13  LEU 130          HD13      LEU 130  21.270   8.283  -4.451
  310   HD21  LEU 130          HD21      LEU 130  22.940   4.670  -2.865
  311   HD22  LEU 130          HD22      LEU 130  21.866   5.699  -1.909
  312   HD23  LEU 130          HD23      LEU 130  21.206   4.751  -3.255
  313    H    GLU 131           H        GLU 131  24.388   6.135  -7.878
  314    HA   GLU 131           HA       GLU 131  23.155   4.069  -9.432
  315    HB2  GLU 131           HB2      GLU 131  25.232   6.169 -10.205
  316    HB3  GLU 131           HB3      GLU 131  24.331   5.165 -11.353
  317    HG2  GLU 131           HG2      GLU 131  22.203   6.141 -10.611
  318    HG3  GLU 131           HG3      GLU 131  23.026   7.102  -9.389
  319    H    ASP 132           H        ASP 132  26.366   4.113  -7.999
  320    HA   ASP 132           HA       ASP 132  27.639   2.204  -9.728
  321    HB2  ASP 132           HB2      ASP 132  28.026   2.875  -6.787
  322    HB3  ASP 132           HB3      ASP 132  28.948   1.641  -7.614
  323    H    PHE 133           H        PHE 133  25.140   1.893  -7.321
  324    HA   PHE 133           HA       PHE 133  25.298  -1.100  -7.367
  325    HB2  PHE 133           HB2      PHE 133  24.326   0.729  -5.150
  326    HB3  PHE 133           HB3      PHE 133  24.453  -1.020  -5.080
  327    HD1  PHE 133           HD1      PHE 133  26.746  -2.116  -5.159
  328    HD2  PHE 133           HD2      PHE 133  26.241   2.147  -4.734
  329    HE1  PHE 133           HE1      PHE 133  29.060  -1.923  -4.274
  330    HE2  PHE 133           HE2      PHE 133  28.557   2.334  -3.857
  331    HZ   PHE 133           HZ       PHE 133  29.963   0.284  -3.622
  332    H    LEU 134           H        LEU 134  23.314   1.578  -8.147
  333    HA   LEU 134           HA       LEU 134  20.700   0.374  -7.889
  334    HB2  LEU 134           HB2      LEU 134  21.565   2.869  -8.007
  335    HB3  LEU 134           HB3      LEU 134  21.494   2.646  -9.743
  336    HG   LEU 134           HG       LEU 134  19.205   2.490  -7.757
  337   HD11  LEU 134          HD11      LEU 134  19.874   4.586  -9.862
  338   HD12  LEU 134          HD12      LEU 134  18.485   4.607  -8.758
  339   HD13  LEU 134          HD13      LEU 134  20.122   4.761  -8.111
  340   HD21  LEU 134          HD21      LEU 134  17.766   2.648  -9.860
  341   HD22  LEU 134          HD22      LEU 134  19.224   2.203 -10.784
  342   HD23  LEU 134          HD23      LEU 134  18.531   1.102  -9.557
  343    H    ILE 135           H        ILE 135  19.650  -0.899  -9.241
  344    HA   ILE 135           HA       ILE 135  20.791  -1.551 -11.947
  345    HB   ILE 135           HB       ILE 135  20.313  -3.873 -11.556
  346   HG12  ILE 135          HG12      ILE 135  18.891  -2.877  -9.090
  347   HG13  ILE 135          HG13      ILE 135  18.337  -3.985 -10.330
  348   HG21  ILE 135          HG21      ILE 135  22.462  -2.855 -10.773
  349   HG22  ILE 135          HG22      ILE 135  21.790  -2.828  -9.127
  350   HG23  ILE 135          HG23      ILE 135  22.022  -4.366  -9.976
  351   HD11  ILE 135          HD11      ILE 135  18.677  -5.178  -8.268
  352   HD12  ILE 135          HD12      ILE 135  19.937  -5.698  -9.407
  353   HD13  ILE 135          HD13      ILE 135  20.318  -4.528  -8.109
  354    H    LYS 136           H        LYS 136  17.861  -0.450 -10.567
  355    HA   LYS 136           HA       LYS 136  16.295  -1.558 -12.876
  356    HB2  LYS 136           HB2      LYS 136  16.125  -2.521 -10.363
  357    HB3  LYS 136           HB3      LYS 136  15.029  -1.167 -10.171
  358    HG2  LYS 136           HG2      LYS 136  13.694  -3.025 -10.717
  359    HG3  LYS 136           HG3      LYS 136  13.741  -2.079 -12.203
  360    HD2  LYS 136           HD2      LYS 136  15.574  -3.613 -13.046
  361    HD3  LYS 136           HD3      LYS 136  15.395  -4.583 -11.589
  362    HE2  LYS 136           HE2      LYS 136  13.183  -4.032 -13.626
  363    HE3  LYS 136           HE3      LYS 136  14.222  -5.460 -13.645
  364    HZ1  LYS 136           HZ1      LYS 136  12.328  -4.763 -11.447
  365    HZ2  LYS 136           HZ2      LYS 136  12.140  -5.956 -12.541
  366    HZ3  LYS 136           HZ3      LYS 136  13.333  -6.063 -11.440
  367    H    GLU 137           H        GLU 137  17.419   1.257 -12.370
  368    HA   GLU 137           HA       GLU 137  14.970   2.590 -13.427
  369    HB2  GLU 137           HB2      GLU 137  15.414   2.902 -10.819
  370    HB3  GLU 137           HB3      GLU 137  16.590   4.091 -11.374
  371    HG2  GLU 137           HG2      GLU 137  14.667   5.179 -12.698
  372    HG3  GLU 137           HG3      GLU 137  13.591   4.017 -11.942
  373    H    LEU 138           H        LEU 138  17.754   1.725 -14.461
  374    HA   LEU 138           HA       LEU 138  18.650   4.343 -15.598
  375    HB2  LEU 138           HB2      LEU 138  20.404   2.135 -14.452
  376    HB3  LEU 138           HB3      LEU 138  20.990   3.608 -15.225
  377    HG   LEU 138           HG       LEU 138  19.389   3.555 -12.638
  378   HD11  LEU 138          HD11      LEU 138  22.364   3.948 -13.104
  379   HD12  LEU 138          HD12      LEU 138  21.517   4.089 -11.553
  380   HD13  LEU 138          HD13      LEU 138  21.601   2.522 -12.367
  381   HD21  LEU 138          HD21      LEU 138  20.121   5.878 -12.370
  382   HD22  LEU 138          HD22      LEU 138  20.919   5.833 -13.962
  383   HD23  LEU 138          HD23      LEU 138  19.151   5.707 -13.832
  384    H    GLU 139           H        GLU 139  17.007   2.189 -16.716
  385    HA   GLU 139           HA       GLU 139  18.407   0.726 -18.778
  386    HB2  GLU 139           HB2      GLU 139  15.511   1.596 -18.482
  387    HB3  GLU 139           HB3      GLU 139  16.096   0.607 -19.815
  388    HG2  GLU 139           HG2      GLU 139  16.326  -0.205 -16.879
  389    HG3  GLU 139           HG3      GLU 139  15.012  -0.669 -17.941
  Start of MODEL   19
    1    H1   ALA  91           H1       ALA  91   7.805 -14.162  -4.776
    2    H2   ALA  91           H2       ALA  91   8.084 -14.148  -6.388
    3    H3   ALA  91           H3       ALA  91   8.971 -13.197  -5.395
    4    HA   ALA  91           HA       ALA  91   7.358 -11.864  -6.572
    5    HB1  ALA  91           HB1      ALA  91   5.699 -13.668  -6.948
    6    HB2  ALA  91           HB2      ALA  91   5.287 -13.663  -5.217
    7    HB3  ALA  91           HB3      ALA  91   4.944 -12.241  -6.225
    8    H    ALA  92           H        ALA  92   6.035 -10.127  -5.542
    9    HA   ALA  92           HA       ALA  92   5.818  -8.459  -4.068
   10    HB1  ALA  92           HB1      ALA  92   4.612  -9.079  -2.061
   11    HB2  ALA  92           HB2      ALA  92   4.118 -10.122  -3.406
   12    HB3  ALA  92           HB3      ALA  92   5.219 -10.745  -2.157
   13    H    ARG  93           H        ARG  93   8.615  -9.281  -4.248
   14    HA   ARG  93           HA       ARG  93   9.658  -7.921  -1.800
   15    HB2  ARG  93           HB2      ARG  93  10.743 -10.541  -2.905
   16    HB3  ARG  93           HB3      ARG  93  11.567  -9.513  -1.721
   17    HG2  ARG  93           HG2      ARG  93   9.650  -9.800  -0.141
   18    HG3  ARG  93           HG3      ARG  93   8.872 -10.869  -1.310
   19    HD2  ARG  93           HD2      ARG  93   9.924 -12.252   0.298
   20    HD3  ARG  93           HD3      ARG  93  10.842 -12.391  -1.213
   21    HE   ARG  93           HE       ARG  93  11.982 -10.349   0.472
   22   HH11  ARG  93          HH11      ARG  93  11.806 -13.843   0.316
   23   HH12  ARG  93          HH12      ARG  93  13.295 -14.053   1.193
   24   HH21  ARG  93          HH21      ARG  93  13.889 -10.678   1.571
   25   HH22  ARG  93          HH22      ARG  93  14.444 -12.294   1.889
   26    HA   PRO  94           HA       PRO  94  11.245  -6.300  -5.907
   27    HB2  PRO  94           HB2      PRO  94  10.456  -3.691  -5.701
   28    HB3  PRO  94           HB3      PRO  94   9.364  -5.001  -6.249
   29    HG2  PRO  94           HG2      PRO  94   9.608  -3.831  -3.457
   30    HG3  PRO  94           HG3      PRO  94   8.122  -4.087  -4.421
   31    HD2  PRO  94           HD2      PRO  94   8.942  -5.886  -2.554
   32    HD3  PRO  94           HD3      PRO  94   8.191  -6.416  -4.091
   33    H    ALA  95           H        ALA  95  12.903  -4.707  -6.340
   34    HA   ALA  95           HA       ALA  95  14.316  -3.405  -4.109
   35    HB1  ALA  95           HB1      ALA  95  16.457  -4.522  -4.662
   36    HB2  ALA  95           HB2      ALA  95  15.246  -5.694  -4.117
   37    HB3  ALA  95           HB3      ALA  95  15.620  -5.553  -5.847
   38    H    LYS  96           H        LYS  96  16.268  -2.203  -4.969
   39    HA   LYS  96           HA       LYS  96  16.062  -1.287  -7.774
   40    HB2  LYS  96           HB2      LYS  96  14.586   0.117  -6.352
   41    HB3  LYS  96           HB3      LYS  96  15.965   0.555  -5.343
   42    HG2  LYS  96           HG2      LYS  96  17.034   1.696  -7.235
   43    HG3  LYS  96           HG3      LYS  96  15.764   1.154  -8.332
   44    HD2  LYS  96           HD2      LYS  96  15.240   2.912  -5.889
   45    HD3  LYS  96           HD3      LYS  96  15.617   3.562  -7.494
   46    HE2  LYS  96           HE2      LYS  96  13.644   2.454  -8.459
   47    HE3  LYS  96           HE3      LYS  96  13.253   1.726  -6.890
   48    HZ1  LYS  96           HZ1      LYS  96  13.292   4.659  -7.433
   49    HZ2  LYS  96           HZ2      LYS  96  11.950   3.747  -7.279
   50    HZ3  LYS  96           HZ3      LYS  96  12.921   3.978  -5.991
   51    H    TYR  97           H        TYR  97  18.048  -1.873  -4.992
   52    HA   TYR  97           HA       TYR  97  20.461  -1.271  -6.626
   53    HB2  TYR  97           HB2      TYR  97  20.313  -0.715  -3.653
   54    HB3  TYR  97           HB3      TYR  97  21.522  -0.163  -4.800
   55    HD1  TYR  97           HD1      TYR  97  21.016   1.768  -6.309
   56    HD2  TYR  97           HD2      TYR  97  18.218   0.444  -3.313
   57    HE1  TYR  97           HE1      TYR  97  19.682   3.842  -6.641
   58    HE2  TYR  97           HE2      TYR  97  16.928   2.561  -3.603
   59    HH   TYR  97           HH       TYR  97  17.867   5.105  -5.925
   60    H    SER  98           H        SER  98  22.380  -2.539  -5.932
   61    HA   SER  98           HA       SER  98  22.007  -4.618  -3.894
   62    HB2  SER  98           HB2      SER  98  22.320  -6.504  -5.258
   63    HB3  SER  98           HB3      SER  98  21.130  -5.528  -6.143
   64    HG   SER  98           HG       SER  98  22.862  -6.368  -7.480
   65    H    TYR  99           H        TYR  99  23.980  -5.712  -3.270
   66    HA   TYR  99           HA       TYR  99  26.497  -4.585  -4.330
   67    HB2  TYR  99           HB2      TYR  99  27.264  -3.676  -2.290
   68    HB3  TYR  99           HB3      TYR  99  25.675  -3.015  -2.559
   69    HD1  TYR  99           HD2      TYR  99  23.737  -3.766  -1.183
   70    HD2  TYR  99           HD1      TYR  99  27.744  -5.147  -0.396
   71    HE1  TYR  99           HE2      TYR  99  23.089  -4.308   1.159
   72    HE2  TYR  99           HE1      TYR  99  27.085  -5.731   1.934
   73    HH   TYR  99           HH       TYR  99  23.850  -5.002   3.253
   74    H    VAL 100           H        VAL 100  28.406  -5.375  -3.102
   75    HA   VAL 100           HA       VAL 100  28.283  -8.294  -2.541
   76    HB   VAL 100           HB       VAL 100  30.326  -6.981  -4.379
   77   HG11  VAL 100          HG11      VAL 100  31.114  -9.009  -3.267
   78   HG12  VAL 100          HG12      VAL 100  29.630  -9.875  -3.743
   79   HG13  VAL 100          HG13      VAL 100  30.812  -9.346  -4.972
   80   HG21  VAL 100          HG21      VAL 100  27.811  -8.496  -5.147
   81   HG22  VAL 100          HG22      VAL 100  28.251  -6.838  -5.594
   82   HG23  VAL 100          HG23      VAL 100  29.178  -8.188  -6.246
   83    H    ASP 101           H        ASP 101  29.375  -8.731  -0.690
   84    HA   ASP 101           HA       ASP 101  31.260  -6.813   0.512
   85    HB2  ASP 101           HB2      ASP 101  29.667  -8.074   1.883
   86    HB3  ASP 101           HB3      ASP 101  30.378  -9.597   1.346
   87    H    GLU 102           H        GLU 102  31.532 -10.236  -0.690
   88    HA   GLU 102           HA       GLU 102  34.230  -9.734  -1.734
   89    HB2  GLU 102           HB2      GLU 102  34.679 -10.060   0.651
   90    HB3  GLU 102           HB3      GLU 102  33.718 -11.547   0.672
   91    HG2  GLU 102           HG2      GLU 102  35.278 -12.656  -0.784
   92    HG3  GLU 102           HG3      GLU 102  36.179 -11.152  -1.049
   93    H    ASN 103           H        ASN 103  31.844 -12.308  -0.870
   94    HA   ASN 103           HA       ASN 103  32.994 -14.339  -2.389
   95    HB2  ASN 103           HB2      ASN 103  30.967 -15.577  -1.910
   96    HB3  ASN 103           HB3      ASN 103  31.405 -14.615  -0.506
   97   HD21  ASN 103          HD22      ASN 103  28.838 -15.403  -2.642
   98   HD22  ASN 103          HD21      ASN 103  27.800 -14.030  -2.233
   99    H    GLY 104           H        GLY 104  30.867 -11.866  -3.680
  100    HA2  GLY 104           HA2      GLY 104  31.306 -11.795  -6.224
  101    HA3  GLY 104           HA3      GLY 104  30.526 -13.377  -6.257
  102    H    GLU 105           H        GLU 105  28.449 -12.888  -4.381
  103    HA   GLU 105           HA       GLU 105  26.971 -10.481  -5.129
  104    HB2  GLU 105           HB2      GLU 105  25.789 -13.272  -5.439
  105    HB3  GLU 105           HB3      GLU 105  24.864 -11.766  -5.413
  106    HG2  GLU 105           HG2      GLU 105  26.076 -10.988  -7.442
  107    HG3  GLU 105           HG3      GLU 105  26.931 -12.539  -7.514
  108    H    THR 106           H        THR 106  25.940  -9.646  -3.278
  109    HA   THR 106           HA       THR 106  25.916 -11.429  -0.902
  110    HB   THR 106           HB       THR 106  26.577  -8.497  -1.025
  111    HG1  THR 106           HG1      THR 106  28.026 -10.864  -0.414
  112   HG21  THR 106          HG21      THR 106  25.381  -8.799   1.011
  113   HG22  THR 106          HG22      THR 106  26.297 -10.290   1.393
  114   HG23  THR 106          HG23      THR 106  27.113  -8.704   1.360
  115    H    LYS 107           H        LYS 107  24.300  -8.269  -1.683
  116    HA   LYS 107           HA       LYS 107  21.698  -9.559  -1.565
  117    HB2  LYS 107           HB2      LYS 107  20.785  -8.709   0.464
  118    HB3  LYS 107           HB3      LYS 107  22.264  -9.546   0.864
  119    HG2  LYS 107           HG2      LYS 107  23.451  -7.329   1.013
  120    HG3  LYS 107           HG3      LYS 107  21.917  -6.530   0.663
  121    HD2  LYS 107           HD2      LYS 107  22.138  -6.441   3.015
  122    HD3  LYS 107           HD3      LYS 107  20.925  -7.677   2.703
  123    HE2  LYS 107           HE2      LYS 107  22.674  -9.449   2.979
  124    HE3  LYS 107           HE3      LYS 107  23.884  -8.198   3.283
  125    HZ1  LYS 107           HZ1      LYS 107  22.607  -7.543   5.273
  126    HZ2  LYS 107           HZ2      LYS 107  21.483  -8.698   4.985
  127    HZ3  LYS 107           HZ3      LYS 107  23.011  -9.119   5.368
  128    H    THR 108           H        THR 108  19.874  -7.888  -1.261
  129    HA   THR 108           HA       THR 108  20.329  -5.623  -3.150
  130    HB   THR 108           HB       THR 108  17.923  -5.946  -3.716
  131    HG1  THR 108           HG1      THR 108  16.982  -7.938  -3.079
  132   HG21  THR 108          HG21      THR 108  19.622  -8.436  -4.166
  133   HG22  THR 108          HG22      THR 108  18.200  -7.933  -5.104
  134   HG23  THR 108          HG23      THR 108  19.667  -6.955  -5.148
  135    H    TRP 109           H        TRP 109  18.826  -3.823  -2.972
  136    HA   TRP 109           HA       TRP 109  17.542  -3.280  -0.364
  137    HB2  TRP 109           HB2      TRP 109  19.914  -2.597  -0.110
  138    HB3  TRP 109           HB3      TRP 109  19.784  -1.577  -1.529
  139    HD1  TRP 109           HD1      TRP 109  17.663  -1.865   1.724
  140    HE1  TRP 109           HE1      TRP 109  17.384   0.470   2.763
  141    HE3  TRP 109           HE3      TRP 109  20.450   0.877  -1.616
  142    HZ2  TRP 109           HZ2      TRP 109  18.315   3.128   2.287
  143    HZ3  TRP 109           HZ3      TRP 109  20.768   3.312  -1.241
  144    HH2  TRP 109           HH2      TRP 109  19.724   4.442   0.698
  145    H    THR 110           H        THR 110  16.139  -1.395  -0.453
  146    HA   THR 110           HA       THR 110  15.190  -0.785  -3.240
  147    HB   THR 110           HB       THR 110  13.915  -2.444  -1.799
  148    HG1  THR 110           HG1      THR 110  11.945  -1.620  -2.616
  149   HG21  THR 110          HG21      THR 110  13.861  -1.116   0.314
  150   HG22  THR 110          HG22      THR 110  12.812   0.077  -0.490
  151   HG23  THR 110          HG23      THR 110  12.256  -1.590  -0.259
  152    H    GLY 111           H        GLY 111  16.711   0.827  -0.828
  153    HA2  GLY 111           HA2      GLY 111  17.113   3.124  -0.757
  154    HA3  GLY 111           HA3      GLY 111  15.723   3.425  -1.792
  155    H    GLN 112           H        GLN 112  15.634   1.607   1.276
  156    HA   GLN 112           HA       GLN 112  14.170   3.804   2.665
  157    HB2  GLN 112           HB2      GLN 112  13.199   0.943   2.261
  158    HB3  GLN 112           HB3      GLN 112  12.494   2.055   3.429
  159    HG2  GLN 112           HG2      GLN 112  12.540   2.566   0.417
  160    HG3  GLN 112           HG3      GLN 112  11.213   1.830   1.294
  161   HE21  GLN 112          HE22      GLN 112  12.977   4.898   0.818
  162   HE22  GLN 112          HE21      GLN 112  11.707   5.894   1.538
  163    H    GLY 113           H        GLY 113  13.946   3.430   4.992
  164    HA2  GLY 113           HA2      GLY 113  14.843   2.920   7.081
  165    HA3  GLY 113           HA3      GLY 113  15.717   1.559   6.372
  166    H    ARG 114           H        ARG 114  17.875   1.787   6.003
  167    HA   ARG 114           HA       ARG 114  19.151   4.469   5.783
  168    HB2  ARG 114           HB2      ARG 114  20.019   2.291   7.738
  169    HB3  ARG 114           HB3      ARG 114  20.990   3.708   7.316
  170    HG2  ARG 114           HG2      ARG 114  19.200   5.197   8.200
  171    HG3  ARG 114           HG3      ARG 114  18.274   3.764   8.697
  172    HD2  ARG 114           HD2      ARG 114  20.135   3.044  10.144
  173    HD3  ARG 114           HD3      ARG 114  21.069   4.479   9.671
  174    HE   ARG 114           HE       ARG 114  18.570   5.383  10.650
  175   HH11  ARG 114          HH11      ARG 114  21.386   3.791  11.993
  176   HH12  ARG 114          HH12      ARG 114  21.119   4.450  13.584
  177   HH21  ARG 114          HH21      ARG 114  18.286   6.194  12.699
  178   HH22  ARG 114          HH22      ARG 114  19.406   5.788  13.968
  179    H    THR 115           H        THR 115  21.098   4.485   4.646
  180    HA   THR 115           HA       THR 115  21.427   2.739   2.495
  181    HB   THR 115           HB       THR 115  23.596   4.446   3.750
  182    HG1  THR 115           HG1      THR 115  22.757   6.067   2.429
  183   HG21  THR 115          HG21      THR 115  24.454   2.978   1.969
  184   HG22  THR 115          HG22      THR 115  23.140   3.498   0.886
  185   HG23  THR 115          HG23      THR 115  24.392   4.650   1.412
  186    HA   PRO 116           HA       PRO 116  23.342  -0.885   4.432
  187    HB2  PRO 116           HB2      PRO 116  24.340  -1.254   1.598
  188    HB3  PRO 116           HB3      PRO 116  23.661  -2.463   2.731
  189    HG2  PRO 116           HG2      PRO 116  22.105  -1.426   0.774
  190    HG3  PRO 116           HG3      PRO 116  21.444  -1.628   2.426
  191    HD2  PRO 116           HD2      PRO 116  22.473   0.895   1.123
  192    HD3  PRO 116           HD3      PRO 116  21.048   0.644   2.178
  193    H    ALA 117           H        ALA 117  25.373  -1.485   5.209
  194    HA   ALA 117           HA       ALA 117  27.197   0.542   5.629
  195    HB1  ALA 117           HB1      ALA 117  26.903  -1.427   7.069
  196    HB2  ALA 117           HB2      ALA 117  27.662  -2.467   5.840
  197    HB3  ALA 117           HB3      ALA 117  28.608  -1.201   6.653
  198    H    VAL 118           H        VAL 118  27.675  -2.118   3.227
  199    HA   VAL 118           HA       VAL 118  30.253  -1.199   2.397
  200    HB   VAL 118           HB       VAL 118  28.219  -2.852   0.858
  201   HG11  VAL 118          HG11      VAL 118  31.202  -2.472   0.348
  202   HG12  VAL 118          HG12      VAL 118  30.185  -3.696  -0.433
  203   HG13  VAL 118          HG13      VAL 118  29.875  -1.987  -0.733
  204   HG21  VAL 118          HG21      VAL 118  30.621  -3.690   2.544
  205   HG22  VAL 118          HG22      VAL 118  28.912  -3.937   2.973
  206   HG23  VAL 118          HG23      VAL 118  29.604  -4.786   1.590
  207    H    ILE 119           H        ILE 119  26.994  -0.429   1.148
  208    HA   ILE 119           HA       ILE 119  27.867   1.208  -1.067
  209    HB   ILE 119           HB       ILE 119  25.251   1.211   0.500
  210   HG12  ILE 119          HG12      ILE 119  26.138  -0.159  -2.071
  211   HG13  ILE 119          HG13      ILE 119  25.695  -0.943  -0.567
  212   HG21  ILE 119          HG21      ILE 119  25.604   3.372  -0.685
  213   HG22  ILE 119          HG22      ILE 119  25.875   2.484  -2.202
  214   HG23  ILE 119          HG23      ILE 119  24.292   2.450  -1.384
  215   HD11  ILE 119          HD11      ILE 119  23.821   0.496  -2.477
  216   HD12  ILE 119          HD12      ILE 119  23.874  -1.229  -2.085
  217   HD13  ILE 119          HD13      ILE 119  23.345  -0.060  -0.855
  218    H    LYS 120           H        LYS 120  27.038   1.981   2.333
  219    HA   LYS 120           HA       LYS 120  27.554   4.807   2.245
  220    HB2  LYS 120           HB2      LYS 120  26.347   3.919   4.080
  221    HB3  LYS 120           HB3      LYS 120  27.566   2.698   4.441
  222    HG2  LYS 120           HG2      LYS 120  29.133   4.342   5.241
  223    HG3  LYS 120           HG3      LYS 120  28.072   5.682   4.738
  224    HD2  LYS 120           HD2      LYS 120  26.356   4.926   6.365
  225    HD3  LYS 120           HD3      LYS 120  27.414   3.583   6.859
  226    HE2  LYS 120           HE2      LYS 120  29.158   5.218   7.551
  227    HE3  LYS 120           HE3      LYS 120  28.113   6.551   7.064
  228    HZ1  LYS 120           HZ1      LYS 120  27.473   4.597   9.225
  229    HZ2  LYS 120           HZ2      LYS 120  27.968   6.135   9.454
  230    HZ3  LYS 120           HZ3      LYS 120  26.511   5.846   8.775
  231    H    LYS 121           H        LYS 121  29.765   2.099   3.106
  232    HA   LYS 121           HA       LYS 121  32.045   3.789   3.479
  233    HB2  LYS 121           HB2      LYS 121  31.696   0.824   2.904
  234    HB3  LYS 121           HB3      LYS 121  33.304   1.528   3.006
  235    HG2  LYS 121           HG2      LYS 121  31.238   1.579   5.250
  236    HG3  LYS 121           HG3      LYS 121  32.634   0.502   5.122
  237    HD2  LYS 121           HD2      LYS 121  34.076   2.645   5.011
  238    HD3  LYS 121           HD3      LYS 121  32.620   3.516   5.544
  239    HE2  LYS 121           HE2      LYS 121  32.521   2.060   7.574
  240    HE3  LYS 121           HE3      LYS 121  33.990   1.238   7.026
  241    HZ1  LYS 121           HZ1      LYS 121  33.770   4.106   7.780
  242    HZ2  LYS 121           HZ2      LYS 121  34.639   2.959   8.550
  243    HZ3  LYS 121           HZ3      LYS 121  35.092   3.477   7.051
  244    H    ALA 122           H        ALA 122  30.878   2.199   0.519
  245    HA   ALA 122           HA       ALA 122  33.047   3.004  -1.129
  246    HB1  ALA 122           HB1      ALA 122  31.514   2.533  -2.974
  247    HB2  ALA 122           HB2      ALA 122  31.382   1.291  -1.720
  248    HB3  ALA 122           HB3      ALA 122  30.126   2.542  -1.858
  249    H    MET 123           H        MET 123  30.032   4.769  -0.253
  250    HA   MET 123           HA       MET 123  30.609   7.098  -1.831
  251    HB2  MET 123           HB2      MET 123  28.928   6.729   0.682
  252    HB3  MET 123           HB3      MET 123  28.995   8.221  -0.253
  253    HG2  MET 123           HG2      MET 123  28.003   7.208  -2.164
  254    HG3  MET 123           HG3      MET 123  28.196   5.575  -1.518
  255    HE1  MET 123           HE1      MET 123  24.308   6.058  -1.657
  256    HE2  MET 123           HE2      MET 123  25.447   6.881  -2.746
  257    HE3  MET 123           HE3      MET 123  25.718   5.182  -2.302
  258    H    GLU 124           H        GLU 124  31.252   6.372   1.647
  259    HA   GLU 124           HA       GLU 124  32.389   8.930   2.202
  260    HB2  GLU 124           HB2      GLU 124  32.505   6.276   3.682
  261    HB3  GLU 124           HB3      GLU 124  33.171   7.784   4.322
  262    HG2  GLU 124           HG2      GLU 124  30.936   8.857   4.111
  263    HG3  GLU 124           HG3      GLU 124  30.245   7.309   3.639
  264    H    GLU 125           H        GLU 125  34.009   5.798   1.541
  265    HA   GLU 125           HA       GLU 125  36.671   7.157   1.781
  266    HB2  GLU 125           HB2      GLU 125  35.833   4.272   2.202
  267    HB3  GLU 125           HB3      GLU 125  37.502   4.853   2.210
  268    HG2  GLU 125           HG2      GLU 125  36.891   6.474   4.045
  269    HG3  GLU 125           HG3      GLU 125  35.295   5.723   4.119
  270    H    GLN 126           H        GLN 126  34.703   5.647  -0.624
  271    HA   GLN 126           HA       GLN 126  37.058   5.588  -2.485
  272    HB2  GLN 126           HB2      GLN 126  34.561   3.872  -2.617
  273    HB3  GLN 126           HB3      GLN 126  35.921   3.834  -3.738
  274    HG2  GLN 126           HG2      GLN 126  37.424   3.144  -1.872
  275    HG3  GLN 126           HG3      GLN 126  36.041   3.102  -0.776
  276   HE21  GLN 126          HE22      GLN 126  37.974   1.045  -2.494
  277   HE22  GLN 126          HE21      GLN 126  36.792  -0.216  -2.817
  278    H    GLY 127           H        GLY 127  34.412   7.471  -1.808
  279    HA2  GLY 127           HA2      GLY 127  33.536   9.277  -2.894
  280    HA3  GLY 127           HA3      GLY 127  34.768   9.067  -4.133
  281    H    LYS 128           H        LYS 128  32.574   6.393  -3.636
  282    HA   LYS 128           HA       LYS 128  31.537   6.635  -6.367
  283    HB2  LYS 128           HB2      LYS 128  30.679   4.726  -4.137
  284    HB3  LYS 128           HB3      LYS 128  30.318   4.541  -5.841
  285    HG2  LYS 128           HG2      LYS 128  33.016   4.277  -4.485
  286    HG3  LYS 128           HG3      LYS 128  32.063   3.020  -5.268
  287    HD2  LYS 128           HD2      LYS 128  33.438   5.331  -6.712
  288    HD3  LYS 128           HD3      LYS 128  34.049   3.686  -6.561
  289    HE2  LYS 128           HE2      LYS 128  32.020   2.812  -7.719
  290    HE3  LYS 128           HE3      LYS 128  31.442   4.466  -7.956
  291    HZ1  LYS 128           HZ1      LYS 128  33.991   3.370  -9.053
  292    HZ2  LYS 128           HZ2      LYS 128  32.634   3.626  -9.917
  293    HZ3  LYS 128           HZ3      LYS 128  33.454   4.897  -9.298
  294    H    GLN 129           H        GLN 129  29.185   6.269  -6.788
  295    HA   GLN 129           HA       GLN 129  27.353   7.826  -5.000
  296    HB2  GLN 129           HB2      GLN 129  27.480   7.880  -8.050
  297    HB3  GLN 129           HB3      GLN 129  26.192   8.596  -7.074
  298    HG2  GLN 129           HG2      GLN 129  27.867  10.098  -5.975
  299    HG3  GLN 129           HG3      GLN 129  29.132   9.407  -6.992
  300   HE21  GLN 129          HE22      GLN 129  29.591  11.535  -7.896
  301   HE22  GLN 129          HE21      GLN 129  28.487  12.235  -9.069
  302    H    LEU 130           H        LEU 130  25.022   7.185  -5.389
  303    HA   LEU 130           HA       LEU 130  24.827   4.413  -4.875
  304    HB2  LEU 130           HB2      LEU 130  23.387   6.279  -3.991
  305    HB3  LEU 130           HB3      LEU 130  22.657   6.426  -5.587
  306    HG   LEU 130           HG       LEU 130  21.675   4.218  -5.396
  307   HD11  LEU 130          HD11      LEU 130  23.351   3.005  -4.058
  308   HD12  LEU 130          HD12      LEU 130  22.964   4.021  -2.641
  309   HD13  LEU 130          HD13      LEU 130  21.762   2.898  -3.322
  310   HD21  LEU 130          HD21      LEU 130  21.246   5.876  -2.873
  311   HD22  LEU 130          HD22      LEU 130  20.435   6.116  -4.438
  312   HD23  LEU 130          HD23      LEU 130  20.128   4.646  -3.495
  313    H    GLU 131           H        GLU 131  24.502   6.148  -7.889
  314    HA   GLU 131           HA       GLU 131  23.186   4.191  -9.477
  315    HB2  GLU 131           HB2      GLU 131  23.688   6.573 -10.071
  316    HB3  GLU 131           HB3      GLU 131  25.374   6.112 -10.341
  317    HG2  GLU 131           HG2      GLU 131  24.680   4.586 -12.152
  318    HG3  GLU 131           HG3      GLU 131  22.981   4.899 -11.795
  319    H    ASP 132           H        ASP 132  26.512   4.162  -8.197
  320    HA   ASP 132           HA       ASP 132  27.536   2.146  -9.956
  321    HB2  ASP 132           HB2      ASP 132  28.825   3.689  -8.385
  322    HB3  ASP 132           HB3      ASP 132  28.334   2.612  -7.075
  323    H    PHE 133           H        PHE 133  25.189   1.992  -7.475
  324    HA   PHE 133           HA       PHE 133  25.347  -0.985  -7.212
  325    HB2  PHE 133           HB2      PHE 133  24.316   1.090  -5.250
  326    HB3  PHE 133           HB3      PHE 133  24.341  -0.645  -4.990
  327    HD1  PHE 133           HD2      PHE 133  26.546  -1.861  -4.787
  328    HD2  PHE 133           HD1      PHE 133  26.326   2.440  -4.933
  329    HE1  PHE 133           HE2      PHE 133  28.848  -1.716  -3.867
  330    HE2  PHE 133           HE1      PHE 133  28.627   2.584  -4.014
  331    HZ   PHE 133           HZ       PHE 133  29.891   0.494  -3.494
  332    H    LEU 134           H        LEU 134  23.369   1.648  -8.229
  333    HA   LEU 134           HA       LEU 134  20.732   0.611  -8.178
  334    HB2  LEU 134           HB2      LEU 134  21.482   2.908  -8.720
  335    HB3  LEU 134           HB3      LEU 134  22.303   2.326 -10.155
  336    HG   LEU 134           HG       LEU 134  20.260   3.631 -10.517
  337   HD11  LEU 134          HD11      LEU 134  20.036   0.894 -11.789
  338   HD12  LEU 134          HD12      LEU 134  19.395   2.433 -12.372
  339   HD13  LEU 134          HD13      LEU 134  21.140   2.182 -12.292
  340   HD21  LEU 134          HD21      LEU 134  18.705   1.183  -9.648
  341   HD22  LEU 134          HD22      LEU 134  18.883   2.651  -8.678
  342   HD23  LEU 134          HD23      LEU 134  18.069   2.720 -10.244
  343    H    ILE 135           H        ILE 135  19.648  -0.796  -9.289
  344    HA   ILE 135           HA       ILE 135  21.046  -2.384 -11.420
  345    HB   ILE 135           HB       ILE 135  19.953  -4.351 -10.698
  346   HG12  ILE 135          HG12      ILE 135  18.246  -2.522  -9.055
  347   HG13  ILE 135          HG13      ILE 135  17.810  -3.908 -10.027
  348   HG21  ILE 135          HG21      ILE 135  21.081  -2.957  -8.253
  349   HG22  ILE 135          HG22      ILE 135  21.104  -4.688  -8.640
  350   HG23  ILE 135          HG23      ILE 135  22.058  -3.564  -9.603
  351   HD11  ILE 135          HD11      ILE 135  17.415  -4.360  -7.684
  352   HD12  ILE 135          HD12      ILE 135  18.749  -5.397  -8.233
  353   HD13  ILE 135          HD13      ILE 135  19.078  -3.928  -7.271
  354    H    LYS 136           H        LYS 136  17.966  -0.677 -10.949
  355    HA   LYS 136           HA       LYS 136  17.386  -1.406 -13.779
  356    HB2  LYS 136           HB2      LYS 136  15.221  -2.087 -13.367
  357    HB3  LYS 136           HB3      LYS 136  16.233  -2.852 -12.143
  358    HG2  LYS 136           HG2      LYS 136  15.442  -1.116 -10.483
  359    HG3  LYS 136           HG3      LYS 136  14.303  -0.550 -11.723
  360    HD2  LYS 136           HD2      LYS 136  13.393  -2.929 -11.851
  361    HD3  LYS 136           HD3      LYS 136  14.453  -3.330 -10.497
  362    HE2  LYS 136           HE2      LYS 136  12.382  -2.963  -9.485
  363    HE3  LYS 136           HE3      LYS 136  13.292  -1.498  -9.152
  364    HZ1  LYS 136           HZ1      LYS 136  12.047  -0.414 -11.000
  365    HZ2  LYS 136           HZ2      LYS 136  11.245  -1.807 -11.316
  366    HZ3  LYS 136           HZ3      LYS 136  11.001  -1.028  -9.909
  367    H    GLU 137           H        GLU 137  16.188   0.977 -11.307
  368    HA   GLU 137           HA       GLU 137  16.307   3.134 -13.301
  369    HB2  GLU 137           HB2      GLU 137  14.252   1.813 -13.920
  370    HB3  GLU 137           HB3      GLU 137  13.617   2.083 -12.295
  371    HG2  GLU 137           HG2      GLU 137  13.530   4.512 -12.719
  372    HG3  GLU 137           HG3      GLU 137  14.309   4.293 -14.286
  373    H    LEU 138           H        LEU 138  16.336   5.155 -12.303
  374    HA   LEU 138           HA       LEU 138  15.175   5.461  -9.617
  375    HB2  LEU 138           HB2      LEU 138  17.208   6.594  -8.734
  376    HB3  LEU 138           HB3      LEU 138  17.385   4.880  -9.029
  377    HG   LEU 138           HG       LEU 138  18.716   5.294 -11.037
  378   HD11  LEU 138          HD11      LEU 138  19.589   7.567 -11.545
  379   HD12  LEU 138          HD12      LEU 138  17.868   7.407 -11.891
  380   HD13  LEU 138          HD13      LEU 138  18.399   8.253 -10.419
  381   HD21  LEU 138          HD21      LEU 138  19.684   6.954  -8.667
  382   HD22  LEU 138          HD22      LEU 138  19.791   5.190  -8.782
  383   HD23  LEU 138          HD23      LEU 138  20.698   6.197  -9.917
  384    H    GLU 139           H        GLU 139  14.625   6.420 -12.386
  385    HA   GLU 139           HA       GLU 139  13.955   9.208 -11.733
  386    HB2  GLU 139           HB2      GLU 139  16.223   9.367 -12.729
  387    HB3  GLU 139           HB3      GLU 139  15.636   8.555 -14.188
  388    HG2  GLU 139           HG2      GLU 139  14.047  10.424 -14.585
  389    HG3  GLU 139           HG3      GLU 139  14.565  11.192 -13.086
  Start of MODEL   20
    1    H1   ALA  91           H1       ALA  91  10.332 -10.871 -16.687
    2    H2   ALA  91           H2       ALA  91  11.154 -12.277 -16.546
    3    H3   ALA  91           H3       ALA  91   9.521 -12.268 -16.412
    4    HA   ALA  91           HA       ALA  91   9.611 -10.975 -14.397
    5    HB1  ALA  91           HB1      ALA  91  11.344 -13.494 -14.252
    6    HB2  ALA  91           HB2      ALA  91  10.514 -12.706 -12.894
    7    HB3  ALA  91           HB3      ALA  91   9.572 -13.447 -14.194
    8    H    ALA  92           H        ALA  92  10.898 -10.116 -12.621
    9    HA   ALA  92           HA       ALA  92  13.768  -9.586 -13.079
   10    HB1  ALA  92           HB1      ALA  92  13.442  -7.130 -12.928
   11    HB2  ALA  92           HB2      ALA  92  12.590  -7.789 -14.331
   12    HB3  ALA  92           HB3      ALA  92  11.678  -7.357 -12.867
   13    H    ARG  93           H        ARG  93  14.682  -8.277 -11.216
   14    HA   ARG  93           HA       ARG  93  14.184  -9.666  -8.771
   15    HB2  ARG  93           HB2      ARG  93  15.797  -7.139  -9.357
   16    HB3  ARG  93           HB3      ARG  93  15.818  -7.980  -7.803
   17    HG2  ARG  93           HG2      ARG  93  16.648 -10.042  -8.891
   18    HG3  ARG  93           HG3      ARG  93  16.674  -9.215 -10.460
   19    HD2  ARG  93           HD2      ARG  93  18.275  -7.553  -9.566
   20    HD3  ARG  93           HD3      ARG  93  18.237  -8.374  -7.987
   21    HE   ARG  93           HE       ARG  93  18.940 -10.256 -10.028
   22   HH11  ARG  93          HH11      ARG  93  20.420  -7.550  -8.349
   23   HH12  ARG  93          HH12      ARG  93  22.037  -8.209  -8.550
   24   HH21  ARG  93          HH21      ARG  93  21.072 -10.987 -10.259
   25   HH22  ARG  93          HH22      ARG  93  22.376 -10.025  -9.582
   26    HA   PRO  94           HA       PRO  94  11.225  -6.890  -6.796
   27    HB2  PRO  94           HB2      PRO  94  11.112  -7.946  -4.300
   28    HB3  PRO  94           HB3      PRO  94  10.686  -8.939  -5.717
   29    HG2  PRO  94           HG2      PRO  94  13.386  -8.812  -4.318
   30    HG3  PRO  94           HG3      PRO  94  12.391 -10.268  -4.664
   31    HD2  PRO  94           HD2      PRO  94  14.396  -9.423  -6.331
   32    HD3  PRO  94           HD3      PRO  94  12.900 -10.196  -6.947
   33    H    ALA  95           H        ALA  95  13.851  -5.828  -7.145
   34    HA   ALA  95           HA       ALA  95  14.180  -3.907  -4.947
   35    HB1  ALA  95           HB1      ALA  95  15.416  -5.902  -4.111
   36    HB2  ALA  95           HB2      ALA  95  16.339  -5.974  -5.629
   37    HB3  ALA  95           HB3      ALA  95  16.544  -4.599  -4.522
   38    H    LYS  96           H        LYS  96  16.073  -2.381  -5.500
   39    HA   LYS  96           HA       LYS  96  16.479  -2.178  -8.438
   40    HB2  LYS  96           HB2      LYS  96  14.782  -0.603  -7.695
   41    HB3  LYS  96           HB3      LYS  96  15.892   0.096  -6.507
   42    HG2  LYS  96           HG2      LYS  96  17.262   1.050  -8.194
   43    HG3  LYS  96           HG3      LYS  96  16.584   0.037  -9.470
   44    HD2  LYS  96           HD2      LYS  96  15.861   2.334  -9.725
   45    HD3  LYS  96           HD3      LYS  96  14.481   1.270  -9.400
   46    HE2  LYS  96           HE2      LYS  96  14.505   1.990  -7.002
   47    HE3  LYS  96           HE3      LYS  96  15.873   3.060  -7.349
   48    HZ1  LYS  96           HZ1      LYS  96  13.163   3.305  -8.579
   49    HZ2  LYS  96           HZ2      LYS  96  13.759   4.271  -7.406
   50    HZ3  LYS  96           HZ3      LYS  96  14.424   4.300  -8.893
   51    H    TYR  97           H        TYR  97  18.103  -2.371  -5.459
   52    HA   TYR  97           HA       TYR  97  20.684  -1.647  -6.781
   53    HB2  TYR  97           HB2      TYR  97  19.878  -1.156  -3.899
   54    HB3  TYR  97           HB3      TYR  97  21.424  -0.757  -4.618
   55    HD1  TYR  97           HD2      TYR  97  17.807   0.111  -4.505
   56    HD2  TYR  97           HD1      TYR  97  21.740   1.338  -5.780
   57    HE1  TYR  97           HE2      TYR  97  16.932   2.384  -5.003
   58    HE2  TYR  97           HE1      TYR  97  20.849   3.606  -6.291
   59    HH   TYR  97           HH       TYR  97  17.447   4.543  -5.716
   60    H    SER  98           H        SER  98  22.546  -2.839  -5.981
   61    HA   SER  98           HA       SER  98  22.096  -4.953  -3.986
   62    HB2  SER  98           HB2      SER  98  22.967  -6.760  -5.292
   63    HB3  SER  98           HB3      SER  98  21.616  -6.056  -6.189
   64    HG   SER  98           HG       SER  98  23.576  -6.549  -7.403
   65    H    TYR  99           H        TYR  99  24.037  -5.933  -3.169
   66    HA   TYR  99           HA       TYR  99  26.569  -4.504  -3.739
   67    HB2  TYR  99           HB2      TYR  99  26.937  -4.033  -1.363
   68    HB3  TYR  99           HB3      TYR  99  25.618  -3.136  -2.057
   69    HD1  TYR  99           HD1      TYR  99  23.226  -3.742  -1.520
   70    HD2  TYR  99           HD2      TYR  99  26.588  -5.494   0.537
   71    HE1  TYR  99           HE1      TYR  99  21.764  -4.256   0.445
   72    HE2  TYR  99           HE2      TYR  99  25.157  -5.956   2.505
   73    HH   TYR  99           HH       TYR  99  23.055  -5.699   3.452
   74    H    VAL 100           H        VAL 100  28.396  -5.346  -2.529
   75    HA   VAL 100           HA       VAL 100  28.450  -8.341  -2.741
   76    HB   VAL 100           HB       VAL 100  30.400  -6.163  -3.597
   77   HG11  VAL 100          HG11      VAL 100  30.853  -9.169  -3.672
   78   HG12  VAL 100          HG12      VAL 100  31.831  -7.961  -4.532
   79   HG13  VAL 100          HG13      VAL 100  31.793  -7.966  -2.774
   80   HG21  VAL 100          HG21      VAL 100  30.072  -7.077  -5.857
   81   HG22  VAL 100          HG22      VAL 100  28.926  -8.273  -5.224
   82   HG23  VAL 100          HG23      VAL 100  28.533  -6.545  -5.173
   83    H    ASP 101           H        ASP 101  29.518  -9.465  -1.258
   84    HA   ASP 101           HA       ASP 101  31.477  -8.190   0.586
   85    HB2  ASP 101           HB2      ASP 101  29.152  -8.317   1.710
   86    HB3  ASP 101           HB3      ASP 101  29.325 -10.079   1.570
   87    H    GLU 102           H        GLU 102  29.823 -11.129  -0.463
   88    HA   GLU 102           HA       GLU 102  32.037 -12.972   0.042
   89    HB2  GLU 102           HB2      GLU 102  29.380 -13.214  -1.446
   90    HB3  GLU 102           HB3      GLU 102  30.455 -14.565  -1.147
   91    HG2  GLU 102           HG2      GLU 102  29.085 -12.925   1.010
   92    HG3  GLU 102           HG3      GLU 102  28.587 -14.509   0.426
   93    H    ASN 103           H        ASN 103  31.810 -14.475  -2.285
   94    HA   ASN 103           HA       ASN 103  33.808 -13.386  -4.021
   95    HB2  ASN 103           HB2      ASN 103  33.575 -15.426  -5.252
   96    HB3  ASN 103           HB3      ASN 103  33.479 -15.824  -3.538
   97   HD21  ASN 103          HD22      ASN 103  32.544 -17.410  -5.847
   98   HD22  ASN 103          HD21      ASN 103  30.815 -17.604  -5.603
   99    H    GLY 104           H        GLY 104  30.665 -12.416  -3.933
  100    HA2  GLY 104           HA2      GLY 104  30.545 -11.105  -6.460
  101    HA3  GLY 104           HA3      GLY 104  29.598 -12.603  -6.518
  102    H    GLU 105           H        GLU 105  27.768 -11.188  -6.805
  103    HA   GLU 105           HA       GLU 105  26.792  -9.246  -4.998
  104    HB2  GLU 105           HB2      GLU 105  25.223 -11.211  -6.711
  105    HB3  GLU 105           HB3      GLU 105  24.517  -9.871  -5.800
  106    HG2  GLU 105           HG2      GLU 105  26.038  -8.291  -7.068
  107    HG3  GLU 105           HG3      GLU 105  26.491  -9.650  -8.104
  108    H    THR 106           H        THR 106  25.962  -9.241  -3.069
  109    HA   THR 106           HA       THR 106  25.688 -11.780  -1.582
  110    HB   THR 106           HB       THR 106  26.829  -9.067  -0.989
  111    HG1  THR 106           HG1      THR 106  27.600 -11.739  -0.430
  112   HG21  THR 106          HG21      THR 106  25.817 -10.944   1.161
  113   HG22  THR 106          HG22      THR 106  27.036  -9.672   1.408
  114   HG23  THR 106          HG23      THR 106  25.414  -9.219   0.907
  115    H    LYS 107           H        LYS 107  24.306  -8.460  -1.693
  116    HA   LYS 107           HA       LYS 107  21.616  -9.518  -0.968
  117    HB2  LYS 107           HB2      LYS 107  23.321  -7.684   0.743
  118    HB3  LYS 107           HB3      LYS 107  21.561  -7.537   0.788
  119    HG2  LYS 107           HG2      LYS 107  21.380  -9.945   1.392
  120    HG3  LYS 107           HG3      LYS 107  23.150 -10.033   1.482
  121    HD2  LYS 107           HD2      LYS 107  23.165  -8.320   3.256
  122    HD3  LYS 107           HD3      LYS 107  21.389  -8.200   3.163
  123    HE2  LYS 107           HE2      LYS 107  21.215 -10.614   3.754
  124    HE3  LYS 107           HE3      LYS 107  22.977 -10.723   3.852
  125    HZ1  LYS 107           HZ1      LYS 107  21.289  -8.995   5.599
  126    HZ2  LYS 107           HZ2      LYS 107  21.977 -10.405   6.052
  127    HZ3  LYS 107           HZ3      LYS 107  22.920  -9.122   5.694
  128    H    THR 108           H        THR 108  19.975  -7.772  -0.947
  129    HA   THR 108           HA       THR 108  20.421  -5.765  -3.112
  130    HB   THR 108           HB       THR 108  18.107  -6.292  -3.864
  131    HG1  THR 108           HG1      THR 108  17.257  -8.317  -3.179
  132   HG21  THR 108          HG21      THR 108  20.029  -7.244  -5.065
  133   HG22  THR 108          HG22      THR 108  20.032  -8.653  -3.977
  134   HG23  THR 108          HG23      THR 108  18.654  -8.358  -5.066
  135    H    TRP 109           H        TRP 109  18.849  -4.030  -3.221
  136    HA   TRP 109           HA       TRP 109  17.449  -3.288  -0.724
  137    HB2  TRP 109           HB2      TRP 109  19.772  -2.714  -0.283
  138    HB3  TRP 109           HB3      TRP 109  19.898  -1.841  -1.793
  139    HD1  TRP 109           HD1      TRP 109  17.538  -1.606   1.294
  140    HE1  TRP 109           HE1      TRP 109  17.360   0.851   2.027
  141    HE3  TRP 109           HE3      TRP 109  20.604   0.540  -2.223
  142    HZ2  TRP 109           HZ2      TRP 109  18.531   3.369   1.310
  143    HZ3  TRP 109           HZ3      TRP 109  21.052   2.971  -2.160
  144    HH2  TRP 109           HH2      TRP 109  20.072   4.393  -0.374
  145    H    THR 110           H        THR 110  16.227  -1.316  -0.899
  146    HA   THR 110           HA       THR 110  15.028  -1.019  -3.611
  147    HB   THR 110           HB       THR 110  12.994  -0.380  -2.281
  148    HG1  THR 110           HG1      THR 110  13.116  -0.768  -0.035
  149   HG21  THR 110          HG21      THR 110  12.475  -2.602  -1.434
  150   HG22  THR 110          HG22      THR 110  13.342  -2.742  -2.969
  151   HG23  THR 110          HG23      THR 110  14.187  -3.057  -1.435
  152    H    GLY 111           H        GLY 111  17.022   0.835  -1.633
  153    HA2  GLY 111           HA2      GLY 111  17.621   3.083  -1.880
  154    HA3  GLY 111           HA3      GLY 111  16.232   3.367  -2.922
  155    H    GLN 112           H        GLN 112  15.694   1.839   0.195
  156    HA   GLN 112           HA       GLN 112  14.514   4.351   1.318
  157    HB2  GLN 112           HB2      GLN 112  13.215   1.597   1.148
  158    HB3  GLN 112           HB3      GLN 112  12.540   3.007   1.977
  159    HG2  GLN 112           HG2      GLN 112  12.484   4.238  -0.192
  160    HG3  GLN 112           HG3      GLN 112  13.024   2.778  -1.026
  161   HE21  GLN 112          HE22      GLN 112  10.335   4.458  -0.878
  162   HE22  GLN 112          HE21      GLN 112   9.147   3.170  -0.749
  163    H    GLY 113           H        GLY 113  13.939   4.175   3.627
  164    HA2  GLY 113           HA2      GLY 113  14.388   3.681   5.843
  165    HA3  GLY 113           HA3      GLY 113  15.189   2.189   5.352
  166    H    ARG 114           H        ARG 114  17.422   2.203   4.971
  167    HA   ARG 114           HA       ARG 114  19.000   4.699   5.082
  168    HB2  ARG 114           HB2      ARG 114  19.439   2.361   7.006
  169    HB3  ARG 114           HB3      ARG 114  20.611   3.645   6.735
  170    HG2  ARG 114           HG2      ARG 114  17.823   4.027   7.921
  171    HG3  ARG 114           HG3      ARG 114  19.335   3.939   8.820
  172    HD2  ARG 114           HD2      ARG 114  20.174   5.957   7.664
  173    HD3  ARG 114           HD3      ARG 114  18.664   6.103   6.776
  174    HE   ARG 114           HE       ARG 114  19.147   6.705   9.616
  175   HH11  ARG 114          HH11      ARG 114  16.611   6.248   7.215
  176   HH12  ARG 114          HH12      ARG 114  15.457   7.158   8.157
  177   HH21  ARG 114          HH21      ARG 114  17.619   7.837  10.749
  178   HH22  ARG 114          HH22      ARG 114  16.012   8.012  10.110
  179    H    THR 115           H        THR 115  20.944   4.580   4.026
  180    HA   THR 115           HA       THR 115  21.339   2.725   1.946
  181    HB   THR 115           HB       THR 115  23.434   4.459   3.289
  182    HG1  THR 115           HG1      THR 115  22.747   6.024   1.832
  183   HG21  THR 115          HG21      THR 115  24.437   2.904   1.685
  184   HG22  THR 115          HG22      THR 115  23.217   3.343   0.461
  185   HG23  THR 115          HG23      THR 115  24.421   4.536   1.000
  186    HA   PRO 116           HA       PRO 116  23.139  -0.852   4.111
  187    HB2  PRO 116           HB2      PRO 116  24.361  -1.175   1.359
  188    HB3  PRO 116           HB3      PRO 116  23.685  -2.427   2.439
  189    HG2  PRO 116           HG2      PRO 116  22.192  -1.468   0.400
  190    HG3  PRO 116           HG3      PRO 116  21.445  -1.692   2.016
  191    HD2  PRO 116           HD2      PRO 116  22.427   0.872   0.745
  192    HD3  PRO 116           HD3      PRO 116  20.963   0.562   1.728
  193    H    ALA 117           H        ALA 117  25.091  -1.306   5.132
  194    HA   ALA 117           HA       ALA 117  26.795   0.817   5.591
  195    HB1  ALA 117           HB1      ALA 117  28.150  -0.787   6.874
  196    HB2  ALA 117           HB2      ALA 117  26.421  -1.052   7.133
  197    HB3  ALA 117           HB3      ALA 117  27.341  -2.144   6.069
  198    H    VAL 118           H        VAL 118  27.679  -2.029   3.513
  199    HA   VAL 118           HA       VAL 118  30.244  -0.977   2.873
  200    HB   VAL 118           HB       VAL 118  29.593  -3.336   2.632
  201   HG11  VAL 118          HG11      VAL 118  27.419  -3.084   1.464
  202   HG12  VAL 118          HG12      VAL 118  28.282  -2.524   0.005
  203   HG13  VAL 118          HG13      VAL 118  28.536  -4.167   0.616
  204   HG21  VAL 118          HG21      VAL 118  30.779  -2.151   0.093
  205   HG22  VAL 118          HG22      VAL 118  31.663  -2.456   1.603
  206   HG23  VAL 118          HG23      VAL 118  30.976  -3.809   0.696
  207    H    ILE 119           H        ILE 119  27.106  -0.346   1.337
  208    HA   ILE 119           HA       ILE 119  28.175   1.103  -0.951
  209    HB   ILE 119           HB       ILE 119  25.431   1.221   0.375
  210   HG12  ILE 119          HG12      ILE 119  26.469  -0.262  -2.071
  211   HG13  ILE 119          HG13      ILE 119  25.936  -0.985  -0.564
  212   HG21  ILE 119          HG21      ILE 119  25.883   3.330  -0.842
  213   HG22  ILE 119          HG22      ILE 119  26.359   2.403  -2.275
  214   HG23  ILE 119          HG23      ILE 119  24.685   2.376  -1.686
  215   HD11  ILE 119          HD11      ILE 119  24.178  -1.305  -2.146
  216   HD12  ILE 119          HD12      ILE 119  23.620  -0.075  -1.002
  217   HD13  ILE 119          HD13      ILE 119  24.179   0.395  -2.626
  218    H    LYS 120           H        LYS 120  27.010   2.102   2.304
  219    HA   LYS 120           HA       LYS 120  27.533   4.909   2.049
  220    HB2  LYS 120           HB2      LYS 120  26.175   4.146   3.839
  221    HB3  LYS 120           HB3      LYS 120  27.370   2.979   4.400
  222    HG2  LYS 120           HG2      LYS 120  28.856   4.727   5.174
  223    HG3  LYS 120           HG3      LYS 120  27.791   5.988   4.499
  224    HD2  LYS 120           HD2      LYS 120  25.962   5.153   6.033
  225    HD3  LYS 120           HD3      LYS 120  27.135   4.066   6.791
  226    HE2  LYS 120           HE2      LYS 120  27.315   7.117   6.667
  227    HE3  LYS 120           HE3      LYS 120  26.735   6.192   8.050
  228    HZ1  LYS 120           HZ1      LYS 120  29.040   6.774   8.380
  229    HZ2  LYS 120           HZ2      LYS 120  28.982   5.156   8.184
  230    HZ3  LYS 120           HZ3      LYS 120  29.519   6.134   6.958
  231    H    LYS 121           H        LYS 121  29.660   2.299   3.280
  232    HA   LYS 121           HA       LYS 121  31.895   4.045   3.722
  233    HB2  LYS 121           HB2      LYS 121  31.717   1.042   3.290
  234    HB3  LYS 121           HB3      LYS 121  33.228   1.856   3.672
  235    HG2  LYS 121           HG2      LYS 121  30.761   1.647   5.431
  236    HG3  LYS 121           HG3      LYS 121  32.313   0.886   5.679
  237    HD2  LYS 121           HD2      LYS 121  31.575   3.807   5.986
  238    HD3  LYS 121           HD3      LYS 121  32.119   2.700   7.235
  239    HE2  LYS 121           HE2      LYS 121  33.831   3.740   4.921
  240    HE3  LYS 121           HE3      LYS 121  33.829   4.402   6.549
  241    HZ1  LYS 121           HZ1      LYS 121  34.604   1.586   5.957
  242    HZ2  LYS 121           HZ2      LYS 121  35.651   2.830   6.091
  243    HZ3  LYS 121           HZ3      LYS 121  34.748   2.368   7.393
  244    H    ALA 122           H        ALA 122  30.988   2.199   0.798
  245    HA   ALA 122           HA       ALA 122  33.282   2.957  -0.724
  246    HB1  ALA 122           HB1      ALA 122  31.751   1.106  -1.309
  247    HB2  ALA 122           HB2      ALA 122  30.469   2.282  -1.667
  248    HB3  ALA 122           HB3      ALA 122  31.955   2.251  -2.643
  249    H    MET 123           H        MET 123  30.126   4.654  -0.242
  250    HA   MET 123           HA       MET 123  30.706   6.847  -1.984
  251    HB2  MET 123           HB2      MET 123  28.994   6.728   0.527
  252    HB3  MET 123           HB3      MET 123  29.050   8.096  -0.575
  253    HG2  MET 123           HG2      MET 123  28.045   6.866  -2.344
  254    HG3  MET 123           HG3      MET 123  28.318   5.324  -1.557
  255    HE1  MET 123           HE1      MET 123  26.219   8.622  -1.623
  256    HE2  MET 123           HE2      MET 123  25.084   8.398  -0.275
  257    HE3  MET 123           HE3      MET 123  26.801   8.696   0.055
  258    H    GLU 124           H        GLU 124  31.390   6.397   1.520
  259    HA   GLU 124           HA       GLU 124  32.534   8.993   1.863
  260    HB2  GLU 124           HB2      GLU 124  32.623   6.457   3.537
  261    HB3  GLU 124           HB3      GLU 124  33.370   7.977   4.046
  262    HG2  GLU 124           HG2      GLU 124  31.186   9.136   3.833
  263    HG3  GLU 124           HG3      GLU 124  30.411   7.613   3.417
  264    H    GLU 125           H        GLU 125  34.141   5.812   1.374
  265    HA   GLU 125           HA       GLU 125  36.800   7.195   1.430
  266    HB2  GLU 125           HB2      GLU 125  36.045   4.293   1.904
  267    HB3  GLU 125           HB3      GLU 125  37.690   4.936   1.882
  268    HG2  GLU 125           HG2      GLU 125  36.909   6.606   3.699
  269    HG3  GLU 125           HG3      GLU 125  35.496   5.566   3.885
  270    H    GLN 126           H        GLN 126  34.766   5.589  -0.870
  271    HA   GLN 126           HA       GLN 126  37.068   5.447  -2.794
  272    HB2  GLN 126           HB2      GLN 126  34.599   3.674  -2.728
  273    HB3  GLN 126           HB3      GLN 126  35.922   3.602  -3.894
  274    HG2  GLN 126           HG2      GLN 126  37.513   3.077  -2.052
  275    HG3  GLN 126           HG3      GLN 126  36.174   3.047  -0.903
  276   HE21  GLN 126          HE22      GLN 126  38.131   0.915  -2.317
  277   HE22  GLN 126          HE21      GLN 126  36.985  -0.381  -2.635
  278    H    GLY 127           H        GLY 127  34.548   7.409  -2.115
  279    HA2  GLY 127           HA2      GLY 127  33.628   9.147  -3.266
  280    HA3  GLY 127           HA3      GLY 127  34.722   8.782  -4.600
  281    H    LYS 128           H        LYS 128  32.551   6.220  -3.690
  282    HA   LYS 128           HA       LYS 128  31.226   6.250  -6.288
  283    HB2  LYS 128           HB2      LYS 128  30.597   4.621  -3.783
  284    HB3  LYS 128           HB3      LYS 128  29.945   4.322  -5.387
  285    HG2  LYS 128           HG2      LYS 128  32.833   3.987  -4.515
  286    HG3  LYS 128           HG3      LYS 128  31.664   2.741  -4.973
  287    HD2  LYS 128           HD2      LYS 128  31.605   3.823  -7.297
  288    HD3  LYS 128           HD3      LYS 128  33.005   4.792  -6.785
  289    HE2  LYS 128           HE2      LYS 128  34.224   2.654  -6.263
  290    HE3  LYS 128           HE3      LYS 128  32.820   1.741  -6.847
  291    HZ1  LYS 128           HZ1      LYS 128  33.156   2.765  -9.052
  292    HZ2  LYS 128           HZ2      LYS 128  34.458   3.598  -8.507
  293    HZ3  LYS 128           HZ3      LYS 128  34.505   1.971  -8.587
  294    H    GLN 129           H        GLN 129  28.875   6.016  -6.515
  295    HA   GLN 129           HA       GLN 129  27.198   7.602  -4.615
  296    HB2  GLN 129           HB2      GLN 129  27.150   7.791  -7.663
  297    HB3  GLN 129           HB3      GLN 129  25.951   8.498  -6.575
  298    HG2  GLN 129           HG2      GLN 129  27.761   9.886  -5.527
  299    HG3  GLN 129           HG3      GLN 129  28.908   9.240  -6.708
  300   HE21  GLN 129          HE22      GLN 129  28.975  10.201  -8.785
  301   HE22  GLN 129          HE21      GLN 129  27.858  11.469  -9.270
  302    H    LEU 130           H        LEU 130  24.771   7.050  -5.061
  303    HA   LEU 130           HA       LEU 130  24.513   4.258  -4.621
  304    HB2  LEU 130           HB2      LEU 130  22.367   6.297  -5.365
  305    HB3  LEU 130           HB3      LEU 130  22.074   4.671  -4.786
  306    HG   LEU 130           HG       LEU 130  21.645   6.031  -2.977
  307   HD11  LEU 130          HD11      LEU 130  24.468   5.028  -2.440
  308   HD12  LEU 130          HD12      LEU 130  23.172   5.310  -1.259
  309   HD13  LEU 130          HD13      LEU 130  23.018   4.008  -2.452
  310   HD21  LEU 130          HD21      LEU 130  23.026   7.707  -2.005
  311   HD22  LEU 130          HD22      LEU 130  24.370   7.369  -3.103
  312   HD23  LEU 130          HD23      LEU 130  22.858   8.089  -3.728
  313    H    GLU 131           H        GLU 131  24.254   6.061  -7.637
  314    HA   GLU 131           HA       GLU 131  23.084   3.988  -9.247
  315    HB2  GLU 131           HB2      GLU 131  24.910   6.297  -9.989
  316    HB3  GLU 131           HB3      GLU 131  24.094   5.247 -11.156
  317    HG2  GLU 131           HG2      GLU 131  21.891   5.894 -10.229
  318    HG3  GLU 131           HG3      GLU 131  22.679   6.978  -9.083
  319    H    ASP 132           H        ASP 132  26.384   4.226  -7.997
  320    HA   ASP 132           HA       ASP 132  27.544   2.361  -9.872
  321    HB2  ASP 132           HB2      ASP 132  28.361   3.104  -7.038
  322    HB3  ASP 132           HB3      ASP 132  29.285   2.064  -8.099
  323    H    PHE 133           H        PHE 133  25.246   1.987  -7.397
  324    HA   PHE 133           HA       PHE 133  25.614  -0.981  -7.236
  325    HB2  PHE 133           HB2      PHE 133  24.543   0.980  -5.174
  326    HB3  PHE 133           HB3      PHE 133  24.619  -0.764  -4.986
  327    HD1  PHE 133           HD2      PHE 133  26.833  -1.933  -4.818
  328    HD2  PHE 133           HD1      PHE 133  26.534   2.365  -4.913
  329    HE1  PHE 133           HE2      PHE 133  29.153  -1.753  -3.942
  330    HE2  PHE 133           HE1      PHE 133  28.844   2.542  -4.019
  331    HZ   PHE 133           HZ       PHE 133  30.159   0.486  -3.536
  332    H    LEU 134           H        LEU 134  23.531   1.512  -8.270
  333    HA   LEU 134           HA       LEU 134  20.980   0.170  -8.111
  334    HB2  LEU 134           HB2      LEU 134  21.595   2.661  -8.332
  335    HB3  LEU 134           HB3      LEU 134  21.820   2.352 -10.041
  336    HG   LEU 134           HG       LEU 134  19.257   1.973  -8.450
  337   HD11  LEU 134          HD11      LEU 134  18.467   3.966  -9.630
  338   HD12  LEU 134          HD12      LEU 134  19.941   4.333  -8.729
  339   HD13  LEU 134          HD13      LEU 134  20.014   4.094 -10.493
  340   HD21  LEU 134          HD21      LEU 134  18.178   1.904 -10.746
  341   HD22  LEU 134          HD22      LEU 134  19.810   1.662 -11.427
  342   HD23  LEU 134          HD23      LEU 134  19.099   0.472 -10.301
  343    H    ILE 135           H        ILE 135  20.332  -1.482  -9.301
  344    HA   ILE 135           HA       ILE 135  21.778  -2.176 -11.839
  345    HB   ILE 135           HB       ILE 135  21.547  -4.583 -11.150
  346   HG12  ILE 135          HG12      ILE 135  21.532  -5.121  -8.778
  347   HG13  ILE 135          HG13      ILE 135  21.153  -3.460  -8.344
  348   HG21  ILE 135          HG21      ILE 135  23.590  -4.497  -9.820
  349   HG22  ILE 135          HG22      ILE 135  23.657  -3.319 -11.128
  350   HG23  ILE 135          HG23      ILE 135  23.330  -2.782  -9.470
  351   HD11  ILE 135          HD11      ILE 135  18.919  -3.675  -9.304
  352   HD12  ILE 135          HD12      ILE 135  19.320  -5.275  -9.976
  353   HD13  ILE 135          HD13      ILE 135  19.216  -5.030  -8.217
  354    H    LYS 136           H        LYS 136  18.528  -1.778 -10.707
  355    HA   LYS 136           HA       LYS 136  17.484  -3.622 -12.781
  356    HB2  LYS 136           HB2      LYS 136  16.539  -3.553 -10.513
  357    HB3  LYS 136           HB3      LYS 136  15.982  -1.894 -10.787
  358    HG2  LYS 136           HG2      LYS 136  14.455  -2.619 -12.518
  359    HG3  LYS 136           HG3      LYS 136  15.144  -4.254 -12.523
  360    HD2  LYS 136           HD2      LYS 136  14.285  -4.692 -10.299
  361    HD3  LYS 136           HD3      LYS 136  13.738  -3.005 -10.124
  362    HE2  LYS 136           HE2      LYS 136  12.155  -3.325 -12.007
  363    HE3  LYS 136           HE3      LYS 136  12.720  -4.986 -12.209
  364    HZ1  LYS 136           HZ1      LYS 136  11.351  -3.915  -9.786
  365    HZ2  LYS 136           HZ2      LYS 136  10.686  -4.929 -10.875
  366    HZ3  LYS 136           HZ3      LYS 136  11.915  -5.452  -9.916
  367    H    GLU 137           H        GLU 137  18.030  -0.196 -12.588
  368    HA   GLU 137           HA       GLU 137  16.319   0.271 -15.017
  369    HB2  GLU 137           HB2      GLU 137  16.870   2.103 -12.661
  370    HB3  GLU 137           HB3      GLU 137  15.920   2.539 -14.064
  371    HG2  GLU 137           HG2      GLU 137  15.218   0.350 -12.065
  372    HG3  GLU 137           HG3      GLU 137  14.520   1.962 -12.139
  373    H    LEU 138           H        LEU 138  19.384  -0.220 -14.651
  374    HA   LEU 138           HA       LEU 138  20.293   1.948 -16.467
  375    HB2  LEU 138           HB2      LEU 138  21.731   1.018 -13.945
  376    HB3  LEU 138           HB3      LEU 138  22.444   2.053 -15.171
  377    HG   LEU 138           HG       LEU 138  20.032   2.821 -13.476
  378   HD11  LEU 138          HD11      LEU 138  22.930   3.730 -13.292
  379   HD12  LEU 138          HD12      LEU 138  21.570   4.246 -12.262
  380   HD13  LEU 138          HD13      LEU 138  22.151   2.572 -12.205
  381   HD21  LEU 138          HD21      LEU 138  20.066   4.040 -15.628
  382   HD22  LEU 138          HD22      LEU 138  20.473   5.104 -14.283
  383   HD23  LEU 138          HD23      LEU 138  21.761   4.498 -15.349
  384    H    GLU 139           H        GLU 139  22.274   1.422 -17.595
  385    HA   GLU 139           HA       GLU 139  23.136  -1.396 -17.764
  386    HB2  GLU 139           HB2      GLU 139  21.166  -1.213 -19.277
  387    HB3  GLU 139           HB3      GLU 139  21.981   0.078 -20.165
  388    HG2  GLU 139           HG2      GLU 139  23.795  -1.498 -20.791
  389    HG3  GLU 139           HG3      GLU 139  23.035  -2.770 -19.833