*HEADER    MATRIX PROTEIN                          22-SEP-95   2HMX      
*TITLE     HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 MATRIX PROTEIN            
*COMPND    MOL_ID: 1;                                                    
*COMPND   2 MOLECULE: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 MATRIX         
*COMPND   3 PROTEIN;                                                     
*COMPND   4 CHAIN: NULL;                                                 
*COMPND   5 SYNONYM: HIV-1 MA, HIVP17, P17, MA                           
*SOURCE    MOL_ID: 1;                                                    
*SOURCE   2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1;    
*SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                         
*SOURCE   4 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                        
*SOURCE   5 EXPRESSION_SYSTEM_PLASMID: WISP93-93                         
*KEYWDS    HIV-1 P17, HIV-1 MA, MATRIX PROTEIN                           
*EXPDTA    NMR, 20 STRUCTURES                                            
*AUTHOR    M.A.MASSIAH,M.R.STARICH,C.PASCHALL,A.M.CHRISTENSEN,           
*AUTHOR   2 W.I.SUNDQUIST,M.F.SUMMERS                                    
*REVDAT   1   12-OCT-04 2HMX    0   

h56373
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d D 1.7 95/12/17 13:10:52 swami 7 6
c 
e
s 00000/00000/01004
d D 1.6 95/10/08 16:13:10 rose 6 5
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d D 1.5 95/10/08 14:56:30 abola 5 4
c "."
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d D 1.4 95/10/08 13:17:02 rose 4 3
c "."
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s 00000/00000/01004
d D 1.3 95/10/06 18:02:22 libeson 3 2
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s 00000/00000/01004
d D 1.2 95/10/06 17:34:35 libeson 2 1
c 
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s 01004/00000/00000
d D 1.1 95/10/06 15:02:49 deroski 1 0
c date and time created 95/10/06 15:02:49 by deroski
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I 1
           Michael F. Summers/Michael A. Massiah
           Howard Hughes Medical Institute 
           and Department of Chemistry and Biochemistry
           University of Maryland Baltimore County
           5401 Wilkens Ave.
           Baltimore, MD 21228 
           phone (410)455-2527 or x2718
           fax (410)455-1174
           e-mail:summers@hhmi.umbc.edu/
           e-mail:massiah@umbc.edu


Experimental Restraints for the NMR solution structure of HIV-1 Matrix 
Protein (HIVp17) determined from the Nuclear Overhauser Effect (NOE) of
the recombinant HIV-1 matrix protein.
AUTHORS
    Michael A. Massiah*, Mary R. Starich*, Chiana Paschall*, 
Michael F. Summers*, Allyson M. Christensen**, Wesley I. Sundquist**.
*Howard Hughes Medical Institute and Department of Chemistry and 
Biochemistry, University of Maryland Baltimore County, Baltimore,
MD 21228, USA.
** Department of Biochemistry, University of Utah, Salt Lake, UT, 84132,USA

Reference:
 M.A. Massiah, M.R.Starich, C.Paschall, M.F.Summers, A.M.Christensen,
W.I.Sundquist (1994) Three dimensional Structure of the Human Immuno-
deficiency virus type 1 Matrix Protein, Journal of Molecular Biology,
244, p198-223

      NOE INTENSITY        INTENSITY STRENGTHS IN ANGSTROM 
         Strong                      1.8-2.7
         Medium                      1.8-3.3
         Weak                        1.8-5.0
   0.5A is added to NOEs involving methyls
LB = Lower Bound
UB = Upper Bound

Amino acid residue sequence of the recombinant protein 
 of the HIV-1 Matrix protein
H M G A R A S V L S  G G E L D K W E K I  R L R P G   25
G K K Q Y K L K H I  V W A S R E L E R F  A V N P G   50
L L E T S E G C R Q  I L G Q L Q P S L Q  T G S E E   75
L R S L Y N T I A V  L Y C V H Q R I D V  K D T K E   100
A L D K I E E E Q N  K S K K K A Q Q A A  A D T G N   125
N S Q V S Q N Y                                       133



CHIRAL CENTERS 
   Ca= alpha carbon center
   Cb= beta carbon center
   Cg= gamma carbon center 
   Cd= delta carbon center
  cb[4] 
  cb[6]    
  cb[8]     
  cb[9]   
  cg[9]   
  ca[11]   
  ca[12]    
  cb[13]    
  cg[13]
  cg[14]   
  cb[17]   
  cg[22]     
  cb[23]   
  cg[23]   
  cb[30]    
  cg1[35]  
  cb[36]    
  cb[38]  
  cb[42]    
  cg[42]      
  cb[45]   
  cb[46]    
  cb[47]    
  cb[49] 
  cb[51]    
  cg[51]   
  ca[57]     
  cb[62]     
  cg[62]    
  cb[65]   
  cg[65]   
  cb[66]    
  cg[66]      
  cd[67]           
  cb[69]    
  cg[69]       
  ca[72]    
  cg[76]      
  cg[79]             
  cb[80]   
  cb[81]   
  cb[84]   
  cb[85]  
  cg[86]        
  cb[87]    
  cb[88]   
  cb[89]    
  cb[90]    
  cb[95]    
  cb[97]   
  cb[101]  
  cg[102]     
HYDROGEN BOND RESTRAINTS
      LB = Lower Bound
      UB = Upper Bound
   ATOM1  ATOM 2 LB UB
  og[10] hn[13] # 2.2       
  o[10] hn[14] # 2.2
  o[11] hn[15] # 2.2
  o[12] hn[16] # 2.2
  o[13] hn[17] # 2.2
  o[14] hn[18] # 2.2
  hn[30] o[20] # 2.2
  hn[20] o[30] # 2.2
  hn[22] o[28] # 2.2
  hn[26] o[23] # 2.2      
  o[31] hn[35] # 2.2            
  o[32] hn[36] # 2.2
  o[33] hn[37] # 2.2
  o[34] hn[38] # 2.2
  o[35] hn[39] # 2.2
  o[36] hn[40] # 2.2
  o[37] hn[41] # 2.2
  o[38] hn[42] # 2.2
  o[39] hn[43] # 2.2
  o[40] hn[44] # 2.2
  o[41] hn[45] # 2.2
  o[42] hn[46] # 2.2   
  o[43] hn[47] # 2.2   
  og1[54] hn[57] # 2.2       
  o[54] hn[58] # 2.2
  o[55] hn[59] # 2.2
  o[56] hn[60] # 2.2
  o[57] hn[61] # 2.2
  o[58] hn[62] # 2.2
  o[59] hn[63] # 2.2
  o[60] hn[64] # 2.2
  o[61] hn[65] # 2.2
  o[62] hn[66] # 2.2
  o[65] hn[68] # 2.2           
  o[66] hn[69] # 2.2
  o[67] hn[70] # 2.2
  o[68] hn[71] # 2.2
  o[69] hn[72] # 2.2
  og[73] hn[76] # 2.2           
  o[73] hn[77] # 2.2
  o[74] hn[78] # 2.2
  o[75] hn[79] # 2.2
  o[76] hn[80] # 2.2
  o[77] hn[81] # 2.2
  o[78] hn[82] # 2.2
  o[79] hn[83] # 2.2
  o[80] hn[84] # 2.2
  o[81] hn[85] # 2.2
  o[82] hn[86] # 2.2
  o[83] hn[87] # 2.2
  o[84] hn[88] # 2.2
  o[85] hn[89] # 2.2
  o[86] hn[90] # 2.2
  o[87] hn[91] # 2.2
  o[88] hn[93] # 2.2    
  o[89] hn[92] # 2.2   
  hn[21] o[96] # 2.2
  o[21] hn[98] # 2.2
  od1[97] hn[100] # 2.2         
  o[97] hn[101] # 2.2
  o[98] hn[102] # 2.2
  o[99] hn[103] # 2.2
  o[100] hn[104] # 2.2
  o[101] hn[105] # 2.2
  o[102] hn[106] # 2.2
  o[103] hn[107] # 2.2
  o[104] hn[109] # 2.2           
  o[105] hn[108] # 2.2       
  o[48] hn[52] # 2.2
  o[49] hn[53] # 2.2
  o[50] hn[54] # 2.2
  od1[48] hn[51] # 2.2
  hg1[54] o[51] # 2.2
  hn[31] nd1[34] # 2.2    
  od1[81] hg1[82] # 2.2    
  hh[80] oe1[66] # 2.2     
RESTRAINTS FROM NMR NUCLEAR OVERHAUSER EFFECT (NOE).
     NOE INTENSITY        INTENSITY STRENGTHS IN ANGSTROM 
         Strong                      1.8-2.7
         Medium                      1.8-3.3
         Weak                        1.8-5.0
               +0.5A for NOEs involving methyls (md)
          LB = Lower Bound
          UB = Upper Bound
  ATOM 1  ATOM 2  LB UB
  hn[11] hn[12] 1.8 5.0       
  hn[12] hn[13] 1.8 5.0        
  hn[13] hn[14] 1.8 2.7
  hn[14] hn[15] 1.8 2.7
  hn[15] hn[16] 1.8 2.7
  hn[16] hn[17] 1.8 2.7
  hn[17] hn[18] 1.8 2.7
  hn[19] hn[20] 1.8 2.7
  hn[11] hn[13] 1.8 5.0
  hn[12] hn[14] 1.8 5.0
  hn[13] hn[15] 1.8 5.0
  hn[14] hn[16] 1.8 5.0
  hn[15] hn[17] 1.8 5.0
  hn[16] hn[18] 1.8 5.0
  hn[17] hn[19] 1.8 5.0
  hn[10] hn[13] 1.8 5.0
  hn[12] hn[15] 1.8 5.0
  hn[13] hn[16] 1.8 5.0
  hn[14] hn[17] 1.8 5.0
  hn[10] hn[14] 1.8 5.0         
  ha[9] hn[10] 1.8 3.3;          
  ha[10] hn[11] 1.8 2.7          
  has[11] hn[12] 1.8 3.3
  har[12] hn[15] 1.8 5.0
  ha[13] hn[16] 1.8 5.0
  ha[14] hn[17] 1.8 5.0
  ha[15] hn[18] 1.8 5.0
  ha[13] hn[17] 1.8 5.0
  har[12] hbr[15] 1.8 3.3      
  ha[13] hbr[16] 1.8 3.3
  ha[13] hbs[16] 1.8 3.3
  ha[14] hbr[17] 1.8 3.3
  ha[14] hbs[17] 1.8 3.3
  ha[15] hbr[18] 1.8 3.3         
  ha[20] hn[21] 1.8 2.7
  ha[21] hn[22] 1.8 2.7
  ha[30] hn[31] 1.8 2.7
  ha[29] hn[30] 1.8 2.7
  ha[28] hn[29] 1.8 2.7
  ha[21] ha[29] 1.8 2.7
  hn[22] ha[29] 1.8 5.0
  hn[30] ha[21] 1.8 5.0
  hn[26] hn[28] 1.8 5.0    
  hn[30] hn[20] 1.8 5.0    
  hn[23] hn[26] 1.8 5.0     
  hn[28] hn[23] 1.8 5.0    
  hn[27] hn[28] 1.8 3.3     
  ha[23] hdr[24] 1.8 2.7
  ha[23] hds[24] 1.8 2.7
  hn[28] mdr[22] 1.8 5.5    
  hn[31] mds[22] 1.8 5.5
  hn[29] mdr[22] 1.8 5.5
  hn[28] mdr[22] 1.8 5.5
  hn[26] hbr[23] 1.8 3.3   
  hn[26] hgr[23] 1.8 3.3  
  ha[23] hbr[23] 1.8 2.7
  ha[23] hbs[23] 1.8 2.7
  hn[23] mdr[22] 1.8 5.5
  hn[23] hg[22] 1.8 5.0
  hn[20] hd1[30] 1.8 5.0
  hn[32] hn[33] 1.8 2.7
  hn[33] hn[34] 1.8 2.7
  hn[34] hn[35] 1.8 2.7
  hn[35] hn[36] 1.8 2.7
  hn[36] hn[37] 1.8 2.7
  hn[37] hn[38] 1.8 2.7      
  hn[38] hn[39] 1.8 2.7         
  hn[39] hn[40] 1.8 2.7
  hn[40] hn[41] 1.8 2.7
  hn[41] hn[42] 1.8 2.7
  hn[42] hn[43] 1.8 2.7
  hn[43] hn[44] 1.8 2.7
  hn[44] hn[45] 1.8 2.7
  hn[45] hn[46] 1.8 2.7
  hn[31] hn[33] 1.8 5.0
  hn[32] hn[34] 1.8 5.0
  hn[33] hn[35] 1.8 5.0
  hn[34] hn[36] 1.8 5.0
  hn[35] hn[37] 1.8 5.0
  hn[37] hn[39] 1.8 5.0
  hn[38] hn[40] 1.8 5.0
  hn[40] hn[42] 1.8 5.0
  hn[41] hn[43] 1.8 5.0
  hn[42] hn[44] 1.8 5.0
  hn[43] hn[45] 1.8 5.0
  hn[44] hn[46] 1.8 5.0
  hn[45] hn[47] 1.8 5.0
  hn[31] hn[34] 1.8 5.0
  hn[32] hn[35] 1.8 5.0
  hn[33] hn[36] 1.8 5.0
  hn[37] hn[40] 1.8 5.0
  hn[39] hn[42] 1.8 5.0
  hn[41] hn[44] 1.8 5.0
  hn[42] hn[45] 1.8 5.0
  ha[31] hn[32] 1.8 2.7      
  ha[31] hn[34] 1.8 5.0
  ha[32] hn[35] 1.8 5.0
  ha[33] hn[36] 1.8 5.0
  ha[34] hn[37] 1.8 5.0
  ha[35] hn[38] 1.8 5.0
  ha[36] hn[39] 1.8 5.0
  ha[37] hn[40] 1.8 5.0
  ha[41] hn[44] 1.8 5.0
  ha[42] hn[45] 1.8 5.0
  ha[43] hn[46] 1.8 5.0
  ha[32] hb[35] 1.8 3.3
  ha[33] hb[36] 1.8 2.7      
  ha[34] hbr[37] 1.8 3.3
  ha[34] hbs[37] 1.8 3.3
  ha[35] mb[38] 1.8 3.8
  ha[37] hbr[40] 1.8 3.3       
  ha[38] hbr[41] 1.8 3.3
  ha[38] hbs[41] 1.8 3.3
  ha[39] hbr[42] 1.8 3.3
  ha[39] hbs[42] 1.8 3.3
  ha[42] hbs[45] 1.8 3.3
  hn[55] hn[56] 1.8 5.0
  hn[56] hn[57] 1.8 2.7
  hn[57] hn[58] 1.8 2.7
  hn[58] hn[59] 1.8 2.7
  hn[59] hn[60] 1.8 2.7
  hn[60] hn[61] 1.8 2.7
  hn[61] hn[62] 1.8 2.7
  hn[62] hn[63] 1.8 2.7
  hn[63] hn[64] 1.8 2.7
  hn[64] hn[65] 1.8 2.7
  hn[65] hn[66] 1.8 2.7
  hn[54] hn[56] 1.8 5.0
  hn[55] hn[57] 1.8 5.0
  hn[56] hn[58] 1.8 5.0
  hn[58] hn[60] 1.8 5.0
  hn[60] hn[62] 1.8 5.0
  hn[61] hn[63] 1.8 5.0
  hn[64] hn[66] 1.8 5.0
  hn[54] hn[57] 1.8 5.0
  hn[54] hn[58] 1.8 5.0          
  ha[54] hn[55] 1.8 2.7          
  ha[56] hn[59] 1.8 5.0
  har[57] hn[60] 1.8 5.0
  ha[59] hn[62] 1.8 5.0
  ha[60] hn[63] 1.8 5.0
  ha[61] hn[64] 1.8 5.0
  ha[62] hn[65] 1.8 5.0
  har[63] hn[66] 1.8 5.0        
  ha[55] hbr[58] 1.8 3.3
  ha[55] hbs[58] 1.8 5.0         
  ha[56] hbr[59] 1.8 3.3
  ha[56] hbs[59] 1.8 3.3
  har[57] hbr[60] 1.8 3.3
  har[57] hbs[60] 1.8 3.3
  ha[58] hb[61] 1.8 3.3
  ha[59] hbr[62] 1.8 3.3
  ha[59] hbs[62] 1.8 3.3
  ha[61] hbr[64] 1.8 3.3
  ha[61] hbs[64] 1.8 3.3
  ha[62] hbr[65] 1.8 3.3          
  har[63] hbr[66] 1.8 5.0
  has[72] hn[73] 1.8 3.3    
  hn[68] hn[69] 1.8 2.7
  hn[69] hn[70] 1.8 2.7
  hn[70] hn[71] 1.8 2.7
  hn[71] hn[72] 1.8 2.7
  hn[72] hn[73] 1.8 2.7
  ha[67] hn[69] 1.8 5.0
  ha[66] hn[68] 1.8 5.0           
  ha[70] hn[72] 1.8 5.0
  ha[65] hn[68] 1.8 5.0
  ha[68] hn[71] 1.8 5.0          
  ha[69] hn[72] 1.8 5.0
  hn[68] hds[67] 1.8 3.3
  hbr[66] hdr[67] 1.8 2.7
  ha[66] he1[80] 1.8 3.3
  hgs[66] he1[80] 1.8 3.3
  hbs[66] he1[80] 1.8 5.0
  hbr[66] hn[66] 1.8 3.3            
  hn[66] he1[80] 1.8 3.3            
  hn[66] hd1[80] 1.8 5.0              
  mds[76] ha[76] 1.8 3.2
  mds[76] hbr[79] 1.8 3.8
  mds[76] hbs[79] 1.8 3.3
  mdr[76] har[72] 1.8 3.8
  mdr[76] ha[69] 1.8 3.2
  mdr[76] hn[69] 1.8 5.5
  mdr[76] hn[73] 1.8 3.8             
  mdr[76] hn[68] 1.8 5.5
  mdr[76] hn[72] 1.8 3.8             
  hbr[76] hn[73] 1.8 3.3             
  hbs[76] hn[73] 1.8 3.3
  mds[69] hn[72] 1.8 5.5
  mds[69] hn[80] 1.8 5.5
  mds[69] ha[77] 1.8 3.2
  hn[69] hg[69] 1.8 2.7
  has[72] hn[72] 1.8 2.7    
  has[72] hn[72] 1.8 2.7
  ha[68] mg2[71] 1.8 3.2
  hn[71] mg2[71] 1.8 3.2
  hn[74] hn[75] 1.8 2.7
  hn[75] hn[76] 1.8 2.7
  hn[76] hn[77] 1.8 2.7
  hn[77] hn[78] 1.8 2.7
  hn[78] hn[79] 1.8 2.7
  hn[79] hn[80] 1.8 2.7
  hn[80] hn[81] 1.8 2.7
  hn[81] hn[82] 1.8 2.7
  hn[83] hn[84] 1.8 2.7
  hn[84] hn[85] 1.8 2.7
  hn[85] hn[86] 1.8 2.7
  hn[86] hn[87] 1.8 2.7
  hn[87] hn[88] 1.8 2.7
  hn[88] hn[89] 1.8 2.7
  hn[89] hn[90] 1.8 2.7
  hn[90] hn[91] 1.8 2.7
  hn[91] hn[92] 1.8 2.7
  hn[92] hn[93] 1.8 2.7          
  hn[74] hn[76] 1.8 5.0
  hn[75] hn[77] 1.8 5.0
  hn[76] hn[78] 1.8 5.0
  hn[77] hn[79] 1.8 5.0
  hn[78] hn[80] 1.8 5.0
  hn[79] hn[81] 1.8 5.0
  hn[80] hn[82] 1.8 5.0
  hn[83] hn[85] 1.8 5.0
  hn[84] hn[86] 1.8 5.0
  hn[85] hn[87] 1.8 5.0
  hn[86] hn[88] 1.8 5.0
  hn[87] hn[89] 1.8 5.0
  hn[88] hn[90] 1.8 5.0
  hn[89] hn[91] 1.8 5.0
  hn[90] hn[92] 1.8 5.0
  hn[91] hn[93] 1.8 5.0
  hn[73] hn[76] 1.8 5.0
  hn[74] hn[77] 1.8 5.0
  hn[76] hn[79] 1.8 5.0
  hn[77] hn[80] 1.8 5.0
  hn[78] hn[81] 1.8 5.0
  hn[79] hn[82] 1.8 5.0
  hn[82] hn[85] 1.8 5.0
  hn[84] hn[87] 1.8 5.0
  hn[85] hn[88] 1.8 5.0
  hn[87] hn[90] 1.8 5.0
  hn[88] hn[91] 1.8 5.0
  ha[73] hn[74] 1.8 2.7        
  ha[74] hn[77] 1.8 5.0
  ha[76] hn[79] 1.8 5.0
  ha[77] hn[80] 1.8 5.0
  ha[79] hn[82] 1.8 5.0
  ha[81] hn[84] 1.8 5.0
  ha[83] hn[86] 1.8 5.0
  ha[87] hn[90] 1.8 5.0
  ha[88] hn[91] 1.8 5.0
  ha[89] hn[92] 1.8 5.0
  ha[74] hbr[77] 1.8 3.3         
  ha[75] hbr[78] 1.8 3.3        
  ha[76] hbr[79] 1.8 3.3
  ha[76] hbs[79] 1.8 3.3
  ha[77] hbr[80] 1.8 3.3
  ha[77] hbs[80] 1.8 3.3
  ha[80] hb[83] 1.8 3.3
  ha[81] mb[84] 1.8 3.8
  ha[82] hb[85] 1.8 3.3
  ha[83] hbr[86] 1.8 3.3
  ha[83] hbs[86] 1.8 3.3
  ha[84] hbr[87] 1.8 3.3
  ha[84] hbs[87] 1.8 3.3
  ha[85] hbs[88] 1.8 3.3
  ha[86] hb[89] 1.8 3.3
  ha[87] hbs[90] 1.8 3.3
  ha[88] hbr[91] 1.8 3.3         
  ha[86] mgs[89] 1.8 3.8
  hb[93] hbr[88] 1.8 3.3 
  hb[93] ha[88] 1.8 2.7  
  hn[93] hbr[88] 1.8 5.0
  hn[96] hn[97] 1.8 2.7
  ha[93] hn[94] 1.8 2.7
  ha[94] hn[95] 1.8 2.7
  ha[95] hn[96] 1.8 2.7
  ha[101] mgs[95] 1.8 5.5   
  ha[101] mgr[95] 1.8 3.2   
  mb[101] mgs[95] 1.8 3.2   
  mb[101] mgr[95] 1.8 3.8   
  ha[20] ha[96] 1.8 5.0
  ha[20] ha[97] 1.8 5.0
  ha[21] ha[97] 1.8 5.0
  ha[97] hn[98] 1.8 2.7
  hn[21] ha[97] 1.8 2.7
  hn[98] ha[22] 1.8 5.0
  hn[21] hn[98] 1.8 5.0
  hn[21] hn[97] 1.8 5.0
  hn[97] hbr[97] 1.8 2.7
  ha[97] mg2[20] 1.8 3.8
  hn[97] mg2[20] 1.8 5.5
  hn[98] mg2[20] 1.8 5.5
  hn[98] hn[99] 1.8 3.3
  hn[99] hn[100] 1.8 2.7
  hn[100] hn[101] 1.8 2.7
  hn[101] hn[102] 1.8 2.7
  hn[102] hn[103] 1.8 2.7
  hn[103] hn[104] 1.8 2.7
  hn[105] hn[106] 1.8 2.7
  hn[107] hn[108] 1.8 2.7
  hn[108] hn[109] 1.8 2.7
  hn[99] hn[101] 1.8 5.0
  hn[100] hn[102] 1.8 5.0
  hn[101] hn[103] 1.8 5.0
  hn[103] hn[105] 1.8 5.0
  hn[104] hn[106] 1.8 5.0
  hn[97] hn[100] 1.8 5.0
  hn[99] hn[102] 1.8 5.0
  hn[100] hn[103] 1.8 5.0
  hn[101] hn[104] 1.8 5.0
  hn[103] hn[106] 1.8 5.0
  ha[98] hn[101] 1.8 5.0
  ha[100] hn[103] 1.8 5.0
  ha[102] hn[105] 1.8 5.0
  ha[105] hn[108] 1.8 5.0
  ha[105] ha[109] 1.8 5.0
  ha[105] hbr[109] 1.8 3.3
  ha[105] hbs[109] 1.8 3.3
  ha[105] hn[109] 1.8 3.3        
  ha[98] mb[101] 1.8 3.8
  ha[99] hbr[102] 1.8 3.3
  ha[99] hbs[102] 1.8 3.3
  ha[100] hbr[103] 1.8 3.3
  ha[100] hbs[103] 1.8 3.3
  ha[101] hbr[104] 1.8 3.3
  ha[101] hbs[104] 1.8 3.3
  ha[102] hb[105] 1.8 3.3
  ha[103] hbr[106] 1.8 3.3
  ha[103] hbs[106] 1.8 3.3
  ha[104] hbr[107] 1.8 3.3       
  ha[104] hbs[107] 1.8 3.3
  hn[33] he1[17] 1.8 5.0     
  mdr[9] hd1[17] 1.8 5.5
  mdr[9] he3[17] 1.8 5.5
  mdr[9] hn[14] 1.8 5.5
  mdr[9] hn[17] 1.8 5.5
  hz3[17] ha[86] 1.8 2.7
  mdr[86] hz3[17] 1.8 3.8     
  mdr[86] hh2[17] 1.8 5.5
  mdr[86] he3[17] 1.8 5.5
  md1[35] he1[17] 1.8 5.5     
  md1[35] hd1[17] 1.8 5.5
  md1[35] hh2[17] 1.8 5.5
  md1[35] hz2[17] 1.8 5.5
  hg1s[35] he1[17] 1.8 5.5
  hg1s[35] hz2[17] 1.8 5.5
  mgr[89] hn[17] 1.8 5.5      
  mgr[89] ha[17] 1.8 5.5
  mgs[89] he3[17] 1.8 3.2
  mgr[89] he3[17] 1.8 5.5     
  mgs[89] hz3[17] 1.8 5.5
  mgr[89] hz3[17] 1.8 5.5
  he1[17] hn[31] 1.8 5.0
  he1[17] hn[32] 1.8 5.0
  he1[17] hn[35] 1.8 5.0
  he1[17] ha[31] 1.8 5.0     
  he1[17] ha[32] 1.8 5.0     
  hd1[17] ha[31] 1.8 5.0     
  hd1[17] ha[32] 1.8 5.0     
  hn[32] hd1[17] 1.8 5.0
  md1[20] he3[17] 1.8 3.8
  md1[20] hn[17] 1.8 5.5
  md1[20] ha[17] 1.8 3.2
  mgr[85] hz3[17] 1.8 3.2
  mgs[85] hz3[17] 1.8 5.5
  mgr[85] hh2[17] 1.8 5.5
  mgr[85] he3[17] 1.8 5.5
  hz2[17] hd1[30] 1.8 3.3
  he1[17] hbs[30] 1.8 5.0
  ha[14] hd1[17] 1.8 5.0
  hn[18] hd1[17] 1.8 5.0
  mgs[85] he1[30] 1.8 5.5
  mgr[85] he1[30] 1.8 5.5
  md1[20] hd1[30] 1.8 5.5
  mg2[20] hd1[30] 1.8 5.5
  mg2[20] he1[30] 1.8 3.8
  mgs[85] he1[30] 1.8 3.2
  mgs[85] hd1[30] 1.8 5.5
  mgr[85] hd1[30] 1.8 5.5
  mgr[85] he1[30] 1.8 5.5
  hn[20] hd1[30] 1.8 5.0
  hn[30] mg2[20] 1.8 5.0     
  hn[30] hd2[30] 1.8 2.7
  mds[22] hd2[30] 1.8 3.2
  mds[22] he2[30] 1.8 3.2
  mds[22] ha[30] 1.8 5.5    
  mds[22] hn[30] 1.8 5.5
  he1[30] ha[82] 1.8 3.3     
  hn[82] he1[30] 1.8 5.0
  he2[30] ha[22] 1.8 5.0     
  hn[98] he2[30] 1.8 5.0      
  hg1[98] he2[30] 1.8 3.3    
  hg1[82] he1[30] 1.8 5.0
  mg2[82] hd1[30] 1.8 3.8
  mg2[82] he1[30] 1.8 3.8
  he1[34] hd2[30] 1.8 5.0
  he1[34] ha[30] 1.8 2.7
  mds[22] he1[34] 1.8 5.5      
  mdr[22] he1[34] 1.8 5.5     
  hn[38] he3[37] 1.8 2.7
  hn[79] hh2[37] 1.8 3.2    
  ha[79] hz3[37] 1.8 3.2
  hz3[37] mdr[79] 1.8 3.8
  hh2[37] mds[79] 1.8 5.5
  hz2[37] mds[79] 1.8 5.5
  hn[79] hz2[37] 1.8 5.5
  hn[79] hz3[37] 1.8 5.5
  ha[79] hh2[37] 1.8 5.5
  hn[82] hz3[37] 1.8 5.0
  hz3[37] hg1[82] 1.8 5.0
  hz3[37] mb[38] 1.8 5.5
  cz[45] mdr[65] 1.8 6.3   
  cz[45] mds[76] 1.8 6.3    
  cz[45] mdr[76] 1.8 6.3     
  cz[45] hg[79] 1.8 6.3    
  mdr[62] hd1[80] 1.8 3.2   
  mdr[62] he1[80] 1.8 3.2    
  hd2[80] mb[84] 1.8 5.5
  he2[80] mb[84] 1.8 5.5
  mdr[69] hd1[80] 1.8 3.2
  hbs[65] hd1[80] 1.8 5.0   
  mds[65] hd1[80] 1.8 3.2
  mds[102] he2[80] 1.8 3.2
  mds[102] hd2[80] 1.8 3.8
  he1[80] ha[66] 1.8 3.3
  ha[80] mdr[62] 1.8 5.5
  ha[80] mds[65] 1.8 3.8
  hbs[80] mds[69] 1.8 3.8   
  hd1[87] ha[55] 1.8 5.0      
  he1[87] ha[55] 1.8 5.0     
  mds[62] hd1[87] 1.8 5.5
  hd2[87] hn[59] 1.8 3.3   
  he2[87] hn[59] 1.8 5.0
  he2[87] hn[60] 1.8 5.0
  hd2[87] ha[55] 1.8 5.5     
  he2[87] ha[55] 1.8 3.3    
  he2[87] hbr[55] 1.8 5.0
  he2[87] hbs[55] 1.8 5.0
  hd2[87] ha[59] 1.8 3.3    
  he2[87] ha[59] 1.8 5.0
  md1[83] hn[87] 1.8 5.5
  mg2[83] hn[87] 1.8 5.5
  ha[84] hbr[87] 1.8 5.0    
  hn[88] hbr[87] 1.8 2.7
  hd2[90] ha[55] 1.8 3.3
  hd2[90] hg[86] 1.8 3.3     
  hd2[90] mds[86] 1.8 5.5  
  hd2[90] mdr[86] 1.8 5.5
  he1[90] mdr[86] 1.8 5.5     
  he1[90] mds[9] 1.8 3.8      
  hn[90] mdr[86] 1.8 5.5      
  hn[90] hg[86] 1.8 5.0
  hn[90] hb[89] 1.8 3.3        
  hd2[90] hn[58] 1.8 5.0
  hn[90] hd1[87] 1.8 5.0
  hd2[90] hbs[90] 1.8 2.7 
  hd2[90] ha[87] 1.8 3.3
  mds[9] hn[10] 1.8 3.8
  mdr[9] hn[14] 1.8 5.5
  mdr[9] hn[17] 1.8 5.5
  md1[35] mdr[9] 1.8 3.2     
  mgr[89] mds[9] 1.8 3.8      
  hn[9] hg[9] 1.8 3.3
  mgr[85] mg2[20] 1.8 5.5
  mgr[85] md1[20] 1.8 5.5
  ha[98] mg2[20] 1.8 5.0
  md1[35] mds[86] 1.8 3.2      
  md1[35] mdr[86] 1.8 3.2     
  hn[35] hb[35] 1.8 2.7
  hn[35] hg1s[35] 1.8 5.0  
  mg2[82] ha[35] 1.8 5.5    
  mg2[82] hg1r[35] 1.8 5.5   
  mg2[82] hg1s[35] 1.8 5.5
  mg2[82] md1[35] 1.8 5.5
  ha[62] mdr[62] 1.8 3.2
  mdr[62] hn[84] 1.8 3.8
  mds[62] mb[84] 1.8 3.8
  mdr[62] mb[84] 1.8 3.8
  mds[65] mdr[62] 1.8 5.5
  mg2[83] mdr[62] 1.8 3.2
  mds[62] hbr[87] 1.8 5.5
  mds[62] hbs[87] 1.8 5.5
  hbs[45] mdr[65] 1.8 5.5
  ha[65] mdr[65] 1.8 3.8    
  mg2[83] mds[65] 1.8 3.8
  hn[80] mds[65] 1.8 5.5
  ha[79] mdr[79] 1.8 3.2
  ha[79] mds[79] 1.8 5.5
  mds[79] hbr[41] 1.8 5.5     
  mds[79] hbs[41] 1.8 5.5    
  hn[86] mgr[85] 1.8 3.8
  hn[85] mgs[85] 1.8 3.8      
  hn[85] hb[85] 1.8 2.7      
  ha[98] mgs[85] 1.8 5.5   
  mb[101] mgs[85] 1.8 3.2    
  mgr[85] mgs[89] 1.8 3.2  
  mb[101] hn[85] 1.8 5.5
  mb[101] ha[85] 1.8 3.8      
  mgs[89] mdr[86] 1.8 5.5 
  ha[83] mds[86] 1.8 5.5
  mds[86] md1[83] 1.8 5.5
  mgs[89] hn[89] 1.8 3.2
  hn[89] hb[89] 1.8 2.7
  mb[101] mb[84] 1.8 5.5      
  mb[101] hbr[88] 1.8 5.5
  mb[101] hbs[88] 1.8 5.5     
  ha[102] mb[84] 1.8 3.8     
  hb[105] hg[102] 1.8 5.0
  hg1[98] ha[22] 1.8 3.3
  hd2e[81] mg2[98] 1.8 5.5
  hd2e[81] ha[98] 1.8 5.0
  hn[82] hg1[82] 1.8 3.2   
  hg1[98] hn[98] 1.8 3.3     
  hn[10] hbr[13] 1.8 3.3  
  hn[13] hbr[13] 1.8 2.7  
  ha[13] hbs[13] 1.8 3.3   
  hbs[13] mds[9] 1.8 5.5  
  ha[13] hgr[13] 1.8 5.0    
  ha[13] hgs[13] 1.8 2.7    
  hgs[13] mgr[89] 1.8 5.5 
  hgr[13] hn[13] 1.8 2.7   
  ha[13] mgr[89] 1.8 3.8   
  hg[9] md1[35] 1.8 5.5
  hbr[17] mdr[9] 1.8 5.5      
  hn[18] hbr[17] 1.8 3.3     
  hz2[17] ha[35] 1.8 3.3  
  ha[14] mdr[9] 1.8 3.8   
  hbs[14] mdr[9] 1.8 5.5
  hbs[14] ha[14] 1.8 3.3   
  hn[15] hbr[14] 1.8 3.3   
  mdr[9] mds[14] 1.8 5.5   
  mdr[9] mdr[14] 1.8 5.5  
  mds[14] hbr[9] 1.8 5.5    
  mds[14] hbs[9] 1.8 5.5   
  ha[14] mdr[14] 1.8 3.2    
  hn[18] mdr[14] 1.8 5.5   
  hn[15] mdr[14] 1.8 5.5    
  mdr[14] hd1[17] 1.8 5.5   
  ha[36] mgr[36] 1.8 3.2  
  ha[36] mgs[36] 1.8 3.2
  hn[37] mgr[36] 1.8 5.5  
  mg2[35] mgs[36] 1.8 3.8 
  ha[36] mg2[35] 1.8 3.8  
  hn[36] mgs[36] 1.8 3.2 
  hn[36] mg2[35] 1.8 3.2 
  hn[36] hb[35] 1.8 5.0   
  hdr[40] mgr[36] 1.8 5.5  
  hn[36] hb[36] 1.8 2.7  
  ha[32] mg2[35] 1.8 3.8  
  mg2[35] mdr[32] 1.8 3.8 
  md1[35] mdr[32] 1.8 3.8  
  ha[32] mdr[32] 1.8 3.2   
  ha[32] hbr[32] 1.8 3.3 
  hn[32] hbs[32] 1.8 3.3  
  he1[17] mdr[32] 1.8 5.5  
  hd1[17] mdr[32] 1.8 5.5
  ha[102] mb[84] 1.8 3.8     
  mb[84] mdr[102] 1.8 3.2       
  ha[81] mdr[102] 1.8 5.5         
  mg2[105] mdr[102] 1.8 5.5     
  ha[102] mdr[102] 1.8 3.2
  ha[105] md1[105] 1.8 3.2    
  md1[105] mb[101] 1.8 5.5  
  mg2[105] mds[62] 1.8 3.2
  mg2[105] ha[84] 1.8 3.2     
  mg2[105] mb[84] 1.8 3.2    
  mg2[105] hd1[87] 1.8 5.5    
  md1[105] ha[88] 1.8 5.5     
  md1[105] hbs[88] 1.5 5.5
  hbr[87] mg2[105] 1.8 3.8    
  mg2[105] hn[88] 1.8 5.5       
  ha[88] hg1s[105] 1.8 5.0
  md1[105] ha[101] 1.8 5.5
  mdr[65] mdr[76] 1.8 3.8      
  hgs[41] mds[79] 1.8 5.5         
  hgr[41] mds[79] 1.8 5.5
  hgs[41] mdr[79] 1.8 5.5
  hgr[41] mdr[79] 1.8 5.5
  hgs[41] cz[45] 1.8 6.3
  hgr[41] cz[45] 1.8 6.3
  mb[38] mg2[82] 1.8 3.2      
  ha[82] mg2[82] 1.8 3.2
  mb[38] ha[79] 1.8 5.5   
  mds[62] ha[84] 1.8 3.2  
  mdr[62] ha[84] 1.8 5.5     
  mg2[98] hbs[81] 1.8 3.8     
  mg2[98] ha[81] 1.8 5.5     
  hn[43] hbs[42] 1.8 5.0   
  hn[43] hg[42] 1.8 3.3  
  hn[43] mds[42] 1.8 3.8   
  ha[42] mdr[42] 1.8 3.8   
  mdr[42] mdr[65] 1.8 5.5   
  hb[61] mds[42] 1.8 5.5  
  hbr[65] mdr[42] 1.8 5.5   
  ha[42] hbs[42] 1.8 3.3    
  mds[42] hbr[42] 1.8 3.8     
  hn[84] mg2[83] 1.8 3.8        
  ha[83] mg2[83] 1.8 3.8       
  hn[62] mg2[83] 1.8 5.5        
  mg2[83] hbr[62] 1.8 3.2     
  mg2[83] mdr[62] 1.8 3.2       
  hb[83] mdr[62] 1.8 5.5      
  hb[83] mg2[83] 1.8 3.8        
  hb[83] ha[62] 1.8 5.0        
  mds[65] md1[83] 1.8 5.5
  mds[65] mg2[83] 1.8 5.5    
  md1[61] hn[61] 1.8 3.8     
  md1[61] hn[60] 1.8 5.5  
  mg2[61] mdr[65] 1.8 3.8  
  mg2[61] mdr[62] 1.8 5.5
  mg2[61] ha[61] 1.8 3.2   
  md1[61] ha[61] 1.8 3.2  
  mg2[61] ha[62] 1.8 5.5 
  mg2[61] hn[62] 1.8 3.8   
  mg2[61] hbr[65] 1.8 5.5
  md1[61] ha[58] 1.8 5.5   
  hn[62] hb[61] 1.8 3.8   
  hn[61] hb[61] 1.8 2.7
  hn[45] hn[46] 1.8 2.7 
  hn[46] hn[47] 1.8 2.7
  hn[47] hn[48] 1.8 5.5 
  hn[50] hn[51] 1.8 2.7 
  hn[50] hn[52] 1.8 5.0 
  hn[51] hn[52] 1.8 2.7 
  hn[53] hn[52] 1.8 2.7 
  hn[53] hn[51] 1.8 5.0
  hn[51] hn[48] 1.8 5.0 
  has[50] hn[51] 1.8 5.0 
  har[50] hn[53] 1.8 5.0 
  hn[50] hbr[49] 1.8 2.7  
  hn[46] mgs[47] 1.8 5.5  
  hn[46] mb[46] 1.8 3.2
  ha[49] mds[42] 1.8 3.8  
  ha[49] hbs[49] 1.8 2.7
  hbs[49] mds[42] 1.8 5.5
  hbr[49] har[50] 1.8 5.0
  har[50] hbr[53] 1.8 3.3
  hn[57] hbr[56] 1.8 3.3 
  hn[57] hbs[56] 1.8 3.3
  hn[57] hgr[56] 1.8 5.0 
  hgr[43] mds[42] 1.8 5.5
  ha[43] mds[42] 1.8 3.8    
  hn[39] mb[38] 1.8 2.7
  ha[48] hdr[49] 1.8 2.7
  ha[48] hds[49] 1.8 2.7
  hn[47] mb[46] 1.8 5.5    
  ha[47] hn[48] 1.8 2.7
  ha[47] mb[46] 1.8 5.5 
  ha[47] mgr[47] 1.8 3.2 
  ha[47] mgs[47] 1.8 3.3
  mgs[47] md1[61] 1.8 3.2
  hn[48] hb[47] 1.8 3.8
  hn[48] mgr[47] 1.8 3.2
  mb[46] mgs[47] 1.8 5.5 
  mgs[47] hbs[45] 1.8 3.8
  mgs[47] hbr[45] 1.8 3.8
  hn[47] mgs[47] 1.8 3.2
  hn[47] hb[47] 1.8 2.7 
  hb[47] mds[42] 1.8 3.2  
  hb[47] ha[42] 1.8 5.0
  hn[47] hbr[45] 1.8 5.0
  hn[47] hbs[45] 1.8 5.0
  mgs[47] mdr[65] 1.8 5.5  
  ha[42] mgs[47] 1.8 5.5  
  hn[53] har[50] 1.8 5.0
  hn[51] ha[49] 1.8 5.0
  ha[51] hn[54] 1.8 5.0
  hn[71] mdr[76] 1.8 5.5
  hn[70] hbr[69] 1.8 2.7
  hn[70] hbs[70] 1.8 2.7
  hn[70] hgr[70] 1.8 3.3   
  hn[71] hgr[70] 1.8 3.3   
  mg2[71] hbr[70] 1.8 5.5  
  mg2[71] hgs[70] 1.8 3.8 
  hbr[68] mdr[76] 1.8 5.5  
  ha[65] mdr[76] 1.8 5.5 
  ha[65] mds[76] 1.8 5.5
  hn[72] mg2[71] 1.8 5.5
  hn[55] hbr[90] 1.8 5.0
  hn[55] hbs[90] 1.8 5.0   
  ha[55] hbs[90] 1.8 5.0
  ha[55] hbr[90] 1.8 5.0
  hn[50] har[50] 1.8 5.0 
  hn[50] has[50] 1.8 2.7
  mds[69] mdr[76] 1.8 3.8  
  mds[69] hbr[80] 1.8 3.8 
  mds[69] hbs[80] 1.8 3.8 
  mds[69] hbr[77] 1.8 5.5  
  hbs[42] hb[47] 1.8 5.0   
  mgs[47] mb[46] 1.8 5.5
  mgr[47] ha[61] 1.8 5.5
  ha[42] hg[42] 1.8 3.3  
  hbs[51] mdr[51] 1.8 3.2 
  hbs[51] mds[51] 1.8 5.5
  hbr[51] ha[51] 1.8 5.0  
  hn[50] hbr[51] 1.8 5.0      
  hn[57] mds[51] 1.8 5.5  
  hbr[48] mdr[51] 1.8 3.8 
  hbr[48] hbr[51] 1.8 5.0
  mds[51] ha[51] 1.8 3.2  
  mds[51] har[57] 1.8 3.8 
  mdr[51] hn[48] 1.8 3.2 
  hbr[52] mds[42] 1.8 3.8  
  hn[53] mdr[52] 1.8 3.8  
  ha[49] hbr[52] 1.8 5.0  
  hn[52] ha[49] 1.8 5.0 
  mds[52] mds[86] 1.8 3.8  
  mdr[52] ha[39] 1.8 3.8  
  mdr[52] hbs[39] 1.8 3.8 
  mds[52] ha[58] 1.8 5.5
  mds[52] hn[58] 1.8 5.5  
  mds[42] hg[52] 1.8 3.8 
  hg[52] hbr[52] 1.8 2.7
  hg[52] hbs[52] 1.8 2.7
  hg[52] ha[52] 1.8 5.0 
  md1[61] hbs[52] 1.8 5.5  
  hn[53] hn[54] 1.8 2.7 
  mg2[54] hn[55] 1.8 5.5 
  mg2[54] hn[53] 1.8 5.5  
  hgr[53] mg2[54] 1.8 5.5
  hbr[53] mg2[54] 1.8 5.5 
  hbr[56] mg2[54] 1.8 5.5 
  mg2[54] hn[54] 1.8 3.2  
  mg2[54] ha[54] 1.8 3.2
  mgr[8] md1[35] 1.8 5.5  
  mgr[8] mdr[9] 1.8 5.5  
  ha[8] mgr[8] 1.9 3.2
  ha[8] mgs[8] 1.8 3.2 
  hn[8] mgs[8] 1.8 3.2
  hn[9] mgr[8] 1.8 3.8    
  hn[9] hb[8] 1.8 2.7  
  hn[8] hb[8] 1.8 3.3   
  ha[8] hb[8] 1.8 5.0   
  hn[8] hbr[7] 1.8 3.3
  ha[8] ha[53] 1.8 3.3  
  ha[8] hgr[53] 1.8 3.3 
  hg[9] mgr[8] 1.8 5.5
  ha[53] mgr[8] 1.8 5.5  
  hn[9] hn[8] 1.8 2.7    
  hbr[53] mgs[8] 1.8 5.5 
  hgr[53] mgs[8] 1.8 5.5  
  hn[8] hbr[7] 1.8 3.3  
  ha[7] mgs[8] 1.8 5.5
  hn[9] hbr[7] 1.8 3.3   
  hn[7] hn[9] 1.8 5.0
  hn[7] hbr[7] 1.8 2.7
  hn[10] hbr[9] 1.8 3.3 
  hn[10] hbs[9] 1.8 3.3  
  hn[9] hbr[9] 1.8 2.7 
  hg[9] ha[9] 1.8 3.3  
  hn[14] hbs[9] 1.8 5.0
  hn[51] hbs[51] 1.8 2.7 
  hbr[51] mds[51] 1.8 3.8
  hn[51] hbs[48] 1.8 5.0
  hn[48] hbs[51] 1.8 3.3  
  hn[52] hbs[52] 1.8 3.3  
  hn[52] hbr[52] 1.8 3.3
  hn[52] mdr[52] 1.8 3.8  
  hn[53] hbs[52] 1.8 5.0 
  hn[53] hbr[52] 1.8 5.0   
  hn[56] hbr[56] 1.8 2.7
  ha[56] hgr[56] 1.8 2.7
  hn[94] hn[93] 1.8 5.0  
  hn[94] hbr[94] 1.8 3.3  
  hn[95] hbs[94] 1.8 2.7  
  ha[89] mgr[89] 1.8 3.2
  ha[89] mgs[89] 1.8 3.2
  ha[89] hb[89] 1.8 5.0
  hn[89] hbr[88] 1.8 3.3
  ha[95] mgr[95] 1.8 3.2  
  hn[95] mgr[95] 1.8 3.2  
  hn[95] md1[20] 1.8 5.5 
  hn[96] mgs[95] 1.8 3.2
  hn[97] mgs[95] 1.8 5.5  
  hbr[88] mgr[95] 1.8 3.8 
  mgs[85] mgs[95] 1.8 3.8 
  hn[96] hb[95] 1.8 2.7   
  hn[94] mgr[95] 1.8 5.5  
  hg1r[20] mgs[95] 1.8 3.2 
  md1[20] mgs[95] 1.8 3.8  
  ha[85] mgs[95] 1.8 5.5
  hb[95] mb[101] 1.8 5.5  
  hn[101] mgs[95] 1.5 5.5
  mgr[95] hn[94] 1.8 5.5
  mgr[95] ha[94] 1.8 3.8 
  ha[93] mg2[93] 1.8 3.2 
  ha[93] hgr[93] 1.8 2.7  
  ha[93] hgs[93] 1.8 2.7
  ha[93] hbr[94] 1.8 5.0
  hn[93] md1[93] 1.8 3.2
  hn[93] hb[93] 1.8 2.7
  hn[93] ha[88] 1.8 5.0
  hn[93] hbr[91] 1.8 3.3  
  hn[93] hgr[91] 1.8 5.0
  md1[93] hbr[88] 1.8 5.5   
  md1[93] ha[88] 1.8 3.2
  hn[92] md1[93] 1.8 5.5
  md1[93] hgs[91] 1.8 3.2 
  md1[93] hbs[92] 1.8 3.8  
  md1[93] he1[87] 1.8 5.5 
  mg2[93] hbr[104] 1.8 3.8  
  mg2[93] hb[95] 1.8 5.5  
  mg2[93] hn[94] 1.8 3.2
  hb[93] mg2[93] 1.8 3.2
  hb[93] md1[93] 1.8 3.2
  hb[93] hn[92] 1.8 5.0
  hn[91] hbr[91] 1.8 2.7 
  hn[91] hd1[87] 1.8 5.0  
  hn[91] md1[93] 1.8 5.5 
  hn[91] hbs[90] 1.8 3.3 
E 1

  Entry H atom name         Submitted Coord H atom name

  Start of MODEL    1
    1   1H    HIS   1           HNB      HIS   1 -16.920  17.335  17.335
    2   2H    HIS   1           HN       HIS   1 -17.233  18.881  18.881
    3   3H    HIS   1           HNC      HIS   1 -18.333  17.713  17.713
    4    HA   HIS   1           HA       HIS   1 -16.982  16.663  16.663
    5   1HB   HIS   1           HBS      HIS   1 -16.562  18.644  18.644
    6   2HB   HIS   1           HBR      HIS   1 -18.241  18.292  18.292
    7    HD1  HIS   1           HD1      HIS   1 -15.937  21.089  21.089
    8    HD2  HIS   1           HD2      HIS   1 -19.054  20.029  20.029
    9    HE1  HIS   1           HE1      HIS   1 -16.765  23.220  23.220
   10    HE2  HIS   1           HE2      HIS   1 -18.667  22.587  22.587
   11    H    MET   2           HN       MET   2 -15.437  18.878  18.878
   12    HA   MET   2           HA       MET   2 -12.834  18.464  18.464
   13   1HB   MET   2           HBS      MET   2 -12.080  20.536  20.536
   14   2HB   MET   2           HBR      MET   2 -13.581  20.790  20.790
   15   1HG   MET   2           HGR      MET   2 -13.667  20.292  20.292
   16   2HG   MET   2           HGS      MET   2 -13.253  21.912  21.912
   17   1HE   MET   2           HME      MET   2 -15.490  20.137  20.137
   18   2HE   MET   2           HME      MET   2 -17.012  21.038  21.038
   19   3HE   MET   2           HME      MET   2 -16.746  19.516  19.516
   20    H    GLY   3           HN       GLY   3 -10.977  18.118  18.118
   21   1HA   GLY   3           HAR      GLY   3 -10.483  17.652  17.652
   22   2HA   GLY   3           HAS      GLY   3 -11.520  16.273  16.273
   23    H    ALA   4           HN       ALA   4  -8.394  17.303  17.303
   24    HA   ALA   4           HA       ALA   4  -7.380  14.845  14.845
   25   1HB   ALA   4           HMB      ALA   4  -7.515  16.825  16.825
   26   2HB   ALA   4           HMB      ALA   4  -5.870  16.199  16.199
   27   3HB   ALA   4           HMB      ALA   4  -7.206  15.071  15.071
   28    H    ARG   5           HN       ARG   5  -6.887  18.264  18.264
   29    HA   ARG   5           HA       ARG   5  -5.299  19.432  19.432
   30   1HB   ARG   5           HBS      ARG   5  -5.892  17.213  17.213
   31   2HB   ARG   5           HBR      ARG   5  -4.124  17.035  17.035
   32   1HG   ARG   5           HGS      ARG   5  -4.684  18.201  18.201
   33   2HG   ARG   5           HGR      ARG   5  -3.787  19.265  19.265
   34   1HD   ARG   5           HDS      ARG   5  -5.559  20.515  20.515
   35   2HD   ARG   5           HDR      ARG   5  -5.956  20.204  20.204
   36    HE   ARG   5           HE       ARG   5  -7.074  18.303  18.303
   37   1HH1  ARG   5           HH1      ARG   5  -7.583  21.062  21.062
   38   2HH1  ARG   5           HH1      ARG   5  -9.304  21.032  21.032
   39   1HH2  ARG   5           HH2      ARG   5  -9.315  18.377  18.377
   40   2HH2  ARG   5           HH2      ARG   5 -10.284  19.513  19.513
   41    H    ALA   6           HN       ALA   6  -3.993  20.101  20.101
   42    HA   ALA   6           HA       ALA   6  -2.003  20.421  20.421
   43   1HB   ALA   6           HMB      ALA   6  -1.259  18.991  18.991
   44   2HB   ALA   6           HMB      ALA   6  -0.232  18.512  18.512
   45   3HB   ALA   6           HMB      ALA   6  -0.370  20.230  20.230
   46    H    SER   7           HN       SER   7  -1.288  17.032  17.032
   47    HA   SER   7           HA       SER   7  -2.243  16.201  16.201
   48   1HB   SER   7           HBS      SER   7   0.038  17.065  17.065
   49   2HB   SER   7           HBR      SER   7   0.578  15.924  15.924
   50    HG   SER   7           HG       SER   7  -0.822  15.209  15.209
   51    H    VAL   8           HN       VAL   8  -1.056  13.756  13.756
   52    HA   VAL   8           HA       VAL   8  -2.344  12.081  12.081
   53    HB   VAL   8           HB       VAL   8  -0.152  11.553  11.553
   54   1HG1  VAL   8           HMG      VAL   8  -0.926   9.926   9.926
   55   2HG1  VAL   8           HMG      VAL   8  -1.565   9.170   9.170
   56   3HG1  VAL   8           HMG      VAL   8   0.172   9.534   9.534
   57   1HG2  VAL   8           HMG      VAL   8  -2.428  12.213  12.213
   58   2HG2  VAL   8           HMG      VAL   8  -1.809  10.640  10.640
   59   3HG2  VAL   8           HMG      VAL   8  -3.047  10.707  10.707
   60    H    LEU   9           HN       LEU   9   1.095  12.878  12.878
   61    HA   LEU   9           HA       LEU   9   1.844  11.343  11.343
   62   1HB   LEU   9           HBR      LEU   9   3.307  12.905  12.905
   63   2HB   LEU   9           HBS      LEU   9   4.157  12.095  12.095
   64    HG   LEU   9           HG       LEU   9   2.304  10.522  10.522
   65   1HD1  LEU   9           HMD      LEU   9   3.919  11.869  11.869
   66   2HD1  LEU   9           HMD      LEU   9   5.234  10.984  10.984
   67   3HD1  LEU   9           HMD      LEU   9   4.031  10.098  10.098
   68   1HD2  LEU   9           HMD      LEU   9   3.647   9.921   9.921
   69   2HD2  LEU   9           HMD      LEU   9   3.388   8.741   8.741
   70   3HD2  LEU   9           HMD      LEU   9   4.941   9.608   9.608
   71    H    SER  10           HN       SER  10   3.995  12.517  12.517
   72    HA   SER  10           HA       SER  10   3.118  15.159  15.159
   73   1HB   SER  10           HBR      SER  10   4.709  14.922  14.922
   74   2HB   SER  10           HBS      SER  10   3.703  13.445  13.445
   75    HG   SER  10           HG       SER  10   5.407  12.588  12.588
   76    H    GLY  11           HN       GLY  11   5.440  16.335  16.335
   77   1HA   GLY  11           HAR      GLY  11   6.664  17.123  17.123
   78   2HA   GLY  11           HAS      GLY  11   7.324  17.385  17.385
   79    H    GLY  12           HN       GLY  12   7.916  15.053  15.053
   80   1HA   GLY  12           HAR      GLY  12  10.236  14.196  14.196
   81   2HA   GLY  12           HAS      GLY  12   9.368  13.261  13.261
   82    H    GLU  13           HN       GLU  13   7.102  12.447  12.447
   83    HA   GLU  13           HA       GLU  13   8.028  10.173  10.173
   84   1HB   GLU  13           HBR      GLU  13   5.200  11.200  11.200
   85   2HB   GLU  13           HBS      GLU  13   5.731   9.634   9.634
   86   1HG   GLU  13           HGS      GLU  13   6.409   9.290   9.290
   87   2HG   GLU  13           HGR      GLU  13   6.004  10.959  10.959
   88    H    LEU  14           HN       LEU  14   6.909  13.268  13.268
   89    HA   LEU  14           HA       LEU  14   6.601  12.643  12.643
   90   1HB   LEU  14           HBR      LEU  14   6.396  14.849  14.849
   91   2HB   LEU  14           HBS      LEU  14   7.806  15.215  15.215
   92    HG   LEU  14           HG       LEU  14   5.931  16.233  16.233
   93   1HD1  LEU  14           HMD      LEU  14   7.471  14.918  14.918
   94   2HD1  LEU  14           HMD      LEU  14   6.277  13.597  13.597
   95   3HD1  LEU  14           HMD      LEU  14   5.835  15.179  15.179
   96   1HD2  LEU  14           HMD      LEU  14   4.255  14.928  14.928
   97   2HD2  LEU  14           HMD      LEU  14   3.864  15.038  15.038
   98   3HD2  LEU  14           HMD      LEU  14   4.553  13.535  13.535
   99    H    ASP  15           HN       ASP  15   9.343  13.979  13.979
  100    HA   ASP  15           HA       ASP  15  11.055  14.057  14.057
  101   1HB   ASP  15           HBS      ASP  15  11.361  15.467  15.467
  102   2HB   ASP  15           HBR      ASP  15  11.768  14.050  14.050
  103    H    LYS  16           HN       LYS  16  10.123  11.413  11.413
  104    HA   LYS  16           HA       LYS  16  12.273   9.682   9.682
  105   1HB   LYS  16           HBR      LYS  16  10.892   9.557   9.557
  106   2HB   LYS  16           HBS      LYS  16   9.946   8.443   8.443
  107   1HG   LYS  16           HGS      LYS  16  12.905   8.279   8.279
  108   2HG   LYS  16           HGR      LYS  16  11.607   7.154   7.154
  109   1HD   LYS  16           HDS      LYS  16  11.374   6.346   6.346
  110   2HD   LYS  16           HDR      LYS  16  12.282   7.677   7.677
  111   1HE   LYS  16           HER      LYS  16  14.015   6.453   6.453
  112   2HE   LYS  16           HES      LYS  16  13.228   5.130   5.130
  113   1HZ   LYS  16           HZB      LYS  16  13.797   6.798   6.798
  114   2HZ   LYS  16           HZC      LYS  16  15.025   7.174   7.174
  115   3HZ   LYS  16           HZA      LYS  16  14.831   5.636   5.636
  116    H    TRP  17           HN       TRP  17   8.832  10.450  10.450
  117    HA   TRP  17           HA       TRP  17   8.234   8.464   8.464
  118   1HB   TRP  17           HBS      TRP  17   6.519   9.559   9.559
  119   2HB   TRP  17           HBR      TRP  17   6.890  11.124  11.124
  120    HD1  TRP  17           HD1      TRP  17   6.286  11.252  11.252
  121    HE1  TRP  17           HE1      TRP  17   4.762   9.851   9.851
  122    HE3  TRP  17           HE3      TRP  17   5.259   7.474   7.474
  123    HZ2  TRP  17           HZ2      TRP  17   3.158   7.561   7.561
  124    HZ3  TRP  17           HZ3      TRP  17   3.685   5.728   5.728
  125    HH2  TRP  17           HH2      TRP  17   2.628   5.776   5.776
  126    H    GLU  18           HN       GLU  18  10.101  11.296  11.296
  127    HA   GLU  18           HA       GLU  18   9.294  11.961  11.961
  128   1HB   GLU  18           HBR      GLU  18   9.735  13.537  13.537
  129   2HB   GLU  18           HBS      GLU  18  11.253  12.884  12.884
  130   1HG   GLU  18           HGR      GLU  18  11.025  14.079  14.079
  131   2HG   GLU  18           HGS      GLU  18  10.782  15.135  15.135
  132    H    LYS  19           HN       LYS  19  10.635   9.350   9.350
  133    HA   LYS  19           HA       LYS  19  11.548   9.365   9.365
  134   1HB   LYS  19           HBR      LYS  19  13.755  10.024  10.024
  135   2HB   LYS  19           HBS      LYS  19  14.074   8.587   8.587
  136   1HG   LYS  19           HGS      LYS  19  12.938  10.589  10.589
  137   2HG   LYS  19           HGR      LYS  19  14.214  11.367  11.367
  138   1HD   LYS  19           HDR      LYS  19  14.543   8.806   8.806
  139   2HD   LYS  19           HDS      LYS  19  14.873  10.374  10.374
  140   1HE   LYS  19           HES      LYS  19  16.952  10.161  10.161
  141   2HE   LYS  19           HER      LYS  19  16.265  10.350  10.350
  142   1HZ   LYS  19           HZB      LYS  19  15.820   7.767   7.767
  143   2HZ   LYS  19           HZC      LYS  19  17.299   8.029   8.029
  144   3HZ   LYS  19           HZA      LYS  19  17.034   8.324   8.324
  145    H    ILE  20           HN       ILE  20   9.973   7.695   7.695
  146    HA   ILE  20           HA       ILE  20  11.317   5.220   5.220
  147    HB   ILE  20           HB       ILE  20   8.403   6.064   6.064
  148   1HG1  ILE  20           HG1      ILE  20   9.960   4.486   4.486
  149   2HG1  ILE  20           HG1      ILE  20  10.191   6.249   6.249
  150   1HG2  ILE  20           HMG      ILE  20   9.229   3.416   3.416
  151   2HG2  ILE  20           HMG      ILE  20   8.436   3.386   3.386
  152   3HG2  ILE  20           HMG      ILE  20   7.595   4.101   4.101
  153   1HD1  ILE  20           HMD      ILE  20   7.379   5.634   5.634
  154   2HD1  ILE  20           HMD      ILE  20   8.223   4.903   4.903
  155   3HD1  ILE  20           HMD      ILE  20   8.363   6.654   6.654
  156    H    ARG  21           HN       ARG  21  12.233   4.238   4.238
  157    HA   ARG  21           HA       ARG  21  11.739   4.931   4.931
  158   1HB   ARG  21           HBS      ARG  21  13.922   4.129   4.129
  159   2HB   ARG  21           HBR      ARG  21  13.199   2.512   2.512
  160   1HG   ARG  21           HGS      ARG  21  12.695   2.501   2.501
  161   2HG   ARG  21           HGR      ARG  21  13.689   3.979   3.979
  162   1HD   ARG  21           HDR      ARG  21  15.069   2.140   2.140
  163   2HD   ARG  21           HDS      ARG  21  15.550   2.714   2.714
  164    HE   ARG  21           HE       ARG  21  13.608   0.560   0.560
  165   1HH1  ARG  21           HH1      ARG  21  17.017   1.455   1.455
  166   2HH1  ARG  21           HH1      ARG  21  17.527  -0.115  -0.115
  167   1HH2  ARG  21           HH2      ARG  21  14.326  -1.516  -1.516
  168   2HH2  ARG  21           HH2      ARG  21  16.004  -1.797  -1.797
  169    H    LEU  22           HN       LEU  22  10.456   4.064   4.064
  170    HA   LEU  22           HA       LEU  22   8.162   2.630   2.630
  171   1HB   LEU  22           HBR      LEU  22   8.848   2.980   2.980
  172   2HB   LEU  22           HBS      LEU  22   7.269   3.085   3.085
  173    HG   LEU  22           HG       LEU  22   9.069   5.185   5.185
  174   1HD1  LEU  22           HMD      LEU  22   9.893   4.748   4.748
  175   2HD1  LEU  22           HMD      LEU  22   8.284   5.291   5.291
  176   3HD1  LEU  22           HMD      LEU  22   9.340   6.399   6.399
  177   1HD2  LEU  22           HMD      LEU  22   6.390   4.695   4.695
  178   2HD2  LEU  22           HMD      LEU  22   7.112   6.303   6.303
  179   3HD2  LEU  22           HMD      LEU  22   6.666   5.785   5.785
  180    H    ARG  23           HN       ARG  23  10.760   1.774   1.774
  181    HA   ARG  23           HA       ARG  23  10.063  -1.100  -1.100
  182   1HB   ARG  23           HBR      ARG  23  10.854  -1.122  -1.122
  183   2HB   ARG  23           HBS      ARG  23   9.146  -0.904  -0.904
  184   1HG   ARG  23           HGS      ARG  23   9.221   1.426   1.426
  185   2HG   ARG  23           HGR      ARG  23  11.004   1.424   1.424
  186   1HD   ARG  23           HDS      ARG  23  10.893   0.085   0.085
  187   2HD   ARG  23           HDR      ARG  23   9.113   0.006   0.006
  188    HE   ARG  23           HE       ARG  23  10.626   2.110   2.110
  189   1HH1  ARG  23           HH1      ARG  23   7.685   1.442   1.442
  190   2HH1  ARG  23           HH1      ARG  23   6.965   2.968   2.968
  191   1HH2  ARG  23           HH2      ARG  23   9.709   4.147   4.147
  192   2HH2  ARG  23           HH2      ARG  23   8.110   4.499   4.499
  193    HA   PRO  24           HA       PRO  24  14.317  -1.773  -1.773
  194   1HB   PRO  24           HBR      PRO  24  14.421  -4.285  -4.285
  195   2HB   PRO  24           HBS      PRO  24  14.109  -3.876  -3.876
  196   1HG   PRO  24           HGS      PRO  24  12.325  -4.789  -4.789
  197   2HG   PRO  24           HGR      PRO  24  12.151  -4.801  -4.801
  198   1HD   PRO  24           HDS      PRO  24  10.908  -3.106  -3.106
  199   2HD   PRO  24           HDR      PRO  24  11.041  -2.908  -2.908
  200    H    GLY  25           HN       GLY  25  14.816  -0.083  -0.083
  201   1HA   GLY  25           HAS      GLY  25  16.692   0.294   0.294
  202   2HA   GLY  25           HAR      GLY  25  16.392  -1.267  -1.267
  203    H    GLY  26           HN       GLY  26  13.616   0.681   0.681
  204   1HA   GLY  26           HAS      GLY  26  13.336   1.466   1.466
  205   2HA   GLY  26           HAR      GLY  26  12.129   1.679   1.679
  206    H    LYS  27           HN       LYS  27  14.507   2.685   2.685
  207    HA   LYS  27           HA       LYS  27  16.013   4.445   4.445
  208   1HB   LYS  27           HBR      LYS  27  15.747   4.668   4.668
  209   2HB   LYS  27           HBS      LYS  27  14.998   6.185   6.185
  210   1HG   LYS  27           HGS      LYS  27  17.047   7.044   7.044
  211   2HG   LYS  27           HGR      LYS  27  17.356   5.876   5.876
  212   1HD   LYS  27           HDS      LYS  27  18.117   4.252   4.252
  213   2HD   LYS  27           HDR      LYS  27  17.848   5.466   5.466
  214   1HE   LYS  27           HES      LYS  27  20.233   5.151   5.151
  215   2HE   LYS  27           HER      LYS  27  19.586   6.812   6.812
  216   1HZ   LYS  27           HZB      LYS  27  19.446   5.312   5.312
  217   2HZ   LYS  27           HZC      LYS  27  20.789   6.151   6.151
  218   3HZ   LYS  27           HZA      LYS  27  19.362   6.927   6.927
  219    H    LYS  28           HN       LYS  28  12.757   5.281   5.281
  220    HA   LYS  28           HA       LYS  28  12.694   7.844   7.844
  221   1HB   LYS  28           HBR      LYS  28  10.507   6.051   6.051
  222   2HB   LYS  28           HBS      LYS  28  10.204   7.674   7.674
  223   1HG   LYS  28           HGS      LYS  28  10.931   8.722   8.722
  224   2HG   LYS  28           HGR      LYS  28  12.330   7.624   7.624
  225   1HD   LYS  28           HDR      LYS  28  11.292   6.428   6.428
  226   2HD   LYS  28           HDS      LYS  28   9.851   6.250   6.250
  227   1HE   LYS  28           HES      LYS  28  10.094   8.942   8.942
  228   2HE   LYS  28           HER      LYS  28  10.165   7.688   7.688
  229   1HZ   LYS  28           HZC      LYS  28   8.147   6.773   6.773
  230   2HZ   LYS  28           HZA      LYS  28   8.008   8.281   8.281
  231   3HZ   LYS  28           HZB      LYS  28   7.944   8.045   8.045
  232    H    GLN  29           HN       GLN  29  11.409   8.566   8.566
  233    HA   GLN  29           HA       GLN  29  11.180   6.507   6.507
  234   1HB   GLN  29           HBS      GLN  29  11.918   8.598   8.598
  235   2HB   GLN  29           HBR      GLN  29  13.087   7.474   7.474
  236   1HG   GLN  29           HGS      GLN  29  14.041   9.404   9.404
  237   2HG   GLN  29           HGR      GLN  29  12.853   9.243   9.243
  238   1HE2  GLN  29           HE2      GLN  29  12.753  12.711  12.711
  239   2HE2  GLN  29           HE2      GLN  29  13.948  11.662  11.662
  240    H    TYR  30           HN       TYR  30   9.545   6.627   6.627
  241    HA   TYR  30           HA       TYR  30   7.266   8.178   8.178
  242   1HB   TYR  30           HBS      TYR  30   8.435   6.806   6.806
  243   2HB   TYR  30           HBR      TYR  30   6.972   7.816   7.816
  244    HD1  TYR  30           HD2      TYR  30   7.618   5.758   5.758
  245    HD2  TYR  30           HD1      TYR  30   5.569   5.942   5.942
  246    HE1  TYR  30           HE2      TYR  30   6.620   3.557   3.557
  247    HE2  TYR  30           HE1      TYR  30   4.722   3.649   3.649
  248    HH   TYR  30           HH       TYR  30   5.485   1.836   1.836
  249    H    LYS  31           HN       LYS  31   6.657  10.152  10.152
  250    HA   LYS  31           HA       LYS  31   7.910  11.611  11.611
  251   1HB   LYS  31           HBR      LYS  31   8.382  12.535  12.535
  252   2HB   LYS  31           HBS      LYS  31   6.635  12.891  12.891
  253   1HG   LYS  31           HGR      LYS  31   8.017  14.855  14.855
  254   2HG   LYS  31           HGS      LYS  31   6.764  14.401  14.401
  255   1HD   LYS  31           HDS      LYS  31   8.469  13.179  13.179
  256   2HD   LYS  31           HDR      LYS  31   9.682  13.682  13.682
  257   1HE   LYS  31           HES      LYS  31   8.139  15.929  15.929
  258   2HE   LYS  31           HER      LYS  31   9.010  14.999  14.999
  259   1HZ   LYS  31           HZA      LYS  31  10.841  15.227  15.227
  260   2HZ   LYS  31           HZB      LYS  31  10.050  16.642  16.642
  261   3HZ   LYS  31           HZC      LYS  31  10.696  16.266  16.266
  262    H    LEU  32           HN       LEU  32   6.440  13.312  13.312
  263    HA   LEU  32           HA       LEU  32   4.011  12.242  12.242
  264   1HB   LEU  32           HBS      LEU  32   5.610  14.190  14.190
  265   2HB   LEU  32           HBR      LEU  32   4.460  15.210  15.210
  266    HG   LEU  32           HG       LEU  32   4.039  15.144  15.144
  267   1HD1  LEU  32           HMD      LEU  32   2.204  14.615  14.615
  268   2HD1  LEU  32           HMD      LEU  32   1.570  13.984  13.984
  269   3HD1  LEU  32           HMD      LEU  32   2.037  15.697  15.697
  270   1HD2  LEU  32           HMD      LEU  32   3.660  12.202  12.202
  271   2HD2  LEU  32           HMD      LEU  32   4.581  13.000  13.000
  272   3HD2  LEU  32           HMD      LEU  32   2.800  13.014  13.014
  273    H    LYS  33           HN       LYS  33   4.799  13.985  13.985
  274    HA   LYS  33           HA       LYS  33   2.214  14.721  14.721
  275   1HB   LYS  33           HBR      LYS  33   4.378  15.317  15.317
  276   2HB   LYS  33           HBS      LYS  33   4.472  13.637  13.637
  277   1HG   LYS  33           HGS      LYS  33   3.529  14.687  14.687
  278   2HG   LYS  33           HGR      LYS  33   2.059  14.178  14.178
  279   1HD   LYS  33           HDS      LYS  33   1.493  16.309  16.309
  280   2HD   LYS  33           HDR      LYS  33   3.148  16.804  16.804
  281   1HE   LYS  33           HES      LYS  33   1.963  17.908  17.908
  282   2HE   LYS  33           HER      LYS  33   3.515  17.115  17.115
  283   1HZ   LYS  33           HZA      LYS  33   1.111  15.543  15.543
  284   2HZ   LYS  33           HZB      LYS  33   1.350  16.726  16.726
  285   3HZ   LYS  33           HZC      LYS  33   2.470  15.554  15.554
  286    H    HIS  34           HN       DHI  34   3.911  11.627  11.627
  287    HA   HIS  34           HA       DHI  34   1.828  10.333  10.333
  288   1HB   HIS  34           HBS      DHI  34   3.960   8.793   8.793
  289   2HB   HIS  34           HBR      DHI  34   3.134   8.398   8.398
  290    HD2  HIS  34           HD2      DHI  34   4.157  11.844  11.844
  291    HE1  HIS  34           HE1      DHI  34   7.739   9.736   9.736
  292    HE2  HIS  34           HE2      DHI  34   6.549  11.936  11.936
  293    H    ILE  35           HN       ILE  35   2.753  10.554  10.554
  294    HA   ILE  35           HA       ILE  35   0.759   8.776   8.776
  295    HB   ILE  35           HB       ILE  35   2.736  10.075  10.075
  296   1HG1  ILE  35           HG1      ILE  35   0.133   9.507   9.507
  297   2HG1  ILE  35           HG1      ILE  35   1.208   8.245   8.245
  298   1HG2  ILE  35           HMG      ILE  35   0.532  12.071  12.071
  299   2HG2  ILE  35           HMG      ILE  35   1.431  11.720  11.720
  300   3HG2  ILE  35           HMG      ILE  35   2.303  12.281  12.281
  301   1HD1  ILE  35           HMD      ILE  35   2.870   9.912   9.912
  302   2HD1  ILE  35           HMD      ILE  35   1.392   9.689   9.689
  303   3HD1  ILE  35           HMD      ILE  35   2.310   8.268   8.268
  304    H    VAL  36           HN       VAL  36   0.652  12.115  12.115
  305    HA   VAL  36           HA       VAL  36  -1.885  12.742  12.742
  306    HB   VAL  36           HB       VAL  36  -0.263  14.139  14.139
  307   1HG1  VAL  36           HMG      VAL  36  -2.885  14.554  14.554
  308   2HG1  VAL  36           HMG      VAL  36  -2.343  15.621  15.621
  309   3HG1  VAL  36           HMG      VAL  36  -1.728  15.865  15.865
  310   1HG2  VAL  36           HMG      VAL  36   0.167  13.929  13.929
  311   2HG2  VAL  36           HMG      VAL  36   0.940  15.053  15.053
  312   3HG2  VAL  36           HMG      VAL  36  -0.518  15.553  15.553
  313    H    TRP  37           HN       TRP  37  -0.712  11.665  11.665
  314    HA   TRP  37           HA       TRP  37  -3.202  11.287  11.287
  315   1HB   TRP  37           HBR      TRP  37  -1.174  11.076  11.076
  316   2HB   TRP  37           HBS      TRP  37  -0.594   9.770   9.770
  317    HD1  TRP  37           HD1      TRP  37  -3.062  10.392  10.392
  318    HE1  TRP  37           HE1      TRP  37  -4.038   8.157   8.157
  319    HE3  TRP  37           HE3      TRP  37  -0.999   7.358   7.358
  320    HZ2  TRP  37           HZ2      TRP  37  -4.017   5.482   5.482
  321    HZ3  TRP  37           HZ3      TRP  37  -1.387   4.942   4.942
  322    HH2  TRP  37           HH2      TRP  37  -2.844   4.008   4.008
  323    H    ALA  38           HN       ALA  38  -1.419   9.274   9.274
  324    HA   ALA  38           HA       ALA  38  -2.903   6.836   6.836
  325   1HB   ALA  38           HMB      ALA  38  -0.555   7.124   7.124
  326   2HB   ALA  38           HMB      ALA  38  -1.386   7.609   7.609
  327   3HB   ALA  38           HMB      ALA  38  -1.651   5.983   5.983
  328    H    SER  39           HN       SER  39  -2.650   8.918   8.918
  329    HA   SER  39           HA       SER  39  -5.030   8.087   8.087
  330   1HB   SER  39           HBS      SER  39  -4.829   9.938   9.938
  331   2HB   SER  39           HBR      SER  39  -3.169   9.398   9.398
  332    HG   SER  39           HG       SER  39  -2.963  11.004  11.004
  333    H    ARG  40           HN       ARG  40  -4.571  10.046  10.046
  334    HA   ARG  40           HA       ARG  40  -7.251  11.191  11.191
  335   1HB   ARG  40           HBS      ARG  40  -4.922  11.080  11.080
  336   2HB   ARG  40           HBR      ARG  40  -6.399  10.598  10.598
  337   1HG   ARG  40           HGS      ARG  40  -6.141  12.932  12.932
  338   2HG   ARG  40           HGR      ARG  40  -7.475  12.718  12.718
  339   1HD   ARG  40           HDS      ARG  40  -5.783  13.063  13.063
  340   2HD   ARG  40           HDR      ARG  40  -4.627  13.538  13.538
  341    HE   ARG  40           HE       ARG  40  -5.597  15.607  15.607
  342   1HH1  ARG  40           HH1      ARG  40  -8.032  13.249  13.249
  343   2HH1  ARG  40           HH1      ARG  40  -9.307  14.421  14.421
  344   1HH2  ARG  40           HH2      ARG  40  -7.315  17.087  17.087
  345   2HH2  ARG  40           HH2      ARG  40  -8.901  16.593  16.593
  346    H    GLU  41           HN       GLU  41  -5.703   8.498   8.498
  347    HA   GLU  41           HA       GLU  41  -8.130   7.633   7.633
  348   1HB   GLU  41           HBS      GLU  41  -5.502   7.293   7.293
  349   2HB   GLU  41           HBR      GLU  41  -5.800   5.835   5.835
  350   1HG   GLU  41           HGR      GLU  41  -5.807   5.175   5.175
  351   2HG   GLU  41           HGS      GLU  41  -7.529   5.582   5.582
  352    H    LEU  42           HN       LEU  42  -6.627   6.971   6.971
  353    HA   LEU  42           HA       LEU  42  -8.103   4.550   4.550
  354   1HB   LEU  42           HBR      LEU  42  -6.002   5.095   5.095
  355   2HB   LEU  42           HBS      LEU  42  -6.655   6.681   6.681
  356    HG   LEU  42           HG       LEU  42  -8.435   4.781   4.781
  357   1HD1  LEU  42           HMD      LEU  42  -5.654   3.761   3.761
  358   2HD1  LEU  42           HMD      LEU  42  -6.424   3.672   3.672
  359   3HD1  LEU  42           HMD      LEU  42  -7.195   2.889   2.889
  360   1HD2  LEU  42           HMD      LEU  42  -6.543   6.799   6.799
  361   2HD2  LEU  42           HMD      LEU  42  -8.196   6.413   6.413
  362   3HD2  LEU  42           HMD      LEU  42  -6.813   5.481   5.481
  363    H    GLU  43           HN       GLU  43  -8.181   7.841   7.841
  364    HA   GLU  43           HA       GLU  43 -10.520   7.505   7.505
  365   1HB   GLU  43           HBR      GLU  43  -8.793   9.185   9.185
  366   2HB   GLU  43           HBS      GLU  43  -9.121   9.823   9.823
  367   1HG   GLU  43           HGR      GLU  43 -11.097  10.074  10.074
  368   2HG   GLU  43           HGS      GLU  43  -9.744  11.188  11.188
  369    H    ARG  44           HN       ARG  44 -10.029   8.357   8.357
  370    HA   ARG  44           HA       ARG  44 -12.865   9.008   9.008
  371   1HB   ARG  44           HBS      ARG  44 -10.544   9.931   9.931
  372   2HB   ARG  44           HBR      ARG  44 -11.170   8.809   8.809
  373   1HG   ARG  44           HGS      ARG  44 -13.435  10.144  10.144
  374   2HG   ARG  44           HGR      ARG  44 -12.250  11.415  11.415
  375   1HD   ARG  44           HDR      ARG  44 -12.226  11.897  11.897
  376   2HD   ARG  44           HDS      ARG  44 -11.281  10.394  10.394
  377    HE   ARG  44           HE       ARG  44 -14.183  10.730  10.730
  378   1HH1  ARG  44           HH1      ARG  44 -11.383   8.590   8.590
  379   2HH1  ARG  44           HH1      ARG  44 -12.044   7.498   7.498
  380   1HH2  ARG  44           HH2      ARG  44 -14.959   9.348   9.348
  381   2HH2  ARG  44           HH2      ARG  44 -14.068   7.926   7.926
  382    H    PHE  45           HN       PHE  45 -10.909   6.236   6.236
  383    HA   PHE  45           HA       PHE  45 -12.518   4.617   4.617
  384   1HB   PHE  45           HBS      PHE  45 -10.360   4.128   4.128
  385   2HB   PHE  45           HBR      PHE  45 -11.680   2.931   2.931
  386    HD1  PHE  45           HD2      PHE  45 -10.166   4.709   4.709
  387    HD2  PHE  45           HD1      PHE  45 -11.218   1.059   1.059
  388    HE1  PHE  45           HE2      PHE  45  -9.395   3.446   3.446
  389    HE2  PHE  45           HE1      PHE  45 -10.575  -0.207  -0.207
  390    HZ   PHE  45           HZ       PHE  45  -9.642   0.980   0.980
  391    H    ALA  46           HN       ALA  46 -12.306   4.750   4.750
  392    HA   ALA  46           HA       ALA  46 -15.218   4.711   4.711
  393   1HB   ALA  46           HMB      ALA  46 -13.417   2.292   2.292
  394   2HB   ALA  46           HMB      ALA  46 -14.932   2.370   2.370
  395   3HB   ALA  46           HMB      ALA  46 -14.973   2.510   2.510
  396    H    VAL  47           HN       VAL  47 -12.519   5.967   5.967
  397    HA   VAL  47           HA       VAL  47 -12.477   4.974   4.974
  398    HB   VAL  47           HB       VAL  47 -10.095   5.800   5.800
  399   1HG1  VAL  47           HMG      VAL  47 -10.390   4.398   4.398
  400   2HG1  VAL  47           HMG      VAL  47  -8.899   4.322   4.322
  401   3HG1  VAL  47           HMG      VAL  47  -9.501   5.891   5.891
  402   1HG2  VAL  47           HMG      VAL  47 -11.245   3.032   3.032
  403   2HG2  VAL  47           HMG      VAL  47 -11.118   3.944   3.944
  404   3HG2  VAL  47           HMG      VAL  47  -9.645   3.392   3.392
  405    H    ASN  48           HN       ASN  48 -11.174   6.423   6.423
  406    HA   ASN  48           HA       ASN  48 -11.618   9.286   9.286
  407   1HB   ASN  48           HBS      ASN  48 -13.198   8.682   8.682
  408   2HB   ASN  48           HBR      ASN  48 -11.920   7.916   7.916
  409   1HD2  ASN  48           HD2      ASN  48 -12.875  11.681  11.681
  410   2HD2  ASN  48           HD2      ASN  48 -13.872  10.501  10.501
  411    HA   PRO  49           HA       PRO  49  -7.500   9.740   9.740
  412   1HB   PRO  49           HBR      PRO  49  -7.281  12.377  12.377
  413   2HB   PRO  49           HBS      PRO  49  -7.693  11.682  11.682
  414   1HG   PRO  49           HGR      PRO  49  -9.325  13.108  13.108
  415   2HG   PRO  49           HGS      PRO  49  -9.604  12.684  12.684
  416   1HD   PRO  49           HDR      PRO  49 -10.679  11.510  11.510
  417   2HD   PRO  49           HDS      PRO  49 -10.895  11.040  11.040
  418    H    GLY  50           HN       GLY  50  -8.348  11.838  11.838
  419   1HA   GLY  50           HAS      GLY  50  -6.137  11.335  11.335
  420   2HA   GLY  50           HAR      GLY  50  -7.706  11.809  11.809
  421    H    LEU  51           HN       LEU  51  -8.920   9.353   9.353
  422    HA   LEU  51           HA       LEU  51  -8.698   7.457   7.457
  423   1HB   LEU  51           HBR      LEU  51 -10.532   8.110   8.110
  424   2HB   LEU  51           HBS      LEU  51  -9.710   6.823   6.823
  425    HG   LEU  51           HG       LEU  51 -11.178   6.603   6.603
  426   1HD1  LEU  51           HMD      LEU  51 -11.816   6.086   6.086
  427   2HD1  LEU  51           HMD      LEU  51 -12.116   4.689   4.689
  428   3HD1  LEU  51           HMD      LEU  51 -12.886   6.259   6.259
  429   1HD2  LEU  51           HMD      LEU  51  -9.055   5.257   5.257
  430   2HD2  LEU  51           HMD      LEU  51 -10.546   4.298   4.298
  431   3HD2  LEU  51           HMD      LEU  51  -9.747   4.409   4.409
  432    H    LEU  52           HN       LEU  52  -7.258   7.971   7.971
  433    HA   LEU  52           HA       LEU  52  -5.592   5.635   5.635
  434   1HB   LEU  52           HBS      LEU  52  -6.065   5.556   5.556
  435   2HB   LEU  52           HBR      LEU  52  -6.709   7.217   7.217
  436    HG   LEU  52           HG       LEU  52  -5.075   6.807   6.807
  437   1HD1  LEU  52           HMD      LEU  52  -5.406   9.057   9.057
  438   2HD1  LEU  52           HMD      LEU  52  -3.994   8.746   8.746
  439   3HD1  LEU  52           HMD      LEU  52  -3.800   8.807   8.807
  440   1HD2  LEU  52           HMD      LEU  52  -3.731   5.311   5.311
  441   2HD2  LEU  52           HMD      LEU  52  -2.980   6.035   6.035
  442   3HD2  LEU  52           HMD      LEU  52  -2.812   6.832   6.832
  443    H    GLU  53           HN       GLU  53  -5.285   8.871   8.871
  444    HA   GLU  53           HA       GLU  53  -2.441   9.143   9.143
  445   1HB   GLU  53           HBR      GLU  53  -4.651  10.545  10.545
  446   2HB   GLU  53           HBS      GLU  53  -4.453   9.674   9.674
  447   1HG   GLU  53           HGR      GLU  53  -2.668  11.822  11.822
  448   2HG   GLU  53           HGS      GLU  53  -3.696  11.638  11.638
  449    H    THR  54           HN       THR  54  -4.991   7.587   7.587
  450    HA   THR  54           HA       THR  54  -3.034   6.671   6.671
  451    HB   THR  54           HB       THR  54  -4.896   6.259   6.259
  452    HG1  THR  54           HG1      THR  54  -6.316   6.409   6.409
  453   1HG2  THR  54           HMG      THR  54  -4.608   8.679   8.679
  454   2HG2  THR  54           HMG      THR  54  -6.328   8.347   8.347
  455   3HG2  THR  54           HMG      THR  54  -5.726   8.335   8.335
  456    H    SER  55           HN       SER  55  -2.336   4.675   4.675
  457    HA   SER  55           HA       SER  55  -2.286   2.635   2.635
  458   1HB   SER  55           HBS      SER  55  -1.979   2.087   2.087
  459   2HB   SER  55           HBR      SER  55  -1.160   1.330   1.330
  460    HG   SER  55           HG       SER  55  -0.754   3.763   3.763
  461    H    GLU  56           HN       GLU  56  -4.705   3.429   3.429
  462    HA   GLU  56           HA       GLU  56  -6.027   0.881   0.881
  463   1HB   GLU  56           HBS      GLU  56  -6.135   3.168   3.168
  464   2HB   GLU  56           HBR      GLU  56  -7.344   3.584   3.584
  465   1HG   GLU  56           HGS      GLU  56  -8.642   2.891   2.891
  466   2HG   GLU  56           HGR      GLU  56  -8.305   1.225   1.225
  467    H    GLY  57           HN       GLY  57  -6.633   3.868   3.868
  468   1HA   GLY  57           HAR      GLY  57  -8.572   2.681   2.681
  469   2HA   GLY  57           HAS      GLY  57  -7.693   4.201   4.201
  470    H    CYS  58           HN       CYS  58  -5.088   3.382   3.382
  471    HA   CYS  58           HA       CYS  58  -4.878   2.440   2.440
  472   1HB   CYS  58           HBS      CYS  58  -3.198   3.706   3.706
  473   2HB   CYS  58           HBR      CYS  58  -2.578   2.046   2.046
  474    H    ARG  59           HN       ARG  59  -4.844   0.727   0.727
  475    HA   ARG  59           HA       ARG  59  -4.478  -1.842  -1.842
  476   1HB   ARG  59           HBS      ARG  59  -4.521  -1.036  -1.036
  477   2HB   ARG  59           HBR      ARG  59  -6.256  -1.424  -1.424
  478   1HG   ARG  59           HGR      ARG  59  -5.881  -3.685  -3.685
  479   2HG   ARG  59           HGS      ARG  59  -4.233  -3.468  -3.468
  480   1HD   ARG  59           HDS      ARG  59  -4.041  -2.343  -2.343
  481   2HD   ARG  59           HDR      ARG  59  -5.173  -3.697  -3.697
  482    HE   ARG  59           HE       ARG  59  -2.396  -3.939  -3.939
  483   1HH1  ARG  59           HH1      ARG  59  -5.372  -5.490  -5.490
  484   2HH1  ARG  59           HH1      ARG  59  -4.577  -6.970  -6.970
  485   1HH2  ARG  59           HH2      ARG  59  -1.372  -5.842  -5.842
  486   2HH2  ARG  59           HH2      ARG  59  -2.312  -7.169  -7.169
  487    H    GLN  60           HN       GLN  60  -7.363   0.155   0.155
  488    HA   GLN  60           HA       GLN  60  -9.252  -2.076  -2.076
  489   1HB   GLN  60           HBR      GLN  60  -9.560   0.316   0.316
  490   2HB   GLN  60           HBS      GLN  60 -10.163   0.710   0.710
  491   1HG   GLN  60           HGS      GLN  60 -12.065  -0.394  -0.394
  492   2HG   GLN  60           HGR      GLN  60 -11.214  -1.825  -1.825
  493   1HE2  GLN  60           HE2      GLN  60 -11.167  -0.413  -0.413
  494   2HE2  GLN  60           HE2      GLN  60 -10.048  -1.056  -1.056
  495    H    ILE  61           HN       ILE  61  -7.459   0.262   0.262
  496    HA   ILE  61           HA       ILE  61  -8.759  -0.478  -0.478
  497    HB   ILE  61           HB       ILE  61  -6.192   1.123   1.123
  498   1HG1  ILE  61           HG1      ILE  61  -7.878   2.420   2.420
  499   2HG1  ILE  61           HG1      ILE  61  -7.713   3.005   3.005
  500   1HG2  ILE  61           HMG      ILE  61  -6.465  -0.129  -0.129
  501   2HG2  ILE  61           HMG      ILE  61  -7.612   1.191   1.191
  502   3HG2  ILE  61           HMG      ILE  61  -5.920   1.568   1.568
  503   1HD1  ILE  61           HMD      ILE  61  -9.793   0.937   0.937
  504   2HD1  ILE  61           HMD      ILE  61 -10.075   2.664   2.664
  505   3HD1  ILE  61           HMD      ILE  61  -9.771   2.121   2.121
  506    H    LEU  62           HN       LEU  62  -5.416  -0.998  -0.998
  507    HA   LEU  62           HA       LEU  62  -4.624  -2.548  -2.548
  508   1HB   LEU  62           HBR      LEU  62  -3.380  -1.422  -1.422
  509   2HB   LEU  62           HBS      LEU  62  -3.499  -3.071  -3.071
  510    HG   LEU  62           HG       LEU  62  -2.191  -3.970  -3.970
  511   1HD1  LEU  62           HMD      LEU  62  -3.032  -2.144  -2.144
  512   2HD1  LEU  62           HMD      LEU  62  -1.646  -1.204  -1.204
  513   3HD1  LEU  62           HMD      LEU  62  -1.378  -2.788  -2.788
  514   1HD2  LEU  62           HMD      LEU  62  -1.184  -1.579  -1.579
  515   2HD2  LEU  62           HMD      LEU  62  -0.844  -3.312  -3.312
  516   3HD2  LEU  62           HMD      LEU  62  -0.107  -2.440  -2.440
  517    H    GLY  63           HN       GLY  63  -6.564  -3.390  -3.390
  518   1HA   GLY  63           HAR      GLY  63  -6.463  -6.267  -6.267
  519   2HA   GLY  63           HAS      GLY  63  -7.653  -5.355  -5.355
  520    H    GLN  64           HN       GLN  64  -9.024  -3.812  -3.812
  521    HA   GLN  64           HA       GLN  64 -10.679  -5.485  -5.485
  522   1HB   GLN  64           HBS      GLN  64 -10.907  -2.967  -2.967
  523   2HB   GLN  64           HBR      GLN  64 -10.789  -2.644  -2.644
  524   1HG   GLN  64           HGR      GLN  64 -12.797  -3.586  -3.586
  525   2HG   GLN  64           HGS      GLN  64 -12.617  -4.834  -4.834
  526   1HE2  GLN  64           HE2      GLN  64 -13.698  -1.111  -1.111
  527   2HE2  GLN  64           HE2      GLN  64 -12.297  -1.330  -1.330
  528    H    LEU  65           HN       LEU  65  -7.697  -4.046  -4.046
  529    HA   LEU  65           HA       LEU  65  -8.471  -3.447  -3.447
  530   1HB   LEU  65           HBR      LEU  65  -7.424  -1.894  -1.894
  531   2HB   LEU  65           HBS      LEU  65  -5.910  -2.817  -2.817
  532    HG   LEU  65           HG       LEU  65  -6.036  -2.173  -2.173
  533   1HD1  LEU  65           HMD      LEU  65  -8.360  -0.676  -0.676
  534   2HD1  LEU  65           HMD      LEU  65  -7.318   0.178   0.178
  535   3HD1  LEU  65           HMD      LEU  65  -8.103  -1.353  -1.353
  536   1HD2  LEU  65           HMD      LEU  65  -4.933  -1.024  -1.024
  537   2HD2  LEU  65           HMD      LEU  65  -4.613  -0.507  -0.507
  538   3HD2  LEU  65           HMD      LEU  65  -5.830   0.350   0.350
  539    H    GLN  66           HN       GLN  66  -6.054  -5.386  -5.386
  540    HA   GLN  66           HA       GLN  66  -4.600  -6.316  -6.316
  541   1HB   GLN  66           HBR      GLN  66  -4.944  -7.120  -7.120
  542   2HB   GLN  66           HBS      GLN  66  -4.898  -8.561  -8.561
  543   1HG   GLN  66           HGS      GLN  66  -2.838  -6.897  -6.897
  544   2HG   GLN  66           HGR      GLN  66  -2.756  -6.813  -6.813
  545   1HE2  GLN  66           HE2      GLN  66  -2.567 -10.554 -10.554
  546   2HE2  GLN  66           HE2      GLN  66  -3.800  -9.414  -9.414
  547    HA   PRO  67           HA       PRO  67  -8.153  -9.637  -9.637
  548   1HB   PRO  67           HBS      PRO  67 -10.403  -8.627  -8.627
  549   2HB   PRO  67           HBR      PRO  67  -9.655 -10.023 -10.023
  550   1HG   PRO  67           HGR      PRO  67  -9.666  -7.567  -7.567
  551   2HG   PRO  67           HGS      PRO  67  -9.245  -9.072  -9.072
  552   1HD   PRO  67           HDS      PRO  67  -7.514  -7.110  -7.110
  553   2HD   PRO  67           HDR      PRO  67  -7.111  -8.698  -8.698
  554    H    SER  68           HN       SER  68  -8.890  -6.263  -6.263
  555    HA   SER  68           HA       SER  68 -10.778  -6.364  -6.364
  556   1HB   SER  68           HBS      SER  68  -9.816  -4.202  -4.202
  557   2HB   SER  68           HBR      SER  68 -10.779  -3.822  -3.822
  558    HG   SER  68           HG       SER  68 -12.513  -4.773  -4.773
  559    H    LEU  69           HN       LEU  69  -7.445  -6.220  -6.220
  560    HA   LEU  69           HA       LEU  69  -6.952  -4.515  -4.515
  561   1HB   LEU  69           HBR      LEU  69  -5.374  -6.735  -6.735
  562   2HB   LEU  69           HBS      LEU  69  -4.727  -5.665  -5.665
  563    HG   LEU  69           HG       LEU  69  -5.741  -4.729  -4.729
  564   1HD1  LEU  69           HMD      LEU  69  -3.349  -6.074  -6.074
  565   2HD1  LEU  69           HMD      LEU  69  -2.914  -4.346  -4.346
  566   3HD1  LEU  69           HMD      LEU  69  -3.714  -5.084  -5.084
  567   1HD2  LEU  69           HMD      LEU  69  -5.934  -3.136  -3.136
  568   2HD2  LEU  69           HMD      LEU  69  -4.689  -2.626  -2.626
  569   3HD2  LEU  69           HMD      LEU  69  -4.207  -3.365  -3.365
  570    H    GLN  70           HN       GLN  70  -7.558  -7.988  -7.988
  571    HA   GLN  70           HA       GLN  70  -7.306  -8.657  -8.657
  572   1HB   GLN  70           HBR      GLN  70  -8.469 -10.648 -10.648
  573   2HB   GLN  70           HBS      GLN  70  -7.453 -10.309 -10.309
  574   1HG   GLN  70           HGR      GLN  70  -9.862  -9.133  -9.133
  575   2HG   GLN  70           HGS      GLN  70 -10.357 -10.591 -10.591
  576   1HE2  GLN  70           HE2      GLN  70  -8.332 -12.682 -12.682
  577   2HE2  GLN  70           HE2      GLN  70  -8.077 -12.173 -12.173
  578    H    THR  71           HN       THR  71  -9.565  -6.728  -6.728
  579    HA   THR  71           HA       THR  71 -11.597  -7.106  -7.106
  580    HB   THR  71           HB       THR  71 -13.273  -6.466  -6.466
  581    HG1  THR  71           HG1      THR  71 -11.121  -5.953  -5.953
  582   1HG2  THR  71           HMG      THR  71 -11.487  -8.599  -8.599
  583   2HG2  THR  71           HMG      THR  71 -12.068  -7.859  -7.859
  584   3HG2  THR  71           HMG      THR  71 -13.236  -8.456  -8.456
  585    H    GLY  72           HN       GLY  72  -9.291  -4.886  -4.886
  586   1HA   GLY  72           HAR      GLY  72 -10.909  -2.492  -2.492
  587   2HA   GLY  72           HAS      GLY  72  -9.344  -2.585  -2.585
  588    H    SER  73           HN       SER  73  -7.451  -3.195  -3.195
  589    HA   SER  73           HA       SER  73  -7.248  -2.912  -2.912
  590   1HB   SER  73           HBS      SER  73  -6.420  -0.544  -0.544
  591   2HB   SER  73           HBR      SER  73  -8.187  -0.750  -0.750
  592    HG   SER  73           HG       SER  73  -8.213  -0.043  -0.043
  593    H    GLU  74           HN       GLU  74  -5.093  -2.682  -2.682
  594    HA   GLU  74           HA       GLU  74  -2.880  -3.254  -3.254
  595   1HB   GLU  74           HBS      GLU  74  -3.311  -2.113  -2.113
  596   2HB   GLU  74           HBR      GLU  74  -1.754  -2.106  -2.106
  597   1HG   GLU  74           HGR      GLU  74  -2.301  -4.747  -4.747
  598   2HG   GLU  74           HGS      GLU  74  -3.449  -4.194  -4.194
  599    H    GLU  75           HN       GLU  75  -4.670  -0.394  -0.394
  600    HA   GLU  75           HA       GLU  75  -2.681   1.396   1.396
  601   1HB   GLU  75           HBR      GLU  75  -3.849   3.009   3.009
  602   2HB   GLU  75           HBS      GLU  75  -4.103   1.682   1.682
  603   1HG   GLU  75           HGR      GLU  75  -6.054   2.972   2.972
  604   2HG   GLU  75           HGS      GLU  75  -6.278   1.339   1.339
  605    H    LEU  76           HN       LEU  76  -5.284  -0.485  -0.485
  606    HA   LEU  76           HA       LEU  76  -5.462   0.959   0.959
  607   1HB   LEU  76           HBR      LEU  76  -6.947  -1.013  -1.013
  608   2HB   LEU  76           HBS      LEU  76  -6.074  -1.907  -1.907
  609    HG   LEU  76           HG       LEU  76  -8.221   0.181   0.181
  610   1HD1  LEU  76           HMD      LEU  76  -7.862  -2.663  -2.663
  611   2HD1  LEU  76           HMD      LEU  76  -8.438  -1.827  -1.827
  612   3HD1  LEU  76           HMD      LEU  76  -9.350  -1.686  -1.686
  613   1HD2  LEU  76           HMD      LEU  76  -6.382   0.941   0.941
  614   2HD2  LEU  76           HMD      LEU  76  -7.762   0.328   0.328
  615   3HD2  LEU  76           HMD      LEU  76  -6.302  -0.675  -0.675
  616    H    ARG  77           HN       ARG  77  -3.434  -1.256  -1.256
  617    HA   ARG  77           HA       ARG  77  -2.229  -2.497  -2.497
  618   1HB   ARG  77           HBS      ARG  77  -2.352  -3.124  -3.124
  619   2HB   ARG  77           HBR      ARG  77  -0.674  -2.536  -2.536
  620   1HG   ARG  77           HGS      ARG  77  -1.755  -4.543  -4.543
  621   2HG   ARG  77           HGR      ARG  77  -1.270  -5.082  -5.082
  622   1HD   ARG  77           HDR      ARG  77   0.700  -3.307  -3.307
  623   2HD   ARG  77           HDS      ARG  77   0.357  -4.654  -4.654
  624    HE   ARG  77           HE       ARG  77   0.844  -5.361  -5.361
  625   1HH1  ARG  77           HH1      ARG  77   1.928  -5.360  -5.360
  626   2HH1  ARG  77           HH1      ARG  77   3.316  -6.340  -6.340
  627   1HH2  ARG  77           HH2      ARG  77   2.740  -6.532  -6.532
  628   2HH2  ARG  77           HH2      ARG  77   3.776  -7.004  -7.004
  629    H    SER  78           HN       SER  78  -1.464   0.175   0.175
  630    HA   SER  78           HA       SER  78   0.914   1.027   1.027
  631   1HB   SER  78           HBR      SER  78  -0.455   1.827   1.827
  632   2HB   SER  78           HBS      SER  78  -0.594   3.196   3.196
  633    HG   SER  78           HG       SER  78   1.564   3.327   3.327
  634    H    LEU  79           HN       LEU  79  -2.575   1.691   1.691
  635    HA   LEU  79           HA       LEU  79  -2.521   3.418   3.418
  636   1HB   LEU  79           HBR      LEU  79  -4.380   2.630   2.630
  637   2HB   LEU  79           HBS      LEU  79  -4.626   1.314   1.314
  638    HG   LEU  79           HG       LEU  79  -5.413   2.775   2.775
  639   1HD1  LEU  79           HMD      LEU  79  -4.374   5.044   5.044
  640   2HD1  LEU  79           HMD      LEU  79  -5.405   5.247   5.247
  641   3HD1  LEU  79           HMD      LEU  79  -3.775   4.548   4.548
  642   1HD2  LEU  79           HMD      LEU  79  -6.491   2.745   2.745
  643   2HD2  LEU  79           HMD      LEU  79  -7.340   2.964   2.964
  644   3HD2  LEU  79           HMD      LEU  79  -6.728   4.383   4.383
  645    H    TYR  80           HN       TYR  80  -2.251  -0.092  -0.092
  646    HA   TYR  80           HA       TYR  80  -2.506  -0.553  -0.553
  647   1HB   TYR  80           HBS      TYR  80  -3.088  -2.263  -2.263
  648   2HB   TYR  80           HBR      TYR  80  -1.418  -2.291  -2.291
  649    HD1  TYR  80           HD1      TYR  80  -3.512  -3.143  -3.143
  650    HD2  TYR  80           HD2      TYR  80   0.275  -3.563  -3.563
  651    HE1  TYR  80           HE1      TYR  80  -2.879  -4.841  -4.841
  652    HE2  TYR  80           HE2      TYR  80   0.966  -5.167  -5.167
  653    HH   TYR  80           HH       TYR  80  -0.752  -6.993  -6.993
  654    H    ASN  81           HN       ASN  81   0.319  -0.659  -0.659
  655    HA   ASN  81           HA       ASN  81   2.112  -1.527  -1.527
  656   1HB   ASN  81           HBS      ASN  81   3.843  -1.339  -1.339
  657   2HB   ASN  81           HBR      ASN  81   2.399  -1.995  -1.995
  658   1HD2  ASN  81           HD2      ASN  81   4.224   0.772   0.772
  659   2HD2  ASN  81           HD2      ASN  81   4.866  -0.517  -0.517
  660    H    THR  82           HN       THR  82   1.113   1.595   1.595
  661    HA   THR  82           HA       THR  82   3.016   3.018   3.018
  662    HB   THR  82           HB       THR  82   0.628   3.951   3.951
  663    HG1  THR  82           HG1      THR  82   2.139   3.020   3.020
  664   1HG2  THR  82           HMG      THR  82   1.585   5.458   5.458
  665   2HG2  THR  82           HMG      THR  82   2.730   5.903   5.903
  666   3HG2  THR  82           HMG      THR  82   0.979   6.124   6.124
  667    H    ILE  83           HN       ILE  83  -0.233   1.847   1.847
  668    HA   ILE  83           HA       ILE  83  -0.732   3.297   3.297
  669    HB   ILE  83           HB       ILE  83  -2.033   1.041   1.041
  670   1HG1  ILE  83           HG1      ILE  83  -2.508   3.402   3.402
  671   2HG1  ILE  83           HG1      ILE  83  -3.949   2.510   2.510
  672   1HG2  ILE  83           HMG      ILE  83  -1.975   0.849   0.849
  673   2HG2  ILE  83           HMG      ILE  83  -3.570   1.502   1.502
  674   3HG2  ILE  83           HMG      ILE  83  -3.002  -0.033  -0.033
  675   1HD1  ILE  83           HMD      ILE  83  -3.304   3.409   3.409
  676   2HD1  ILE  83           HMD      ILE  83  -2.269   4.560   4.560
  677   3HD1  ILE  83           HMD      ILE  83  -4.031   4.552   4.552
  678    H    ALA  84           HN       ALA  84   0.526   0.048   0.048
  679    HA   ALA  84           HA       ALA  84   0.940  -0.712  -0.712
  680   1HB   ALA  84           HMB      ALA  84   1.503  -1.768  -1.768
  681   2HB   ALA  84           HMB      ALA  84   2.772  -2.181  -2.181
  682   3HB   ALA  84           HMB      ALA  84   1.073  -2.604  -2.604
  683    H    VAL  85           HN       VAL  85   2.841   1.284   1.284
  684    HA   VAL  85           HA       VAL  85   5.156   1.478   1.478
  685    HB   VAL  85           HB       VAL  85   3.979   3.388   3.388
  686   1HG1  VAL  85           HMG      VAL  85   5.308   4.449   4.449
  687   2HG1  VAL  85           HMG      VAL  85   6.728   3.687   3.687
  688   3HG1  VAL  85           HMG      VAL  85   5.752   4.859   4.859
  689   1HG2  VAL  85           HMG      VAL  85   5.019   1.199   1.199
  690   2HG2  VAL  85           HMG      VAL  85   5.662   2.702   2.702
  691   3HG2  VAL  85           HMG      VAL  85   6.569   1.861   1.861
  692    H    LEU  86           HN       LEU  86   2.252   3.530   3.530
  693    HA   LEU  86           HA       LEU  86   2.966   5.322   5.322
  694   1HB   LEU  86           HBS      LEU  86   1.383   5.587   5.587
  695   2HB   LEU  86           HBR      LEU  86   0.154   4.785   4.785
  696    HG   LEU  86           HG       LEU  86   0.106   6.573   6.573
  697   1HD1  LEU  86           HMD      LEU  86   2.715   7.248   7.248
  698   2HD1  LEU  86           HMD      LEU  86   1.658   8.638   8.638
  699   3HD1  LEU  86           HMD      LEU  86   2.112   7.511   7.511
  700   1HD2  LEU  86           HMD      LEU  86  -0.160   7.008   7.008
  701   2HD2  LEU  86           HMD      LEU  86  -1.271   7.416   7.416
  702   3HD2  LEU  86           HMD      LEU  86   0.065   8.520   8.520
  703    H    TYR  87           HN       TYR  87   1.128   2.326   2.326
  704    HA   TYR  87           HA       TYR  87   0.617   2.344   2.344
  705   1HB   TYR  87           HBS      TYR  87  -0.225   0.719   0.719
  706   2HB   TYR  87           HBR      TYR  87   1.284  -0.186  -0.186
  707    HD1  TYR  87           HD1      TYR  87   1.686  -0.218  -0.218
  708    HD2  TYR  87           HD2      TYR  87  -2.097   0.213   0.213
  709    HE1  TYR  87           HE1      TYR  87   0.591  -1.100  -1.100
  710    HE2  TYR  87           HE2      TYR  87  -3.212  -0.426  -0.426
  711    HH   TYR  87           HH       TYR  87  -1.355  -1.972  -1.972
  712    H    CYS  88           HN       CYS  88   3.436   1.248   1.248
  713    HA   CYS  88           HA       CYS  88   4.948   0.167   0.167
  714   1HB   CYS  88           HBS      CYS  88   5.249   0.568   0.568
  715   2HB   CYS  88           HBR      CYS  88   6.547   1.534   1.534
  716    H    VAL  89           HN       VAL  89   4.540   3.429   3.429
  717    HA   VAL  89           HA       VAL  89   6.508   4.575   4.575
  718    HB   VAL  89           HB       VAL  89   4.229   6.038   6.038
  719   1HG1  VAL  89           HMG      VAL  89   7.075   6.838   6.838
  720   2HG1  VAL  89           HMG      VAL  89   5.950   7.804   7.804
  721   3HG1  VAL  89           HMG      VAL  89   5.575   7.468   7.468
  722   1HG2  VAL  89           HMG      VAL  89   6.235   4.384   4.384
  723   2HG2  VAL  89           HMG      VAL  89   4.850   5.248   5.248
  724   3HG2  VAL  89           HMG      VAL  89   6.406   6.086   6.086
  725    H    HIS  90           HN       HIS  90   2.935   4.603   4.603
  726    HA   HIS  90           HA       HIS  90   2.761   6.242   6.242
  727   1HB   HIS  90           HBS      HIS  90   0.750   4.092   4.092
  728   2HB   HIS  90           HBR      HIS  90   0.462   5.447   5.447
  729    HD1  HIS  90           HD1      HIS  90   1.636   7.807   7.807
  730    HD2  HIS  90           HD2      HIS  90  -0.957   4.885   4.885
  731    HE1  HIS  90           HE1      HIS  90   0.400   8.844   8.844
  732    HE2  HIS  90           HE2      HIS  90  -1.126   7.061   7.061
  733    H    GLN  91           HN       GLN  91   3.351   2.811   2.811
  734    HA   GLN  91           HA       GLN  91   2.663   2.080   2.080
  735   1HB   GLN  91           HBS      GLN  91   2.719   0.382   0.382
  736   2HB   GLN  91           HBR      GLN  91   4.451   0.701   0.701
  737   1HG   GLN  91           HGR      GLN  91   4.040  -1.326  -1.326
  738   2HG   GLN  91           HGS      GLN  91   5.023  -0.096  -0.096
  739   1HE2  GLN  91           HE2      GLN  91   1.350  -1.265  -1.265
  740   2HE2  GLN  91           HE2      GLN  91   1.971  -1.780  -1.780
  741    H    ARG  92           HN       ARG  92   5.694   2.887   2.887
  742    HA   ARG  92           HA       ARG  92   7.268   3.825   3.825
  743   1HB   ARG  92           HBR      ARG  92   6.790   1.886   1.886
  744   2HB   ARG  92           HBS      ARG  92   7.391   0.794   0.794
  745   1HG   ARG  92           HGR      ARG  92   9.120   0.981   0.981
  746   2HG   ARG  92           HGS      ARG  92   9.619   1.977   1.977
  747   1HD   ARG  92           HDS      ARG  92   9.986   2.989   2.989
  748   2HD   ARG  92           HDR      ARG  92   9.058   3.977   3.977
  749    HE   ARG  92           HE       ARG  92   7.644   2.335   2.335
  750   1HH1  ARG  92           HH1      ARG  92   8.628   5.518   5.518
  751   2HH1  ARG  92           HH1      ARG  92   7.329   6.332   6.332
  752   1HH2  ARG  92           HH2      ARG  92   5.883   3.419   3.419
  753   2HH2  ARG  92           HH2      ARG  92   5.774   5.145   5.145
  754    H    ILE  93           HN       ILE  93   6.997   1.384   1.384
  755    HA   ILE  93           HA       ILE  93   9.871   1.077   1.077
  756    HB   ILE  93           HB       ILE  93   7.532   0.203   0.203
  757   1HG1  ILE  93           HG1      ILE  93   8.332  -2.040  -2.040
  758   2HG1  ILE  93           HG1      ILE  93   8.388  -0.727  -0.727
  759   1HG2  ILE  93           HMG      ILE  93   9.742   0.075   0.075
  760   2HG2  ILE  93           HMG      ILE  93  10.310  -0.975  -0.975
  761   3HG2  ILE  93           HMG      ILE  93   9.005  -1.530  -1.530
  762   1HD1  ILE  93           HMD      ILE  93   5.990  -0.236  -0.236
  763   2HD1  ILE  93           HMD      ILE  93   6.081  -2.013  -2.013
  764   3HD1  ILE  93           HMD      ILE  93   6.210  -1.222  -1.222
  765    H    ASP  94           HN       ASP  94  11.046   1.947   1.947
  766    HA   ASP  94           HA       ASP  94   9.574   3.654   3.654
  767   1HB   ASP  94           HBS      ASP  94  11.356   5.218   5.218
  768   2HB   ASP  94           HBR      ASP  94  10.779   5.204   5.204
  769    H    VAL  95           HN       VAL  95  10.270   3.567   3.567
  770    HA   VAL  95           HA       VAL  95  12.143   1.335   1.335
  771    HB   VAL  95           HB       VAL  95  10.577   0.342   0.342
  772   1HG1  VAL  95           HMG      VAL  95   9.225   1.458   1.458
  773   2HG1  VAL  95           HMG      VAL  95   8.434   0.278   0.278
  774   3HG1  VAL  95           HMG      VAL  95   9.958  -0.145  -0.145
  775   1HG2  VAL  95           HMG      VAL  95   9.610   2.977   2.977
  776   2HG2  VAL  95           HMG      VAL  95   9.264   1.451   1.451
  777   3HG2  VAL  95           HMG      VAL  95   8.247   1.958   1.958
  778    H    LYS  96           HN       LYS  96  12.077   1.285   1.285
  779    HA   LYS  96           HA       LYS  96  13.419   3.816   3.816
  780   1HB   LYS  96           HBR      LYS  96  15.421   2.448   2.448
  781   2HB   LYS  96           HBS      LYS  96  15.288   2.790   2.790
  782   1HG   LYS  96           HGR      LYS  96  15.483   0.608   0.608
  783   2HG   LYS  96           HGS      LYS  96  13.967   0.311   0.311
  784   1HD   LYS  96           HDS      LYS  96  15.795  -1.074  -1.074
  785   2HD   LYS  96           HDR      LYS  96  15.103  -0.027  -0.027
  786   1HE   LYS  96           HES      LYS  96  17.258   0.368   0.368
  787   2HE   LYS  96           HER      LYS  96  17.061   1.583   1.583
  788   1HZ   LYS  96           HZA      LYS  96  17.919  -1.130  -1.130
  789   2HZ   LYS  96           HZB      LYS  96  19.005  -0.035  -0.035
  790   3HZ   LYS  96           HZC      LYS  96  18.167   0.253   0.253
  791    H    ASP  97           HN       ASP  97  12.501   0.479   0.479
  792    HA   ASP  97           HA       ASP  97  11.409   1.672   1.672
  793   1HB   ASP  97           HBS      ASP  97  12.881   0.174   0.174
  794   2HB   ASP  97           HBR      ASP  97  12.634  -1.041  -1.041
  795    H    THR  98           HN       THR  98   9.288   0.807   0.807
  796    HA   THR  98           HA       THR  98   7.521   0.709   0.709
  797    HB   THR  98           HB       THR  98   6.517  -0.504  -0.504
  798    HG1  THR  98           HG1      THR  98   7.322   2.072   2.072
  799   1HG2  THR  98           HMG      THR  98   5.135   0.289   0.289
  800   2HG2  THR  98           HMG      THR  98   5.500   1.948   1.948
  801   3HG2  THR  98           HMG      THR  98   4.623   0.833   0.833
  802    H    LYS  99           HN       LYS  99   8.826  -1.823  -1.823
  803    HA   LYS  99           HA       LYS  99   7.149  -3.953  -3.953
  804   1HB   LYS  99           HBS      LYS  99   9.193  -3.634  -3.634
  805   2HB   LYS  99           HBR      LYS  99   9.517  -5.065  -5.065
  806   1HG   LYS  99           HGR      LYS  99   8.203  -5.813  -5.813
  807   2HG   LYS  99           HGS      LYS  99   7.122  -5.777  -5.777
  808   1HD   LYS  99           HDR      LYS  99   5.815  -4.878  -4.878
  809   2HD   LYS  99           HDS      LYS  99   6.403  -3.474  -3.474
  810   1HE   LYS  99           HES      LYS  99   7.454  -4.569  -4.569
  811   2HE   LYS  99           HER      LYS  99   6.415  -3.134  -3.134
  812   1HZ   LYS  99           HZA      LYS  99   8.329  -2.387  -2.387
  813   2HZ   LYS  99           HZB      LYS  99   9.227  -3.480  -3.480
  814   3HZ   LYS  99           HZC      LYS  99   8.501  -2.256  -2.256
  815    H    GLU 100           HN       GLU 100  10.233  -2.468  -2.468
  816    HA   GLU 100           HA       GLU 100  11.126  -4.299  -4.299
  817   1HB   GLU 100           HBS      GLU 100  11.840  -1.986  -1.986
  818   2HB   GLU 100           HBR      GLU 100  11.352  -1.342  -1.342
  819   1HG   GLU 100           HGS      GLU 100  13.259  -3.567  -3.567
  820   2HG   GLU 100           HGR      GLU 100  13.836  -1.975  -1.975
  821    H    ALA 101           HN       ALA 101   8.952  -1.467  -1.467
  822    HA   ALA 101           HA       ALA 101   8.214  -1.742  -1.742
  823   1HB   ALA 101           HMB      ALA 101   7.728   0.089   0.089
  824   2HB   ALA 101           HMB      ALA 101   6.176  -0.786  -0.786
  825   3HB   ALA 101           HMB      ALA 101   6.816  -0.040  -0.040
  826    H    LEU 102           HN       LEU 102   6.740  -2.868  -2.868
  827    HA   LEU 102           HA       LEU 102   4.608  -4.246  -4.246
  828   1HB   LEU 102           HBR      LEU 102   5.812  -4.006  -4.006
  829   2HB   LEU 102           HBS      LEU 102   4.752  -5.414  -5.414
  830    HG   LEU 102           HG       LEU 102   2.919  -3.934  -3.934
  831   1HD1  LEU 102           HMD      LEU 102   4.411  -2.100  -2.100
  832   2HD1  LEU 102           HMD      LEU 102   4.727  -1.641  -1.641
  833   3HD1  LEU 102           HMD      LEU 102   3.071  -1.556  -1.556
  834   1HD2  LEU 102           HMD      LEU 102   3.524  -4.621  -4.621
  835   2HD2  LEU 102           HMD      LEU 102   2.444  -3.216  -3.216
  836   3HD2  LEU 102           HMD      LEU 102   4.168  -2.972  -2.972
  837    H    ASP 103           HN       ASP 103   7.896  -5.009  -5.009
  838    HA   ASP 103           HA       ASP 103   7.459  -7.879  -7.879
  839   1HB   ASP 103           HBR      ASP 103   9.519  -6.935  -6.935
  840   2HB   ASP 103           HBS      ASP 103   9.996  -6.350  -6.350
  841    H    LYS 104           HN       LYS 104   8.503  -5.167  -5.167
  842    HA   LYS 104           HA       LYS 104   8.069  -6.365  -6.365
  843   1HB   LYS 104           HBR      LYS 104   8.901  -3.945  -3.945
  844   2HB   LYS 104           HBS      LYS 104   7.174  -3.540  -3.540
  845   1HG   LYS 104           HGR      LYS 104   7.611  -3.272  -3.272
  846   2HG   LYS 104           HGS      LYS 104   7.792  -5.047  -5.047
  847   1HD   LYS 104           HDR      LYS 104  10.187  -4.746  -4.746
  848   2HD   LYS 104           HDS      LYS 104   9.988  -3.025  -3.025
  849   1HE   LYS 104           HER      LYS 104  10.942  -4.392  -4.392
  850   2HE   LYS 104           HES      LYS 104   9.691  -3.172  -3.172
  851   1HZ   LYS 104           HZA      LYS 104   8.080  -4.993  -4.993
  852   2HZ   LYS 104           HZB      LYS 104   9.293  -6.071  -6.071
  853   3HZ   LYS 104           HZC      LYS 104   9.176  -5.187  -5.187
  854    H    ILE 105           HN       ILE 105   5.785  -4.752  -4.752
  855    HA   ILE 105           HA       ILE 105   3.641  -5.025  -5.025
  856    HB   ILE 105           HB       ILE 105   3.637  -4.218  -4.218
  857   1HG1  ILE 105           HG1      ILE 105   5.271  -3.083  -3.083
  858   2HG1  ILE 105           HG1      ILE 105   4.217  -2.046  -2.046
  859   1HG2  ILE 105           HMG      ILE 105   1.551  -4.042  -4.042
  860   2HG2  ILE 105           HMG      ILE 105   1.727  -2.669  -2.669
  861   3HG2  ILE 105           HMG      ILE 105   1.401  -4.305  -4.305
  862   1HD1  ILE 105           HMD      ILE 105   2.684  -2.113  -2.113
  863   2HD1  ILE 105           HMD      ILE 105   4.230  -2.503  -2.503
  864   3HD1  ILE 105           HMD      ILE 105   4.061  -0.988  -0.988
  865    H    GLU 106           HN       GLU 106   4.755  -6.923  -6.923
  866    HA   GLU 106           HA       GLU 106   2.571  -8.750  -8.750
  867   1HB   GLU 106           HBR      GLU 106   4.283  -8.719  -8.719
  868   2HB   GLU 106           HBS      GLU 106   5.478  -8.662  -8.662
  869   1HG   GLU 106           HGR      GLU 106   5.951 -10.670 -10.670
  870   2HG   GLU 106           HGS      GLU 106   4.784 -11.033 -11.033
  871    H    GLU 107           HN       GLU 107   5.146  -8.294  -8.294
  872    HA   GLU 107           HA       GLU 107   4.663 -10.907 -10.907
  873   1HB   GLU 107           HBR      GLU 107   6.798  -9.245  -9.245
  874   2HB   GLU 107           HBS      GLU 107   6.368  -8.786  -8.786
  875   1HG   GLU 107           HGS      GLU 107   6.799 -10.769 -10.769
  876   2HG   GLU 107           HGR      GLU 107   7.061 -11.615 -11.615
  877    H    GLU 108           HN       GLU 108   2.757  -8.455  -8.455
  878    HA   GLU 108           HA       GLU 108   1.080  -7.742  -7.742
  879   1HB   GLU 108           HBR      GLU 108   1.698 -10.121 -10.121
  880   2HB   GLU 108           HBS      GLU 108   2.384  -9.128  -9.128
  881   1HG   GLU 108           HGS      GLU 108   0.659  -9.105  -9.105
  882   2HG   GLU 108           HGR      GLU 108  -0.157  -8.106  -8.106
  883    H    GLN 109           HN       GLN 109   4.030  -6.939  -6.939
  884    HA   GLN 109           HA       GLN 109   5.416  -5.251  -5.251
  885   1HB   GLN 109           HBR      GLN 109   4.358  -3.212  -3.212
  886   2HB   GLN 109           HBS      GLN 109   3.221  -4.190  -4.190
  887   1HG   GLN 109           HGS      GLN 109   2.793  -4.359  -4.359
  888   2HG   GLN 109           HGR      GLN 109   2.569  -2.729  -2.729
  889   1HE2  GLN 109           HE2      GLN 109  -0.700  -4.336  -4.336
  890   2HE2  GLN 109           HE2      GLN 109   0.468  -3.949  -3.949
  891    H    ASN 110           HN       ASN 110   4.819  -7.422  -7.422
  892    HA   ASN 110           HA       ASN 110   6.533  -6.076  -6.076
  893   1HB   ASN 110           HBS      ASN 110   5.564  -7.074  -7.074
  894   2HB   ASN 110           HBR      ASN 110   4.348  -6.084  -6.084
  895   1HD2  ASN 110           HD2      ASN 110   3.952 -10.189 -10.189
  896   2HD2  ASN 110           HD2      ASN 110   5.495  -9.438  -9.438
  897    H    LYS 111           HN       LYS 111   5.111  -9.253  -9.253
  898    HA   LYS 111           HA       LYS 111   7.575 -10.464 -10.464
  899   1HB   LYS 111           HBR      LYS 111   7.263 -10.164 -10.164
  900   2HB   LYS 111           HBS      LYS 111   7.009 -11.886 -11.886
  901   1HG   LYS 111           HGR      LYS 111   9.364 -10.475 -10.475
  902   2HG   LYS 111           HGS      LYS 111   9.431 -10.903 -10.903
  903   1HD   LYS 111           HDS      LYS 111   8.680 -13.248 -13.248
  904   2HD   LYS 111           HDR      LYS 111   9.155 -12.709 -12.709
  905   1HE   LYS 111           HES      LYS 111  11.420 -12.217 -12.217
  906   2HE   LYS 111           HER      LYS 111  10.933 -12.819 -12.819
  907   1HZ   LYS 111           HZB      LYS 111  10.307 -14.679 -14.679
  908   2HZ   LYS 111           HZC      LYS 111  11.893 -14.296 -14.296
  909   3HZ   LYS 111           HZA      LYS 111  11.255 -14.864 -14.864
  910    H    SER 112           HN       SER 112   7.283 -13.009 -13.009
  911    HA   SER 112           HA       SER 112   6.069 -14.942 -14.942
  912   1HB   SER 112           HBS      SER 112   4.522 -13.362 -13.362
  913   2HB   SER 112           HBR      SER 112   3.389 -13.729 -13.729
  914    HG   SER 112           HG       SER 112   4.078 -15.991 -15.991
  915    H    LYS 113           HN       LYS 113   5.894 -15.975 -15.975
  916    HA   LYS 113           HA       LYS 113   3.579 -15.916 -15.916
  917   1HB   LYS 113           HBR      LYS 113   5.051 -13.756 -13.756
  918   2HB   LYS 113           HBS      LYS 113   5.599 -15.027 -15.027
  919   1HG   LYS 113           HGR      LYS 113   2.688 -14.299 -14.299
  920   2HG   LYS 113           HGS      LYS 113   3.674 -13.676 -13.676
  921   1HD   LYS 113           HDS      LYS 113   3.200 -15.435 -15.435
  922   2HD   LYS 113           HDR      LYS 113   3.988 -16.451 -16.451
  923   1HE   LYS 113           HES      LYS 113   1.958 -17.441 -17.441
  924   2HE   LYS 113           HER      LYS 113   1.702 -16.214 -16.214
  925   1HZ   LYS 113           HZA      LYS 113   0.919 -14.805 -14.805
  926   2HZ   LYS 113           HZB      LYS 113   0.731 -16.225 -16.225
  927   3HZ   LYS 113           HZC      LYS 113  -0.089 -15.942 -15.942
  928    H    LYS 114           HN       LYS 114   3.455 -17.661 -17.661
  929    HA   LYS 114           HA       LYS 114   5.828 -19.460 -19.460
  930   1HB   LYS 114           HBR      LYS 114   4.043 -20.006 -20.006
  931   2HB   LYS 114           HBS      LYS 114   2.878 -20.138 -20.138
  932   1HG   LYS 114           HGR      LYS 114   4.236 -21.997 -21.997
  933   2HG   LYS 114           HGS      LYS 114   5.321 -21.893 -21.893
  934   1HD   LYS 114           HDS      LYS 114   3.850 -22.843 -22.843
  935   2HD   LYS 114           HDR      LYS 114   2.464 -22.148 -22.148
  936   1HE   LYS 114           HES      LYS 114   2.478 -23.781 -23.781
  937   2HE   LYS 114           HER      LYS 114   4.063 -24.399 -24.399
  938   1HZ   LYS 114           HZB      LYS 114   3.007 -25.077 -25.077
  939   2HZ   LYS 114           HZC      LYS 114   1.557 -24.521 -24.521
  940   3HZ   LYS 114           HZA      LYS 114   2.266 -25.774 -25.774
  941    H    LYS 115           HN       LYS 115   2.627 -19.844 -19.844
  942    HA   LYS 115           HA       LYS 115   2.002 -20.496 -20.496
  943   1HB   LYS 115           HBR      LYS 115   3.688 -18.532 -18.532
  944   2HB   LYS 115           HBS      LYS 115   4.675 -19.910 -19.910
  945   1HG   LYS 115           HGR      LYS 115   1.960 -20.235 -20.235
  946   2HG   LYS 115           HGS      LYS 115   2.542 -18.601 -18.601
  947   1HD   LYS 115           HDS      LYS 115   4.028 -19.341 -19.341
  948   2HD   LYS 115           HDR      LYS 115   4.505 -20.690 -20.690
  949   1HE   LYS 115           HES      LYS 115   3.578 -21.685 -21.685
  950   2HE   LYS 115           HER      LYS 115   2.307 -21.784 -21.784
  951   1HZ   LYS 115           HZA      LYS 115   1.923 -19.412 -19.412
  952   2HZ   LYS 115           HZB      LYS 115   2.241 -20.475 -20.475
  953   3HZ   LYS 115           HZC      LYS 115   1.020 -20.765 -20.765
  954    H    ALA 116           HN       ALA 116   2.580 -22.148 -22.148
  955    HA   ALA 116           HA       ALA 116   4.988 -23.648 -23.648
  956   1HB   ALA 116           HMB      ALA 116   2.489 -24.817 -24.817
  957   2HB   ALA 116           HMB      ALA 116   3.723 -25.861 -25.861
  958   3HB   ALA 116           HMB      ALA 116   4.158 -24.811 -24.811
  959    H    GLN 117           HN       GLN 117   1.803 -24.998 -24.998
  960    HA   GLN 117           HA       GLN 117   0.915 -25.781 -25.781
  961   1HB   GLN 117           HBR      GLN 117   2.702 -23.662 -23.662
  962   2HB   GLN 117           HBS      GLN 117   1.922 -24.877 -24.877
  963   1HG   GLN 117           HGS      GLN 117  -0.165 -24.041 -24.041
  964   2HG   GLN 117           HGR      GLN 117   0.790 -22.544 -22.544
  965   1HE2  GLN 117           HE2      GLN 117  -1.649 -23.811 -23.811
  966   2HE2  GLN 117           HE2      GLN 117  -1.612 -24.452 -24.452
  967    H    GLN 118           HN       GLN 118   1.540 -27.081 -27.081
  968    HA   GLN 118           HA       GLN 118   4.272 -27.823 -27.823
  969   1HB   GLN 118           HBR      GLN 118   2.944 -29.391 -29.391
  970   2HB   GLN 118           HBS      GLN 118   3.013 -30.373 -30.373
  971   1HG   GLN 118           HGS      GLN 118   5.526 -28.994 -28.994
  972   2HG   GLN 118           HGR      GLN 118   5.011 -30.109 -30.109
  973   1HE2  GLN 118           HE2      GLN 118   6.155 -32.911 -32.911
  974   2HE2  GLN 118           HE2      GLN 118   5.831 -32.036 -32.036
  975    H    ALA 119           HN       ALA 119   1.497 -29.976 -29.976
  976    HA   ALA 119           HA       ALA 119   0.656 -30.956 -30.956
  977   1HB   ALA 119           HMB      ALA 119   0.015 -28.643 -28.643
  978   2HB   ALA 119           HMB      ALA 119   1.581 -28.455 -28.455
  979   3HB   ALA 119           HMB      ALA 119   0.406 -29.666 -29.666
  980    H    ALA 120           HN       ALA 120   1.346 -31.905 -31.905
  981    HA   ALA 120           HA       ALA 120   3.903 -31.706 -31.706
  982   1HB   ALA 120           HMB      ALA 120   3.728 -33.598 -33.598
  983   2HB   ALA 120           HMB      ALA 120   4.673 -34.085 -34.085
  984   3HB   ALA 120           HMB      ALA 120   5.081 -32.584 -32.584
  985    H    ALA 121           HN       ALA 121   3.009 -32.006 -32.006
  986    HA   ALA 121           HA       ALA 121   2.590 -33.215 -33.215
  987   1HB   ALA 121           HMB      ALA 121   4.395 -34.603 -34.603
  988   2HB   ALA 121           HMB      ALA 121   3.067 -35.790 -35.790
  989   3HB   ALA 121           HMB      ALA 121   3.660 -35.212 -35.212
  990    H    ASP 122           HN       ASP 122   1.062 -34.509 -34.509
  991    HA   ASP 122           HA       ASP 122  -0.635 -36.297 -36.297
  992   1HB   ASP 122           HBS      ASP 122  -2.832 -35.108 -35.108
  993   2HB   ASP 122           HBR      ASP 122  -1.712 -34.696 -34.696
  994    H    THR 123           HN       THR 123  -0.130 -37.410 -37.410
  995    HA   THR 123           HA       THR 123  -2.137 -37.450 -37.450
  996    HB   THR 123           HB       THR 123  -0.990 -35.357 -35.357
  997    HG1  THR 123           HG1      THR 123  -2.242 -36.451 -36.451
  998   1HG2  THR 123           HMG      THR 123   1.366 -36.083 -36.083
  999   2HG2  THR 123           HMG      THR 123   1.157 -37.276 -37.276
 1000   3HG2  THR 123           HMG      THR 123   1.027 -35.533 -35.533
 1001    H    GLY 124           HN       GLY 124  -1.508 -38.924 -38.924
 1002   1HA   GLY 124           HAR      GLY 124   0.268 -40.339 -40.339
 1003   2HA   GLY 124           HAS      GLY 124   0.693 -40.795 -40.795
 1004    H    ASN 125           HN       ASN 125  -1.110 -41.580 -41.580
 1005    HA   ASN 125           HA       ASN 125  -1.545 -44.152 -44.152
 1006   1HB   ASN 125           HBS      ASN 125  -3.543 -42.523 -42.523
 1007   2HB   ASN 125           HBR      ASN 125  -4.302 -43.371 -43.371
 1008   1HD2  ASN 125           HD2      ASN 125  -3.851 -46.655 -46.655
 1009   2HD2  ASN 125           HD2      ASN 125  -3.779 -45.799 -45.799
 1010    H    ASN 126           HN       ASN 126  -1.280 -45.297 -45.297
 1011    HA   ASN 126           HA       ASN 126  -1.544 -46.172 -46.172
 1012   1HB   ASN 126           HBS      ASN 126  -4.132 -44.901 -44.901
 1013   2HB   ASN 126           HBR      ASN 126  -3.856 -45.356 -45.356
 1014   1HD2  ASN 126           HD2      ASN 126  -5.309 -48.413 -48.413
 1015   2HD2  ASN 126           HD2      ASN 126  -5.596 -46.897 -46.897
 1016    H    SER 127           HN       SER 127  -0.244 -45.714 -45.714
 1017    HA   SER 127           HA       SER 127  -1.016 -44.032 -44.032
 1018   1HB   SER 127           HBS      SER 127   1.298 -42.587 -42.587
 1019   2HB   SER 127           HBR      SER 127  -0.376 -42.003 -42.003
 1020    HG   SER 127           HG       SER 127  -0.327 -42.213 -42.213
 1021    H    GLN 128           HN       GLN 128  -0.053 -46.661 -46.661
 1022    HA   GLN 128           HA       GLN 128   2.287 -46.700 -46.700
 1023   1HB   GLN 128           HBR      GLN 128   1.987 -48.013 -48.013
 1024   2HB   GLN 128           HBS      GLN 128   3.030 -48.717 -48.717
 1025   1HG   GLN 128           HGS      GLN 128   4.633 -47.194 -47.194
 1026   2HG   GLN 128           HGR      GLN 128   3.461 -45.848 -45.848
 1027   1HE2  GLN 128           HE2      GLN 128   2.843 -46.567 -46.567
 1028   2HE2  GLN 128           HE2      GLN 128   1.911 -46.517 -46.517
 1029    H    VAL 129           HN       VAL 129   2.725 -49.293 -49.293
 1030    HA   VAL 129           HA       VAL 129   0.280 -50.698 -50.698
 1031    HB   VAL 129           HB       VAL 129   0.274 -49.039 -49.039
 1032   1HG1  VAL 129           HMG      VAL 129   2.741 -48.471 -48.471
 1033   2HG1  VAL 129           HMG      VAL 129   3.039 -49.839 -49.839
 1034   3HG1  VAL 129           HMG      VAL 129   2.040 -48.467 -48.467
 1035   1HG2  VAL 129           HMG      VAL 129   1.297 -51.683 -51.683
 1036   2HG2  VAL 129           HMG      VAL 129  -0.391 -51.230 -51.230
 1037   3HG2  VAL 129           HMG      VAL 129   0.498 -50.430 -50.430
 1038    H    SER 130           HN       SER 130   0.745 -52.713 -52.713
 1039    HA   SER 130           HA       SER 130   3.317 -53.808 -53.808
 1040   1HB   SER 130           HBS      SER 130   1.523 -54.489 -54.489
 1041   2HB   SER 130           HBR      SER 130   0.535 -55.006 -55.006
 1042    HG   SER 130           HG       SER 130   2.474 -56.271 -56.271
 1043    H    GLN 131           HN       GLN 131   1.052 -53.638 -53.638
 1044    HA   GLN 131           HA       GLN 131   1.140 -54.380 -54.380
 1045   1HB   GLN 131           HBR      GLN 131   3.732 -54.028 -54.028
 1046   2HB   GLN 131           HBS      GLN 131   3.736 -55.814 -55.814
 1047   1HG   GLN 131           HGS      GLN 131   2.137 -55.116 -55.116
 1048   2HG   GLN 131           HGR      GLN 131   3.447 -53.901 -53.901
 1049   1HE2  GLN 131           HE2      GLN 131   5.994 -56.082 -56.082
 1050   2HE2  GLN 131           HE2      GLN 131   5.586 -54.547 -54.547
 1051    H    ASN 132           HN       ASN 132   3.052 -56.956 -56.956
 1052    HA   ASN 132           HA       ASN 132   1.199 -58.862 -58.862
 1053   1HB   ASN 132           HBS      ASN 132   3.955 -58.785 -58.785
 1054   2HB   ASN 132           HBR      ASN 132   3.354 -60.089 -60.089
 1055   1HD2  ASN 132           HD2      ASN 132   3.322 -62.330 -62.330
 1056   2HD2  ASN 132           HD2      ASN 132   3.706 -61.972 -61.972
 1057    H    TYR 133           HN       TYR 133   1.381 -61.048 -61.048
 1058    HA   TYR 133           HA       TYR 133  -0.911 -60.584 -60.584
 1059   1HB   TYR 133           HBS      TYR 133  -0.774 -62.881 -62.881
 1060   2HB   TYR 133           HBR      TYR 133  -0.264 -62.753 -62.753
 1061    HD1  TYR 133           HD1      TYR 133   2.348 -62.617 -62.617
 1062    HD2  TYR 133           HD2      TYR 133   0.562 -64.055 -64.055
 1063    HE1  TYR 133           HE1      TYR 133   4.412 -63.840 -63.840
 1064    HE2  TYR 133           HE2      TYR 133   2.607 -65.305 -65.305
 1065    HH   TYR 133           HH       TYR 133   5.455 -64.689 -64.689

  Start of MODEL    2
    1   1H    HIS   1           HNB      HIS   1  -6.822  23.820  23.820
    2   2H    HIS   1           HN       HIS   1  -5.283  24.093  24.093
    3   3H    HIS   1           HNC      HIS   1  -6.528  24.619  24.619
    4    HA   HIS   1           HA       HIS   1  -7.221  26.166  26.166
    5   1HB   HIS   1           HBS      HIS   1  -5.455  26.918  26.918
    6   2HB   HIS   1           HBR      HIS   1  -4.206  26.389  26.389
    7    HD1  HIS   1           HD1      HIS   1  -4.005  27.830  27.830
    8    HD2  HIS   1           HD2      HIS   1  -6.714  29.296  29.296
    9    HE1  HIS   1           HE1      HIS   1  -4.675  30.112  30.112
   10    HE2  HIS   1           HE2      HIS   1  -6.331  30.995  30.995
   11    H    MET   2           HN       MET   2  -7.844  25.463  25.463
   12    HA   MET   2           HA       MET   2  -7.760  25.151  25.151
   13   1HB   MET   2           HBS      MET   2  -6.282  27.335  27.335
   14   2HB   MET   2           HBR      MET   2  -5.044  26.324  26.324
   15   1HG   MET   2           HGR      MET   2  -6.629  25.971  25.971
   16   2HG   MET   2           HGS      MET   2  -7.769  27.105  27.105
   17   1HE   MET   2           HME      MET   2  -7.024  29.540  29.540
   18   2HE   MET   2           HME      MET   2  -5.448  29.033  29.033
   19   3HE   MET   2           HME      MET   2  -5.533  30.370  30.370
   20    H    GLY   3           HN       GLY   3  -6.712  24.050  24.050
   21   1HA   GLY   3           HAS      GLY   3  -5.901  22.060  22.060
   22   2HA   GLY   3           HAR      GLY   3  -4.600  22.128  22.128
   23    H    ALA   4           HN       ALA   4  -8.165  21.707  21.707
   24    HA   ALA   4           HA       ALA   4  -8.029  20.211  20.211
   25   1HB   ALA   4           HMB      ALA   4  -9.668  22.151  22.151
   26   2HB   ALA   4           HMB      ALA   4 -10.611  20.738  20.738
   27   3HB   ALA   4           HMB      ALA   4 -10.156  20.904  20.904
   28    H    ARG   5           HN       ARG   5  -7.164  19.049  19.049
   29    HA   ARG   5           HA       ARG   5  -8.665  16.520  16.520
   30   1HB   ARG   5           HBS      ARG   5  -7.427  16.971  16.971
   31   2HB   ARG   5           HBR      ARG   5  -8.849  15.998  15.998
   32   1HG   ARG   5           HGS      ARG   5  -8.736  19.015  19.015
   33   2HG   ARG   5           HGR      ARG   5  -9.534  17.843  17.843
   34   1HD   ARG   5           HDS      ARG   5 -11.344  17.758  17.758
   35   2HD   ARG   5           HDR      ARG   5 -10.387  17.550  17.550
   36    HE   ARG   5           HE       ARG   5 -10.067  20.091  20.091
   37   1HH1  ARG   5           HH1      ARG   5 -12.993  18.345  18.345
   38   2HH1  ARG   5           HH1      ARG   5 -13.992  19.757  19.757
   39   1HH2  ARG   5           HH2      ARG   5 -11.383  21.937  21.937
   40   2HH2  ARG   5           HH2      ARG   5 -13.083  21.788  21.788
   41    H    ALA   6           HN       ALA   6  -6.033  17.973  17.973
   42    HA   ALA   6           HA       ALA   6  -3.771  17.635  17.635
   43   1HB   ALA   6           HMB      ALA   6  -5.044  15.057  15.057
   44   2HB   ALA   6           HMB      ALA   6  -3.464  14.904  14.904
   45   3HB   ALA   6           HMB      ALA   6  -3.573  15.670  15.670
   46    H    SER   7           HN       SER   7  -2.093  15.829  15.829
   47    HA   SER   7           HA       SER   7  -2.658  16.270  16.270
   48   1HB   SER   7           HBS      SER   7  -0.573  17.400  17.400
   49   2HB   SER   7           HBR      SER   7   0.069  15.865  15.865
   50    HG   SER   7           HG       SER   7   0.630  15.223  15.223
   51    H    VAL   8           HN       VAL   8  -1.086  14.368  14.368
   52    HA   VAL   8           HA       VAL   8  -2.150  11.795  11.795
   53    HB   VAL   8           HB       VAL   8   0.232  12.633  12.633
   54   1HG1  VAL   8           HMG      VAL   8  -0.291  10.063  10.063
   55   2HG1  VAL   8           HMG      VAL   8  -0.781  10.027  10.027
   56   3HG1  VAL   8           HMG      VAL   8   0.869  10.527  10.527
   57   1HG2  VAL   8           HMG      VAL   8  -2.433  12.956  12.956
   58   2HG2  VAL   8           HMG      VAL   8  -1.122  12.864  12.864
   59   3HG2  VAL   8           HMG      VAL   8  -2.062  11.408  11.408
   60    H    LEU   9           HN       LEU   9   1.101  13.243  13.243
   61    HA   LEU   9           HA       LEU   9   1.764  10.942  10.942
   62   1HB   LEU   9           HBR      LEU   9   3.266  12.674  12.674
   63   2HB   LEU   9           HBS      LEU   9   4.102  11.568  11.568
   64    HG   LEU   9           HG       LEU   9   1.953  10.459  10.459
   65   1HD1  LEU   9           HMD      LEU   9   4.760  11.192  11.192
   66   2HD1  LEU   9           HMD      LEU   9   3.695  10.049  10.049
   67   3HD1  LEU   9           HMD      LEU   9   3.221  11.760  11.760
   68   1HD2  LEU   9           HMD      LEU   9   4.596   9.551   9.551
   69   2HD2  LEU   9           HMD      LEU   9   2.954   9.035   9.035
   70   3HD2  LEU   9           HMD      LEU   9   3.620   8.566   8.566
   71    H    SER  10           HN       SER  10   4.112  11.692  11.692
   72    HA   SER  10           HA       SER  10   3.498  14.069  14.069
   73   1HB   SER  10           HBR      SER  10   4.933  13.261  13.261
   74   2HB   SER  10           HBS      SER  10   4.020  11.824  11.824
   75    HG   SER  10           HG       SER  10   5.755  10.863  10.863
   76    H    GLY  11           HN       GLY  11   5.851  14.957  14.957
   77   1HA   GLY  11           HAR      GLY  11   7.026  16.304  16.304
   78   2HA   GLY  11           HAS      GLY  11   7.808  16.043  16.043
   79    H    GLY  12           HN       GLY  12   8.765  13.822  13.822
   80   1HA   GLY  12           HAR      GLY  12  10.747  13.340  13.340
   81   2HA   GLY  12           HAS      GLY  12  10.300  12.207  12.207
   82    H    GLU  13           HN       GLU  13   7.681  11.594  11.594
   83    HA   GLU  13           HA       GLU  13   8.182   9.369   9.369
   84   1HB   GLU  13           HBR      GLU  13   5.705  10.850  10.850
   85   2HB   GLU  13           HBS      GLU  13   5.611   9.549   9.549
   86   1HG   GLU  13           HGS      GLU  13   6.503   8.038   8.038
   87   2HG   GLU  13           HGR      GLU  13   6.626   9.305   9.305
   88    H    LEU  14           HN       LEU  14   7.121  12.622  12.622
   89    HA   LEU  14           HA       LEU  14   6.558  12.120  12.120
   90   1HB   LEU  14           HBR      LEU  14   6.084  14.134  14.134
   91   2HB   LEU  14           HBS      LEU  14   7.587  14.735  14.735
   92    HG   LEU  14           HG       LEU  14   6.585  14.833  14.833
   93   1HD1  LEU  14           HMD      LEU  14   4.461  13.160  13.160
   94   2HD1  LEU  14           HMD      LEU  14   4.007  14.260  14.260
   95   3HD1  LEU  14           HMD      LEU  14   5.232  12.995  12.995
   96   1HD2  LEU  14           HMD      LEU  14   5.109  15.952  15.952
   97   2HD2  LEU  14           HMD      LEU  14   6.002  16.782  16.782
   98   3HD2  LEU  14           HMD      LEU  14   4.371  16.132  16.132
   99    H    ASP  15           HN       ASP  15   9.328  13.519  13.519
  100    HA   ASP  15           HA       ASP  15  10.946  13.807  13.807
  101   1HB   ASP  15           HBS      ASP  15  11.099  14.760  14.760
  102   2HB   ASP  15           HBR      ASP  15  12.271  13.421  13.421
  103    H    LYS  16           HN       LYS  16  10.102  10.993  10.993
  104    HA   LYS  16           HA       LYS  16  12.234   9.471   9.471
  105   1HB   LYS  16           HBS      LYS  16  11.260   9.317   9.317
  106   2HB   LYS  16           HBR      LYS  16  10.399   7.992   7.992
  107   1HG   LYS  16           HGS      LYS  16  12.408   7.078   7.078
  108   2HG   LYS  16           HGR      LYS  16  12.639   7.172   7.172
  109   1HD   LYS  16           HDS      LYS  16  14.652   7.912   7.912
  110   2HD   LYS  16           HDR      LYS  16  13.810   9.356   9.356
  111   1HE   LYS  16           HES      LYS  16  14.632   9.964   9.964
  112   2HE   LYS  16           HER      LYS  16  12.955   9.466   9.466
  113   1HZ   LYS  16           HZA      LYS  16  14.473   7.212   7.212
  114   2HZ   LYS  16           HZB      LYS  16  15.368   8.364   8.364
  115   3HZ   LYS  16           HZC      LYS  16  13.840   8.073   8.073
  116    H    TRP  17           HN       TRP  17   8.862  10.200  10.200
  117    HA   TRP  17           HA       TRP  17   8.001   8.003   8.003
  118   1HB   TRP  17           HBS      TRP  17   6.327   9.203   9.203
  119   2HB   TRP  17           HBR      TRP  17   6.867  10.760  10.760
  120    HD1  TRP  17           HD1      TRP  17   6.222  11.218  11.218
  121    HE1  TRP  17           HE1      TRP  17   4.737  10.022  10.022
  122    HE3  TRP  17           HE3      TRP  17   5.165   7.041   7.041
  123    HZ2  TRP  17           HZ2      TRP  17   3.265   7.639   7.639
  124    HZ3  TRP  17           HZ3      TRP  17   3.689   5.350   5.350
  125    HH2  TRP  17           HH2      TRP  17   2.861   5.571   5.571
  126    H    GLU  18           HN       GLU  18   9.394  11.240  11.240
  127    HA   GLU  18           HA       GLU  18   8.694  11.348  11.348
  128   1HB   GLU  18           HBS      GLU  18   8.668  13.055  13.055
  129   2HB   GLU  18           HBR      GLU  18  10.334  13.067  13.067
  130   1HG   GLU  18           HGS      GLU  18  10.550  14.540  14.540
  131   2HG   GLU  18           HGR      GLU  18   9.444  13.723  13.723
  132    H    LYS  19           HN       LYS  19  10.359   9.169   9.169
  133    HA   LYS  19           HA       LYS  19  11.457   9.649   9.649
  134   1HB   LYS  19           HBS      LYS  19  13.308  10.849  10.849
  135   2HB   LYS  19           HBR      LYS  19  13.670   9.417   9.417
  136   1HG   LYS  19           HGS      LYS  19  13.668   8.536   8.536
  137   2HG   LYS  19           HGR      LYS  19  14.583  10.070  10.070
  138   1HD   LYS  19           HDR      LYS  19  15.035   7.764   7.764
  139   2HD   LYS  19           HDS      LYS  19  15.841   7.864   7.864
  140   1HE   LYS  19           HER      LYS  19  16.223  10.366  10.366
  141   2HE   LYS  19           HES      LYS  19  16.437   9.175   9.175
  142   1HZ   LYS  19           HZA      LYS  19  17.719   8.470   8.470
  143   2HZ   LYS  19           HZB      LYS  19  18.307   9.840   9.840
  144   3HZ   LYS  19           HZC      LYS  19  18.299   8.450   8.450
  145    H    ILE  20           HN       ILE  20   9.941   7.849   7.849
  146    HA   ILE  20           HA       ILE  20  11.253   5.326   5.326
  147    HB   ILE  20           HB       ILE  20   8.316   6.129   6.129
  148   1HG1  ILE  20           HG1      ILE  20  10.146   4.845   4.845
  149   2HG1  ILE  20           HG1      ILE  20   9.997   6.612   6.612
  150   1HG2  ILE  20           HMG      ILE  20   8.394   3.907   3.907
  151   2HG2  ILE  20           HMG      ILE  20   9.378   3.309   3.309
  152   3HG2  ILE  20           HMG      ILE  20   7.707   3.868   3.868
  153   1HD1  ILE  20           HMD      ILE  20   7.386   5.925   5.925
  154   2HD1  ILE  20           HMD      ILE  20   8.163   4.683   4.683
  155   3HD1  ILE  20           HMD      ILE  20   8.446   6.413   6.413
  156    H    ARG  21           HN       ARG  21  10.401   3.445   3.445
  157    HA   ARG  21           HA       ARG  21  10.725   4.299   4.299
  158   1HB   ARG  21           HBS      ARG  21  12.121   2.479   2.479
  159   2HB   ARG  21           HBR      ARG  21  11.261   1.510   1.510
  160   1HG   ARG  21           HGS      ARG  21  13.054   1.909   1.909
  161   2HG   ARG  21           HGR      ARG  21  12.341   3.532   3.532
  162   1HD   ARG  21           HDS      ARG  21  14.542   3.940   3.940
  163   2HD   ARG  21           HDR      ARG  21  13.603   4.183   4.183
  164    HE   ARG  21           HE       ARG  21  14.338   1.602   1.602
  165   1HH1  ARG  21           HH1      ARG  21  16.277   4.298   4.298
  166   2HH1  ARG  21           HH1      ARG  21  17.725   3.733   3.733
  167   1HH2  ARG  21           HH2      ARG  21  16.220   0.967   0.967
  168   2HH2  ARG  21           HH2      ARG  21  17.694   1.847   1.847
  169    H    LEU  22           HN       LEU  22   9.355   3.745   3.745
  170    HA   LEU  22           HA       LEU  22   7.462   1.504   1.504
  171   1HB   LEU  22           HBS      LEU  22   6.395   2.759   2.759
  172   2HB   LEU  22           HBR      LEU  22   5.879   2.982   2.982
  173    HG   LEU  22           HG       LEU  22   7.776   4.917   4.917
  174   1HD1  LEU  22           HMD      LEU  22   7.640   4.150   4.150
  175   2HD1  LEU  22           HMD      LEU  22   6.303   5.326   5.326
  176   3HD1  LEU  22           HMD      LEU  22   7.945   5.828   5.828
  177   1HD2  LEU  22           HMD      LEU  22   5.072   4.644   4.644
  178   2HD2  LEU  22           HMD      LEU  22   5.982   6.174   6.174
  179   3HD2  LEU  22           HMD      LEU  22   5.130   5.713   5.713
  180    H    ARG  23           HN       ARG  23  10.266   1.441   1.441
  181    HA   ARG  23           HA       ARG  23   9.930  -0.902  -0.902
  182   1HB   ARG  23           HBR      ARG  23  11.228  -0.295  -0.295
  183   2HB   ARG  23           HBS      ARG  23   9.448  -0.163  -0.163
  184   1HG   ARG  23           HGS      ARG  23  10.002   2.333   2.333
  185   2HG   ARG  23           HGR      ARG  23  11.533   1.985   1.985
  186   1HD   ARG  23           HDS      ARG  23   9.273   1.009   1.009
  187   2HD   ARG  23           HDR      ARG  23   9.083   2.742   2.742
  188    HE   ARG  23           HE       ARG  23  11.158   3.176   3.176
  189   1HH1  ARG  23           HH1      ARG  23  10.194  -0.209  -0.209
  190   2HH1  ARG  23           HH1      ARG  23  11.030  -0.478  -0.478
  191   1HH2  ARG  23           HH2      ARG  23  12.132   2.821   2.821
  192   2HH2  ARG  23           HH2      ARG  23  12.129   1.235   1.235
  193    HA   PRO  24           HA       PRO  24  13.883  -1.035  -1.035
  194   1HB   PRO  24           HBR      PRO  24  14.473  -3.553  -3.553
  195   2HB   PRO  24           HBS      PRO  24  13.623  -3.119  -3.119
  196   1HG   PRO  24           HGR      PRO  24  12.671  -4.330  -4.330
  197   2HG   PRO  24           HGS      PRO  24  11.962  -4.244  -4.244
  198   1HD   PRO  24           HDS      PRO  24  11.288  -2.767  -2.767
  199   2HD   PRO  24           HDR      PRO  24  10.717  -2.561  -2.561
  200    H    GLY  25           HN       GLY  25  13.636  -2.277  -2.277
  201   1HA   GLY  25           HAS      GLY  25  16.484  -1.534  -1.534
  202   2HA   GLY  25           HAR      GLY  25  15.515  -2.646  -2.646
  203    H    GLY  26           HN       GLY  26  13.977   0.209   0.209
  204   1HA   GLY  26           HAS      GLY  26  14.537   1.710   1.710
  205   2HA   GLY  26           HAR      GLY  26  12.922   1.728   1.728
  206    H    LYS  27           HN       LYS  27  14.427   4.039   4.039
  207    HA   LYS  27           HA       LYS  27  15.226   4.926   4.926
  208   1HB   LYS  27           HBS      LYS  27  15.460   6.132   6.132
  209   2HB   LYS  27           HBR      LYS  27  15.511   7.156   7.156
  210   1HG   LYS  27           HGS      LYS  27  17.776   6.638   6.638
  211   2HG   LYS  27           HGR      LYS  27  17.417   5.776   5.776
  212   1HD   LYS  27           HDS      LYS  27  16.728   3.869   3.869
  213   2HD   LYS  27           HDR      LYS  27  17.801   4.765   4.765
  214   1HE   LYS  27           HES      LYS  27  19.298   3.313   3.313
  215   2HE   LYS  27           HER      LYS  27  19.422   4.648   4.648
  216   1HZ   LYS  27           HZC      LYS  27  17.396   3.082   3.082
  217   2HZ   LYS  27           HZA      LYS  27  18.515   2.005   2.005
  218   3HZ   LYS  27           HZB      LYS  27  18.912   3.137   3.137
  219    H    LYS  28           HN       LYS  28  12.468   4.135   4.135
  220    HA   LYS  28           HA       LYS  28  10.965   6.615   6.615
  221   1HB   LYS  28           HBR      LYS  28  10.489   4.208   4.208
  222   2HB   LYS  28           HBS      LYS  28   9.460   4.103   4.103
  223   1HG   LYS  28           HGS      LYS  28   8.138   5.038   5.038
  224   2HG   LYS  28           HGR      LYS  28   8.496   6.345   6.345
  225   1HD   LYS  28           HDS      LYS  28  10.579   6.367   6.367
  226   2HD   LYS  28           HDR      LYS  28   9.132   6.056   6.056
  227   1HE   LYS  28           HES      LYS  28   8.114   8.056   8.056
  228   2HE   LYS  28           HER      LYS  28   9.200   8.271   8.271
  229   1HZ   LYS  28           HZB      LYS  28  10.069   8.380   8.380
  230   2HZ   LYS  28           HZC      LYS  28   9.746   9.691   9.691
  231   3HZ   LYS  28           HZA      LYS  28  10.981   8.700   8.700
  232    H    GLN  29           HN       GLN  29   9.826   7.291   7.291
  233    HA   GLN  29           HA       GLN  29  10.292   5.832   5.832
  234   1HB   GLN  29           HBS      GLN  29  11.079   8.573   8.573
  235   2HB   GLN  29           HBR      GLN  29  10.527   8.344   8.344
  236   1HG   GLN  29           HGS      GLN  29  12.422   7.332   7.332
  237   2HG   GLN  29           HGR      GLN  29  12.448   6.314   6.314
  238   1HE2  GLN  29           HE2      GLN  29  15.121   9.170   9.170
  239   2HE2  GLN  29           HE2      GLN  29  14.298   8.280   8.280
  240    H    TYR  30           HN       TYR  30   9.104   7.085   7.085
  241    HA   TYR  30           HA       TYR  30   6.630   8.395   8.395
  242   1HB   TYR  30           HBS      TYR  30   6.776   7.900   7.900
  243   2HB   TYR  30           HBR      TYR  30   5.377   7.866   7.866
  244    HD1  TYR  30           HD2      TYR  30   7.046   5.569   5.569
  245    HD2  TYR  30           HD1      TYR  30   5.462   6.069   6.069
  246    HE1  TYR  30           HE2      TYR  30   6.491   3.180   3.180
  247    HE2  TYR  30           HE1      TYR  30   4.695   3.732   3.732
  248    HH   TYR  30           HH       TYR  30   4.817   1.898   1.898
  249    H    LYS  31           HN       LYS  31   6.184  10.396  10.396
  250    HA   LYS  31           HA       LYS  31   7.564  11.316  11.316
  251   1HB   LYS  31           HBS      LYS  31   6.918  13.176  13.176
  252   2HB   LYS  31           HBR      LYS  31   7.725  13.570  13.570
  253   1HG   LYS  31           HGR      LYS  31   9.596  12.014  12.014
  254   2HG   LYS  31           HGS      LYS  31   8.816  11.911  11.911
  255   1HD   LYS  31           HDR      LYS  31   9.234  14.088  14.088
  256   2HD   LYS  31           HDS      LYS  31   9.405  14.607  14.607
  257   1HE   LYS  31           HER      LYS  31  11.379  12.615  12.615
  258   2HE   LYS  31           HES      LYS  31  11.452  14.184  14.184
  259   1HZ   LYS  31           HZC      LYS  31  11.330  14.066  14.066
  260   2HZ   LYS  31           HZA      LYS  31  12.756  13.892  13.892
  261   3HZ   LYS  31           HZB      LYS  31  11.892  15.265  15.265
  262    H    LEU  32           HN       LEU  32   6.268  13.622  13.622
  263    HA   LEU  32           HA       LEU  32   3.943  12.560  12.560
  264   1HB   LEU  32           HBR      LEU  32   5.542  14.978  14.978
  265   2HB   LEU  32           HBS      LEU  32   3.801  15.353  15.353
  266    HG   LEU  32           HG       LEU  32   5.529  13.715  13.715
  267   1HD1  LEU  32           HMD      LEU  32   4.580  16.421  16.421
  268   2HD1  LEU  32           HMD      LEU  32   3.851  15.625  15.625
  269   3HD1  LEU  32           HMD      LEU  32   5.623  15.660  15.660
  270   1HD2  LEU  32           HMD      LEU  32   2.903  13.095  13.095
  271   2HD2  LEU  32           HMD      LEU  32   3.762  12.646  12.646
  272   3HD2  LEU  32           HMD      LEU  32   2.751  14.113  14.113
  273    H    LYS  33           HN       LYS  33   4.406  13.730  13.730
  274    HA   LYS  33           HA       LYS  33   1.643  14.356  14.356
  275   1HB   LYS  33           HBS      LYS  33   4.130  14.002  14.002
  276   2HB   LYS  33           HBR      LYS  33   2.626  13.539  13.539
  277   1HG   LYS  33           HGS      LYS  33   2.345  16.092  16.092
  278   2HG   LYS  33           HGR      LYS  33   3.705  16.112  16.112
  279   1HD   LYS  33           HDS      LYS  33   1.845  14.954  14.954
  280   2HD   LYS  33           HDR      LYS  33   0.773  15.759  15.759
  281   1HE   LYS  33           HER      LYS  33   2.824  17.579  17.579
  282   2HE   LYS  33           HES      LYS  33   2.014  16.860  16.860
  283   1HZ   LYS  33           HZB      LYS  33   0.248  17.673  17.673
  284   2HZ   LYS  33           HZC      LYS  33   1.072  18.910  18.910
  285   3HZ   LYS  33           HZA      LYS  33   0.152  17.933  17.933
  286    H    HIS  34           HN       DHI  34   3.623  11.431  11.431
  287    HA   HIS  34           HA       DHI  34   1.575   9.726   9.726
  288   1HB   HIS  34           HBS      DHI  34   4.100   9.074   9.074
  289   2HB   HIS  34           HBR      DHI  34   2.938   7.842   7.842
  290    HD2  HIS  34           HD2      DHI  34   3.356   7.006   7.006
  291    HE1  HIS  34           HE1      DHI  34   6.620   9.532   9.532
  292    HE2  HIS  34           HE2      DHI  34   5.274   7.567   7.567
  293    H    ILE  35           HN       ILE  35   2.447  11.024  11.024
  294    HA   ILE  35           HA       ILE  35   0.555   9.521   9.521
  295    HB   ILE  35           HB       ILE  35   2.252  11.955  11.955
  296   1HG1  ILE  35           HG1      ILE  35   2.380   9.417   9.417
  297   2HG1  ILE  35           HG1      ILE  35   3.285  10.768  10.768
  298   1HG2  ILE  35           HMG      ILE  35  -0.408  12.026  12.026
  299   2HG2  ILE  35           HMG      ILE  35   0.977  12.362  12.362
  300   3HG2  ILE  35           HMG      ILE  35   0.745  13.322  13.322
  301   1HD1  ILE  35           HMD      ILE  35   0.618  10.079  10.079
  302   2HD1  ILE  35           HMD      ILE  35   1.986   8.971   8.971
  303   3HD1  ILE  35           HMD      ILE  35   2.100  10.680  10.680
  304    H    VAL  36           HN       VAL  36   0.393  12.783  12.783
  305    HA   VAL  36           HA       VAL  36  -2.308  13.178  13.178
  306    HB   VAL  36           HB       VAL  36  -0.716  14.506  14.506
  307   1HG1  VAL  36           HMG      VAL  36  -3.429  14.950  14.950
  308   2HG1  VAL  36           HMG      VAL  36  -2.410  16.410  16.410
  309   3HG1  VAL  36           HMG      VAL  36  -2.645  15.514  15.514
  310   1HG2  VAL  36           HMG      VAL  36  -0.186  14.489  14.489
  311   2HG2  VAL  36           HMG      VAL  36   0.451  15.619  15.619
  312   3HG2  VAL  36           HMG      VAL  36  -1.011  16.038  16.038
  313    H    TRP  37           HN       TRP  37  -0.818  11.866  11.866
  314    HA   TRP  37           HA       TRP  37  -3.189  11.238  11.238
  315   1HB   TRP  37           HBR      TRP  37  -1.061  11.035  11.035
  316   2HB   TRP  37           HBS      TRP  37  -0.527   9.810   9.810
  317    HD1  TRP  37           HD1      TRP  37  -2.649  10.206  10.206
  318    HE1  TRP  37           HE1      TRP  37  -3.652   7.948   7.948
  319    HE3  TRP  37           HE3      TRP  37  -1.143   7.444   7.444
  320    HZ2  TRP  37           HZ2      TRP  37  -3.896   5.380   5.380
  321    HZ3  TRP  37           HZ3      TRP  37  -1.717   5.063   5.063
  322    HH2  TRP  37           HH2      TRP  37  -3.034   4.031   4.031
  323    H    ALA  38           HN       ALA  38  -1.483   9.543   9.543
  324    HA   ALA  38           HA       ALA  38  -2.852   7.006   7.006
  325   1HB   ALA  38           HMB      ALA  38  -0.985   8.243   8.243
  326   2HB   ALA  38           HMB      ALA  38  -1.917   6.796   6.796
  327   3HB   ALA  38           HMB      ALA  38  -0.817   6.733   6.733
  328    H    SER  39           HN       SER  39  -2.801   9.296   9.296
  329    HA   SER  39           HA       SER  39  -4.976   8.151   8.151
  330   1HB   SER  39           HBR      SER  39  -4.254  11.068  11.068
  331   2HB   SER  39           HBS      SER  39  -4.895   9.940   9.940
  332    HG   SER  39           HG       SER  39  -2.937   9.845   9.845
  333    H    ARG  40           HN       ARG  40  -4.873  10.537  10.537
  334    HA   ARG  40           HA       ARG  40  -7.610  11.387  11.387
  335   1HB   ARG  40           HBR      ARG  40  -5.525  11.340  11.340
  336   2HB   ARG  40           HBS      ARG  40  -7.231  11.718  11.718
  337   1HG   ARG  40           HGR      ARG  40  -7.201  13.650  13.650
  338   2HG   ARG  40           HGS      ARG  40  -5.615  13.208  13.208
  339   1HD   ARG  40           HDR      ARG  40  -5.650  15.027  15.027
  340   2HD   ARG  40           HDS      ARG  40  -4.486  13.690  13.690
  341    HE   ARG  40           HE       ARG  40  -5.868  12.829  12.829
  342   1HH1  ARG  40           HH1      ARG  40  -7.203  15.785  15.785
  343   2HH1  ARG  40           HH1      ARG  40  -8.064  16.200  16.200
  344   1HH2  ARG  40           HH2      ARG  40  -6.905  13.471  13.471
  345   2HH2  ARG  40           HH2      ARG  40  -7.897  14.891  14.891
  346    H    GLU  41           HN       GLU  41  -5.956   8.902   8.902
  347    HA   GLU  41           HA       GLU  41  -8.245   7.940   7.940
  348   1HB   GLU  41           HBR      GLU  41  -5.594   7.571   7.571
  349   2HB   GLU  41           HBS      GLU  41  -5.971   6.260   6.260
  350   1HG   GLU  41           HGS      GLU  41  -5.694   5.324   5.324
  351   2HG   GLU  41           HGR      GLU  41  -7.475   5.381   5.381
  352    H    LEU  42           HN       LEU  42  -6.942   7.267   7.267
  353    HA   LEU  42           HA       LEU  42  -8.294   4.731   4.731
  354   1HB   LEU  42           HBR      LEU  42  -6.297   5.254   5.254
  355   2HB   LEU  42           HBS      LEU  42  -6.992   6.804   6.804
  356    HG   LEU  42           HG       LEU  42  -8.771   4.827   4.827
  357   1HD1  LEU  42           HMD      LEU  42  -6.058   3.778   3.778
  358   2HD1  LEU  42           HMD      LEU  42  -6.627   3.796   3.796
  359   3HD1  LEU  42           HMD      LEU  42  -7.571   2.948   2.948
  360   1HD2  LEU  42           HMD      LEU  42  -6.775   6.676   6.676
  361   2HD2  LEU  42           HMD      LEU  42  -8.547   6.608   6.608
  362   3HD2  LEU  42           HMD      LEU  42  -7.528   5.433   5.433
  363    H    GLU  43           HN       GLU  43  -8.687   7.944   7.944
  364    HA   GLU  43           HA       GLU  43 -11.002   7.345   7.345
  365   1HB   GLU  43           HBR      GLU  43 -10.666  10.092  10.092
  366   2HB   GLU  43           HBS      GLU  43 -11.140   9.541   9.541
  367   1HG   GLU  43           HGS      GLU  43  -9.312   9.775   9.775
  368   2HG   GLU  43           HGR      GLU  43  -8.372   8.926   8.926
  369    H    ARG  44           HN       ARG  44 -10.543   8.305   8.305
  370    HA   ARG  44           HA       ARG  44 -13.416   8.701   8.701
  371   1HB   ARG  44           HBR      ARG  44 -10.948   9.033   9.033
  372   2HB   ARG  44           HBS      ARG  44 -12.598   9.087   9.087
  373   1HG   ARG  44           HGR      ARG  44 -13.128  10.942  10.942
  374   2HG   ARG  44           HGS      ARG  44 -11.412  10.942  10.942
  375   1HD   ARG  44           HDR      ARG  44 -11.591  12.630  12.630
  376   2HD   ARG  44           HDS      ARG  44 -10.863  11.243  11.243
  377    HE   ARG  44           HE       ARG  44 -13.288  10.809  10.809
  378   1HH1  ARG  44           HH1      ARG  44 -11.760  13.962  13.962
  379   2HH1  ARG  44           HH1      ARG  44 -12.905  14.763  14.763
  380   1HH2  ARG  44           HH2      ARG  44 -14.839  11.914  11.914
  381   2HH2  ARG  44           HH2      ARG  44 -14.647  13.605  13.605
  382    H    PHE  45           HN       PHE  45 -11.215   6.113   6.113
  383    HA   PHE  45           HA       PHE  45 -12.669   4.367   4.367
  384   1HB   PHE  45           HBS      PHE  45 -10.494   4.056   4.056
  385   2HB   PHE  45           HBR      PHE  45 -11.709   2.750   2.750
  386    HD1  PHE  45           HD1      PHE  45 -12.348   1.565   1.565
  387    HD2  PHE  45           HD2      PHE  45  -8.884   4.045   4.045
  388    HE1  PHE  45           HE1      PHE  45 -11.553   0.517   0.517
  389    HE2  PHE  45           HE2      PHE  45  -8.061   3.004   3.004
  390    HZ   PHE  45           HZ       PHE  45  -9.439   1.277   1.277
  391    H    ALA  46           HN       ALA  46 -12.495   4.511   4.511
  392    HA   ALA  46           HA       ALA  46 -15.397   4.199   4.199
  393   1HB   ALA  46           HMB      ALA  46 -13.377   1.959   1.959
  394   2HB   ALA  46           HMB      ALA  46 -14.918   1.889   1.889
  395   3HB   ALA  46           HMB      ALA  46 -14.923   2.038   2.038
  396    H    VAL  47           HN       VAL  47 -12.822   5.681   5.681
  397    HA   VAL  47           HA       VAL  47 -12.741   4.674   4.674
  398    HB   VAL  47           HB       VAL  47 -10.402   5.706   5.706
  399   1HG1  VAL  47           HMG      VAL  47 -10.669   4.277   4.277
  400   2HG1  VAL  47           HMG      VAL  47  -9.159   4.234   4.234
  401   3HG1  VAL  47           HMG      VAL  47  -9.814   5.790   5.790
  402   1HG2  VAL  47           HMG      VAL  47 -11.367   2.857   2.857
  403   2HG2  VAL  47           HMG      VAL  47 -11.220   3.811   3.811
  404   3HG2  VAL  47           HMG      VAL  47  -9.759   3.329   3.329
  405    H    ASN  48           HN       ASN  48 -11.573   6.211   6.211
  406    HA   ASN  48           HA       ASN  48 -11.981   9.049   9.049
  407   1HB   ASN  48           HBS      ASN  48 -13.542   8.570   8.570
  408   2HB   ASN  48           HBR      ASN  48 -12.305   7.746   7.746
  409   1HD2  ASN  48           HD2      ASN  48 -12.998  11.686  11.686
  410   2HD2  ASN  48           HD2      ASN  48 -13.993  10.621  10.621
  411    HA   PRO  49           HA       PRO  49  -7.812   9.641   9.641
  412   1HB   PRO  49           HBR      PRO  49  -7.720  12.249  12.249
  413   2HB   PRO  49           HBS      PRO  49  -7.814  11.672  11.672
  414   1HG   PRO  49           HGR      PRO  49  -9.832  12.857  12.857
  415   2HG   PRO  49           HGS      PRO  49  -9.760  12.626  12.626
  416   1HD   PRO  49           HDS      PRO  49 -11.292  11.209  11.209
  417   2HD   PRO  49           HDR      PRO  49 -10.926  10.767  10.767
  418    H    GLY  50           HN       GLY  50  -9.077  11.236  11.236
  419   1HA   GLY  50           HAR      GLY  50  -6.626  10.982  10.982
  420   2HA   GLY  50           HAS      GLY  50  -8.251  11.397  11.397
  421    H    LEU  51           HN       LEU  51  -9.224   8.930   8.930
  422    HA   LEU  51           HA       LEU  51  -9.185   6.967   6.967
  423   1HB   LEU  51           HBR      LEU  51 -10.779   7.587   7.587
  424   2HB   LEU  51           HBS      LEU  51  -9.764   6.388   6.388
  425    HG   LEU  51           HG       LEU  51 -11.449   5.915   5.915
  426   1HD1  LEU  51           HMD      LEU  51 -12.078   5.909   5.909
  427   2HD1  LEU  51           HMD      LEU  51 -12.137   4.237   4.237
  428   3HD1  LEU  51           HMD      LEU  51 -13.117   5.506   5.506
  429   1HD2  LEU  51           HMD      LEU  51  -9.298   4.413   4.413
  430   2HD2  LEU  51           HMD      LEU  51  -9.921   4.288   4.288
  431   3HD2  LEU  51           HMD      LEU  51 -10.778   3.476   3.476
  432    H    LEU  52           HN       LEU  52  -7.754   7.033   7.033
  433    HA   LEU  52           HA       LEU  52  -5.931   4.978   4.978
  434   1HB   LEU  52           HBS      LEU  52  -6.094   4.657   4.657
  435   2HB   LEU  52           HBR      LEU  52  -7.069   6.143   6.143
  436    HG   LEU  52           HG       LEU  52  -5.365   6.042   6.042
  437   1HD1  LEU  52           HMD      LEU  52  -6.034   8.230   8.230
  438   2HD1  LEU  52           HMD      LEU  52  -4.506   8.132   8.132
  439   3HD1  LEU  52           HMD      LEU  52  -4.479   8.217   8.217
  440   1HD2  LEU  52           HMD      LEU  52  -3.816   4.703   4.703
  441   2HD2  LEU  52           HMD      LEU  52  -3.102   5.798   5.798
  442   3HD2  LEU  52           HMD      LEU  52  -3.226   6.313   6.313
  443    H    GLU  53           HN       GLU  53  -5.764   8.396   8.396
  444    HA   GLU  53           HA       GLU  53  -2.972   8.862   8.862
  445   1HB   GLU  53           HBR      GLU  53  -4.897  10.462  10.462
  446   2HB   GLU  53           HBS      GLU  53  -5.250   9.890   9.890
  447   1HG   GLU  53           HGR      GLU  53  -2.604  11.114  11.114
  448   2HG   GLU  53           HGS      GLU  53  -4.080  12.108  12.108
  449    H    THR  54           HN       THR  54  -5.200   7.501   7.501
  450    HA   THR  54           HA       THR  54  -2.962   6.850   6.850
  451    HB   THR  54           HB       THR  54  -4.608   6.177   6.177
  452    HG1  THR  54           HG1      THR  54  -6.285   6.336   6.336
  453   1HG2  THR  54           HMG      THR  54  -5.268   8.605   8.605
  454   2HG2  THR  54           HMG      THR  54  -6.497   8.033   8.033
  455   3HG2  THR  54           HMG      THR  54  -4.850   8.414   8.414
  456    H    SER  55           HN       SER  55  -2.258   4.839   4.839
  457    HA   SER  55           HA       SER  55  -2.117   2.757   2.757
  458   1HB   SER  55           HBR      SER  55  -1.667   1.410   1.410
  459   2HB   SER  55           HBS      SER  55  -0.475   2.483   2.483
  460    HG   SER  55           HG       SER  55  -0.411   3.728   3.728
  461    H    GLU  56           HN       GLU  56  -4.556   3.494   3.494
  462    HA   GLU  56           HA       GLU  56  -5.830   0.946   0.946
  463   1HB   GLU  56           HBR      GLU  56  -6.748   3.808   3.808
  464   2HB   GLU  56           HBS      GLU  56  -7.818   2.526   2.526
  465   1HG   GLU  56           HGR      GLU  56  -5.661   2.236   2.236
  466   2HG   GLU  56           HGS      GLU  56  -6.689   3.691   3.691
  467    H    GLY  57           HN       GLY  57  -6.448   3.820   3.820
  468   1HA   GLY  57           HAR      GLY  57  -8.477   2.450   2.450
  469   2HA   GLY  57           HAS      GLY  57  -7.842   4.086   4.086
  470    H    CYS  58           HN       CYS  58  -5.080   3.312   3.312
  471    HA   CYS  58           HA       CYS  58  -4.915   2.467   2.467
  472   1HB   CYS  58           HBS      CYS  58  -3.232   3.808   3.808
  473   2HB   CYS  58           HBR      CYS  58  -2.644   2.189   2.189
  474    H    ARG  59           HN       ARG  59  -4.746   0.797   0.797
  475    HA   ARG  59           HA       ARG  59  -4.395  -1.792  -1.792
  476   1HB   ARG  59           HBS      ARG  59  -4.393  -0.918  -0.918
  477   2HB   ARG  59           HBR      ARG  59  -6.131  -1.318  -1.318
  478   1HG   ARG  59           HGR      ARG  59  -4.775  -3.133  -3.133
  479   2HG   ARG  59           HGS      ARG  59  -5.620  -3.631  -3.631
  480   1HD   ARG  59           HDS      ARG  59  -2.980  -2.524  -2.524
  481   2HD   ARG  59           HDR      ARG  59  -2.941  -3.949  -3.949
  482    HE   ARG  59           HE       ARG  59  -4.565  -4.791  -4.791
  483   1HH1  ARG  59           HH1      ARG  59  -1.308  -3.444  -3.444
  484   2HH1  ARG  59           HH1      ARG  59  -0.875  -4.108  -4.108
  485   1HH2  ARG  59           HH2      ARG  59  -4.013  -5.509  -5.509
  486   2HH2  ARG  59           HH2      ARG  59  -2.409  -5.262  -5.262
  487    H    GLN  60           HN       GLN  60  -7.304   0.176   0.176
  488    HA   GLN  60           HA       GLN  60  -9.173  -2.059  -2.059
  489   1HB   GLN  60           HBR      GLN  60  -9.742  -0.006  -0.006
  490   2HB   GLN  60           HBS      GLN  60  -9.756   0.902   0.902
  491   1HG   GLN  60           HGR      GLN  60 -11.956   0.418   0.418
  492   2HG   GLN  60           HGS      GLN  60 -11.407  -1.111  -1.111
  493   1HE2  GLN  60           HE2      GLN  60 -12.695  -0.961  -0.961
  494   2HE2  GLN  60           HE2      GLN  60 -12.180   0.470   0.470
  495    H    ILE  61           HN       ILE  61  -7.402   0.250   0.250
  496    HA   ILE  61           HA       ILE  61  -8.767  -0.520  -0.520
  497    HB   ILE  61           HB       ILE  61  -6.251   1.170   1.170
  498   1HG1  ILE  61           HG1      ILE  61  -7.948   2.425   2.425
  499   2HG1  ILE  61           HG1      ILE  61  -7.878   2.978   2.978
  500   1HG2  ILE  61           HMG      ILE  61  -6.431  -0.059  -0.059
  501   2HG2  ILE  61           HMG      ILE  61  -7.685   1.161   1.161
  502   3HG2  ILE  61           HMG      ILE  61  -6.030   1.678   1.678
  503   1HD1  ILE  61           HMD      ILE  61  -9.838   0.843   0.843
  504   2HD1  ILE  61           HMD      ILE  61 -10.177   2.571   2.571
  505   3HD1  ILE  61           HMD      ILE  61  -9.915   1.974   1.974
  506    H    LEU  62           HN       LEU  62  -5.383  -0.990  -0.990
  507    HA   LEU  62           HA       LEU  62  -4.594  -2.562  -2.562
  508   1HB   LEU  62           HBR      LEU  62  -3.386  -1.420  -1.420
  509   2HB   LEU  62           HBS      LEU  62  -3.470  -3.085  -3.085
  510    HG   LEU  62           HG       LEU  62  -2.113  -3.914  -3.914
  511   1HD1  LEU  62           HMD      LEU  62  -3.064  -1.790  -1.790
  512   2HD1  LEU  62           HMD      LEU  62  -1.382  -1.313  -1.313
  513   3HD1  LEU  62           HMD      LEU  62  -1.722  -2.867  -2.867
  514   1HD2  LEU  62           HMD      LEU  62  -1.202  -1.449  -1.449
  515   2HD2  LEU  62           HMD      LEU  62  -0.810  -3.161  -3.161
  516   3HD2  LEU  62           HMD      LEU  62  -0.094  -2.313  -2.313
  517    H    GLY  63           HN       GLY  63  -6.547  -3.368  -3.368
  518   1HA   GLY  63           HAR      GLY  63  -6.480  -6.244  -6.244
  519   2HA   GLY  63           HAS      GLY  63  -7.678  -5.308  -5.308
  520    H    GLN  64           HN       GLN  64  -9.022  -3.783  -3.783
  521    HA   GLN  64           HA       GLN  64 -10.656  -5.485  -5.485
  522   1HB   GLN  64           HBR      GLN  64 -10.949  -2.988  -2.988
  523   2HB   GLN  64           HBS      GLN  64 -10.782  -2.631  -2.631
  524   1HG   GLN  64           HGR      GLN  64 -12.648  -4.006  -4.006
  525   2HG   GLN  64           HGS      GLN  64 -12.717  -4.678  -4.678
  526   1HE2  GLN  64           HE2      GLN  64 -13.717  -0.693  -0.693
  527   2HE2  GLN  64           HE2      GLN  64 -12.243  -1.305  -1.305
  528    H    LEU  65           HN       LEU  65  -7.689  -4.031  -4.031
  529    HA   LEU  65           HA       LEU  65  -8.457  -3.451  -3.451
  530   1HB   LEU  65           HBR      LEU  65  -7.374  -1.902  -1.902
  531   2HB   LEU  65           HBS      LEU  65  -5.868  -2.822  -2.822
  532    HG   LEU  65           HG       LEU  65  -6.109  -2.184  -2.184
  533   1HD1  LEU  65           HMD      LEU  65  -8.382  -0.709  -0.709
  534   2HD1  LEU  65           HMD      LEU  65  -7.375   0.198   0.198
  535   3HD1  LEU  65           HMD      LEU  65  -8.163  -1.320  -1.320
  536   1HD2  LEU  65           HMD      LEU  65  -4.816  -1.087  -1.087
  537   2HD2  LEU  65           HMD      LEU  65  -4.700  -0.452  -0.452
  538   3HD2  LEU  65           HMD      LEU  65  -5.811   0.307   0.307
  539    H    GLN  66           HN       GLN  66  -6.063  -5.407  -5.407
  540    HA   GLN  66           HA       GLN  66  -4.606  -6.342  -6.342
  541   1HB   GLN  66           HBR      GLN  66  -4.952  -7.140  -7.140
  542   2HB   GLN  66           HBS      GLN  66  -4.999  -8.599  -8.599
  543   1HG   GLN  66           HGS      GLN  66  -2.868  -6.928  -6.928
  544   2HG   GLN  66           HGR      GLN  66  -2.750  -7.084  -7.084
  545   1HE2  GLN  66           HE2      GLN  66  -2.778 -10.805 -10.805
  546   2HE2  GLN  66           HE2      GLN  66  -3.933  -9.661  -9.661
  547    HA   PRO  67           HA       PRO  67  -8.221  -9.593  -9.593
  548   1HB   PRO  67           HBS      PRO  67 -10.321  -8.261  -8.261
  549   2HB   PRO  67           HBR      PRO  67  -9.994  -9.870  -9.870
  550   1HG   PRO  67           HGS      PRO  67  -9.641  -8.258  -8.258
  551   2HG   PRO  67           HGR      PRO  67  -8.887  -9.738  -9.738
  552   1HD   PRO  67           HDS      PRO  67  -7.778  -7.176  -7.176
  553   2HD   PRO  67           HDR      PRO  67  -6.996  -8.615  -8.615
  554    H    SER  68           HN       SER  68  -8.888  -6.207  -6.207
  555    HA   SER  68           HA       SER  68 -10.737  -6.218  -6.218
  556   1HB   SER  68           HBR      SER  68  -9.738  -4.105  -4.105
  557   2HB   SER  68           HBS      SER  68 -10.671  -3.691  -3.691
  558    HG   SER  68           HG       SER  68 -12.348  -3.989  -3.989
  559    H    LEU  69           HN       LEU  69  -7.402  -6.166  -6.166
  560    HA   LEU  69           HA       LEU  69  -6.847  -4.442  -4.442
  561   1HB   LEU  69           HBR      LEU  69  -5.335  -6.714  -6.714
  562   2HB   LEU  69           HBS      LEU  69  -4.645  -5.637  -5.637
  563    HG   LEU  69           HG       LEU  69  -5.647  -4.773  -4.773
  564   1HD1  LEU  69           HMD      LEU  69  -3.243  -6.043  -6.043
  565   2HD1  LEU  69           HMD      LEU  69  -2.846  -4.309  -4.309
  566   3HD1  LEU  69           HMD      LEU  69  -3.595  -5.133  -5.133
  567   1HD2  LEU  69           HMD      LEU  69  -5.351  -3.367  -3.367
  568   2HD2  LEU  69           HMD      LEU  69  -5.516  -2.685  -2.685
  569   3HD2  LEU  69           HMD      LEU  69  -3.897  -2.973  -2.973
  570    H    GLN  70           HN       GLN  70  -7.533  -7.904  -7.904
  571    HA   GLN  70           HA       GLN  70  -7.233  -8.575  -8.575
  572   1HB   GLN  70           HBR      GLN  70  -8.515 -10.514 -10.514
  573   2HB   GLN  70           HBS      GLN  70  -7.472 -10.232 -10.232
  574   1HG   GLN  70           HGS      GLN  70  -9.260 -10.406 -10.406
  575   2HG   GLN  70           HGR      GLN  70  -9.912  -8.925  -8.925
  576   1HE2  GLN  70           HE2      GLN  70 -12.041 -12.157 -12.157
  577   2HE2  GLN  70           HE2      GLN  70 -10.894 -11.738 -11.738
  578    H    THR  71           HN       THR  71  -9.455  -6.559  -6.559
  579    HA   THR  71           HA       THR  71 -11.478  -6.922  -6.922
  580    HB   THR  71           HB       THR  71 -13.164  -6.306  -6.306
  581    HG1  THR  71           HG1      THR  71 -11.024  -5.791  -5.791
  582   1HG2  THR  71           HMG      THR  71 -11.576  -8.514  -8.514
  583   2HG2  THR  71           HMG      THR  71 -11.703  -7.741  -7.741
  584   3HG2  THR  71           HMG      THR  71 -13.179  -8.182  -8.182
  585    H    GLY  72           HN       GLY  72  -9.161  -4.716  -4.716
  586   1HA   GLY  72           HAR      GLY  72 -10.805  -2.293  -2.293
  587   2HA   GLY  72           HAS      GLY  72  -9.242  -2.371  -2.371
  588    H    SER  73           HN       SER  73  -7.335  -2.946  -2.946
  589    HA   SER  73           HA       SER  73  -7.141  -3.042  -3.042
  590   1HB   SER  73           HBS      SER  73  -6.390  -0.748  -0.748
  591   2HB   SER  73           HBR      SER  73  -8.147  -0.935  -0.935
  592    HG   SER  73           HG       SER  73  -7.455   1.003   1.003
  593    H    GLU  74           HN       GLU  74  -4.945  -2.499  -2.499
  594    HA   GLU  74           HA       GLU  74  -2.705  -2.826  -2.826
  595   1HB   GLU  74           HBS      GLU  74  -3.367  -2.185  -2.185
  596   2HB   GLU  74           HBR      GLU  74  -1.990  -1.361  -1.361
  597   1HG   GLU  74           HGR      GLU  74  -2.459  -4.247  -4.247
  598   2HG   GLU  74           HGS      GLU  74  -1.209  -3.116  -3.116
  599    H    GLU  75           HN       GLU  75  -4.820  -0.226  -0.226
  600    HA   GLU  75           HA       GLU  75  -3.185   1.927   1.927
  601   1HB   GLU  75           HBS      GLU  75  -5.676   1.361   1.361
  602   2HB   GLU  75           HBR      GLU  75  -6.068   2.255   2.255
  603   1HG   GLU  75           HGS      GLU  75  -5.988   3.384   3.384
  604   2HG   GLU  75           HGR      GLU  75  -5.000   4.197   4.197
  605    H    LEU  76           HN       LEU  76  -5.530  -0.246  -0.246
  606    HA   LEU  76           HA       LEU  76  -5.444   1.021   1.021
  607   1HB   LEU  76           HBR      LEU  76  -6.870  -1.038  -1.038
  608   2HB   LEU  76           HBS      LEU  76  -5.971  -1.826  -1.826
  609    HG   LEU  76           HG       LEU  76  -8.142   0.262   0.262
  610   1HD1  LEU  76           HMD      LEU  76  -7.870  -2.593  -2.593
  611   2HD1  LEU  76           HMD      LEU  76  -8.435  -1.772  -1.772
  612   3HD1  LEU  76           HMD      LEU  76  -9.332  -1.576  -1.576
  613   1HD2  LEU  76           HMD      LEU  76  -6.304   0.958   0.958
  614   2HD2  LEU  76           HMD      LEU  76  -7.714   0.380   0.380
  615   3HD2  LEU  76           HMD      LEU  76  -6.282  -0.665  -0.665
  616    H    ARG  77           HN       ARG  77  -3.420  -1.035  -1.035
  617    HA   ARG  77           HA       ARG  77  -2.089  -2.397  -2.397
  618   1HB   ARG  77           HBR      ARG  77  -2.197  -2.801  -2.801
  619   2HB   ARG  77           HBS      ARG  77  -0.649  -1.910  -1.910
  620   1HG   ARG  77           HGS      ARG  77  -1.036  -4.158  -4.158
  621   2HG   ARG  77           HGR      ARG  77  -0.815  -4.578  -4.578
  622   1HD   ARG  77           HDR      ARG  77   1.299  -3.720  -3.720
  623   2HD   ARG  77           HDS      ARG  77   1.011  -2.593  -2.593
  624    HE   ARG  77           HE       ARG  77   0.883  -4.912  -4.912
  625   1HH1  ARG  77           HH1      ARG  77   3.040  -4.175  -4.175
  626   2HH1  ARG  77           HH1      ARG  77   4.358  -5.080  -5.080
  627   1HH2  ARG  77           HH2      ARG  77   2.670  -5.975  -5.975
  628   2HH2  ARG  77           HH2      ARG  77   4.150  -6.098  -6.098
  629    H    SER  78           HN       SER  78  -1.272   0.480   0.480
  630    HA   SER  78           HA       SER  78   1.006   1.252   1.252
  631   1HB   SER  78           HBR      SER  78  -0.366   2.233   2.233
  632   2HB   SER  78           HBS      SER  78  -0.330   3.537   3.537
  633    HG   SER  78           HG       SER  78   1.557   2.689   2.689
  634    H    LEU  79           HN       LEU  79  -2.486   1.733   1.733
  635    HA   LEU  79           HA       LEU  79  -2.496   3.494   3.494
  636   1HB   LEU  79           HBR      LEU  79  -4.330   2.676   2.676
  637   2HB   LEU  79           HBS      LEU  79  -4.558   1.364   1.364
  638    HG   LEU  79           HG       LEU  79  -5.352   2.833   2.833
  639   1HD1  LEU  79           HMD      LEU  79  -4.157   5.003   5.003
  640   2HD1  LEU  79           HMD      LEU  79  -5.454   5.355   5.355
  641   3HD1  LEU  79           HMD      LEU  79  -3.906   4.675   4.675
  642   1HD2  LEU  79           HMD      LEU  79  -6.325   3.171   3.171
  643   2HD2  LEU  79           HMD      LEU  79  -7.169   2.582   2.582
  644   3HD2  LEU  79           HMD      LEU  79  -6.943   4.332   4.332
  645    H    TYR  80           HN       TYR  80  -2.188  -0.011  -0.011
  646    HA   TYR  80           HA       TYR  80  -2.463  -0.567  -0.567
  647   1HB   TYR  80           HBS      TYR  80  -2.986  -2.227  -2.227
  648   2HB   TYR  80           HBR      TYR  80  -1.304  -2.219  -2.219
  649    HD1  TYR  80           HD1      TYR  80  -3.395  -3.104  -3.104
  650    HD2  TYR  80           HD2      TYR  80   0.312  -3.630  -3.630
  651    HE1  TYR  80           HE1      TYR  80  -2.803  -4.900  -4.900
  652    HE2  TYR  80           HE2      TYR  80   0.929  -5.404  -5.404
  653    HH   TYR  80           HH       TYR  80  -0.782  -7.172  -7.172
  654    H    ASN  81           HN       ASN  81   0.407  -0.382  -0.382
  655    HA   ASN  81           HA       ASN  81   2.200  -1.281  -1.281
  656   1HB   ASN  81           HBS      ASN  81   3.988  -0.781  -0.781
  657   2HB   ASN  81           HBR      ASN  81   2.704  -1.784  -1.784
  658   1HD2  ASN  81           HD2      ASN  81   3.665   0.634   0.634
  659   2HD2  ASN  81           HD2      ASN  81   4.158  -0.873  -0.873
  660    H    THR  82           HN       THR  82   1.162   1.836   1.836
  661    HA   THR  82           HA       THR  82   2.893   3.269   3.269
  662    HB   THR  82           HB       THR  82   0.710   4.204   4.204
  663    HG1  THR  82           HG1      THR  82   2.302   3.319   3.319
  664   1HG2  THR  82           HMG      THR  82   1.242   5.723   5.723
  665   2HG2  THR  82           HMG      THR  82   2.719   6.091   6.091
  666   3HG2  THR  82           HMG      THR  82   1.116   6.417   6.417
  667    H    ILE  83           HN       ILE  83  -0.175   1.808   1.808
  668    HA   ILE  83           HA       ILE  83  -0.926   3.309   3.309
  669    HB   ILE  83           HB       ILE  83  -2.099   1.043   1.043
  670   1HG1  ILE  83           HG1      ILE  83  -2.801   3.310   3.310
  671   2HG1  ILE  83           HG1      ILE  83  -4.135   2.374   2.374
  672   1HG2  ILE  83           HMG      ILE  83  -1.890   0.370   0.370
  673   2HG2  ILE  83           HMG      ILE  83  -3.335   1.411   1.411
  674   3HG2  ILE  83           HMG      ILE  83  -3.313  -0.004  -0.004
  675   1HD1  ILE  83           HMD      ILE  83  -3.210   3.326   3.326
  676   2HD1  ILE  83           HMD      ILE  83  -2.416   4.537   4.537
  677   3HD1  ILE  83           HMD      ILE  83  -4.193   4.385   4.385
  678    H    ALA  84           HN       ALA  84   0.357   0.045   0.045
  679    HA   ALA  84           HA       ALA  84   0.731  -0.735  -0.735
  680   1HB   ALA  84           HMB      ALA  84   1.951  -1.655  -1.655
  681   2HB   ALA  84           HMB      ALA  84   2.497  -2.311  -2.311
  682   3HB   ALA  84           HMB      ALA  84   0.792  -2.475  -2.475
  683    H    VAL  85           HN       VAL  85   2.750   1.180   1.180
  684    HA   VAL  85           HA       VAL  85   5.010   1.426   1.426
  685    HB   VAL  85           HB       VAL  85   3.943   3.236   3.236
  686   1HG1  VAL  85           HMG      VAL  85   5.432   4.252   4.252
  687   2HG1  VAL  85           HMG      VAL  85   6.743   3.491   3.491
  688   3HG1  VAL  85           HMG      VAL  85   5.680   4.691   4.691
  689   1HG2  VAL  85           HMG      VAL  85   5.312   0.793   0.793
  690   2HG2  VAL  85           HMG      VAL  85   5.016   1.959   1.959
  691   3HG2  VAL  85           HMG      VAL  85   6.519   2.050   2.050
  692    H    LEU  86           HN       LEU  86   2.203   3.566   3.566
  693    HA   LEU  86           HA       LEU  86   2.865   5.432   5.432
  694   1HB   LEU  86           HBR      LEU  86   1.284   5.601   5.601
  695   2HB   LEU  86           HBS      LEU  86   0.068   4.806   4.806
  696    HG   LEU  86           HG       LEU  86  -0.016   6.648   6.648
  697   1HD1  LEU  86           HMD      LEU  86   2.334   7.758   7.758
  698   2HD1  LEU  86           HMD      LEU  86   1.390   8.673   8.673
  699   3HD1  LEU  86           HMD      LEU  86   2.324   7.239   7.239
  700   1HD2  LEU  86           HMD      LEU  86  -1.018   6.724   6.724
  701   2HD2  LEU  86           HMD      LEU  86  -0.996   8.212   8.212
  702   3HD2  LEU  86           HMD      LEU  86   0.223   7.969   7.969
  703    H    TYR  87           HN       TYR  87   1.204   2.364   2.364
  704    HA   TYR  87           HA       TYR  87   0.691   2.511   2.511
  705   1HB   TYR  87           HBS      TYR  87  -0.117   0.775   0.775
  706   2HB   TYR  87           HBR      TYR  87   1.432  -0.061  -0.061
  707    HD1  TYR  87           HD1      TYR  87   1.917  -0.010  -0.010
  708    HD2  TYR  87           HD2      TYR  87  -1.936   0.267   0.267
  709    HE1  TYR  87           HE1      TYR  87   0.905  -0.743  -0.743
  710    HE2  TYR  87           HE2      TYR  87  -2.967  -0.365  -0.365
  711    HH   TYR  87           HH       TYR  87  -1.032  -1.801  -1.801
  712    H    CYS  88           HN       CYS  88   3.553   1.435   1.435
  713    HA   CYS  88           HA       CYS  88   5.116   0.552   0.552
  714   1HB   CYS  88           HBS      CYS  88   5.374   0.716   0.716
  715   2HB   CYS  88           HBR      CYS  88   6.645   1.782   1.782
  716    H    VAL  89           HN       VAL  89   4.430   3.658   3.658
  717    HA   VAL  89           HA       VAL  89   6.416   5.023   5.023
  718    HB   VAL  89           HB       VAL  89   4.126   6.232   6.232
  719   1HG1  VAL  89           HMG      VAL  89   5.412   7.811   7.811
  720   2HG1  VAL  89           HMG      VAL  89   6.910   7.290   7.290
  721   3HG1  VAL  89           HMG      VAL  89   5.631   8.104   8.104
  722   1HG2  VAL  89           HMG      VAL  89   6.185   4.525   4.525
  723   2HG2  VAL  89           HMG      VAL  89   4.911   5.393   5.393
  724   3HG2  VAL  89           HMG      VAL  89   6.480   6.179   6.179
  725    H    HIS  90           HN       HIS  90   2.853   4.847   4.847
  726    HA   HIS  90           HA       HIS  90   2.542   6.692   6.692
  727   1HB   HIS  90           HBS      HIS  90   0.710   4.343   4.343
  728   2HB   HIS  90           HBR      HIS  90   0.316   5.716   5.716
  729    HD1  HIS  90           HD1      HIS  90   1.310   8.077   8.077
  730    HD2  HIS  90           HD2      HIS  90  -1.104   4.910   4.910
  731    HE1  HIS  90           HE1      HIS  90  -0.054   8.927   8.927
  732    HE2  HIS  90           HE2      HIS  90  -1.566   7.035   7.035
  733    H    GLN  91           HN       GLN  91   3.301   3.266   3.266
  734    HA   GLN  91           HA       GLN  91   2.850   2.675   2.675
  735   1HB   GLN  91           HBS      GLN  91   3.170   0.996   0.996
  736   2HB   GLN  91           HBR      GLN  91   4.909   1.395   1.395
  737   1HG   GLN  91           HGR      GLN  91   3.369   0.452   0.452
  738   2HG   GLN  91           HGS      GLN  91   4.212  -0.654  -0.654
  739   1HE2  GLN  91           HE2      GLN  91   6.124   1.262   1.262
  740   2HE2  GLN  91           HE2      GLN  91   4.463   1.575   1.575
  741    H    ARG  92           HN       ARG  92   5.795   3.650   3.650
  742    HA   ARG  92           HA       ARG  92   7.339   4.804   4.804
  743   1HB   ARG  92           HBR      ARG  92   6.927   2.955   2.955
  744   2HB   ARG  92           HBS      ARG  92   7.582   1.801   1.801
  745   1HG   ARG  92           HGR      ARG  92   9.330   4.077   4.077
  746   2HG   ARG  92           HGS      ARG  92   9.031   2.796   2.796
  747   1HD   ARG  92           HDS      ARG  92  10.151   1.235   1.235
  748   2HD   ARG  92           HDR      ARG  92   9.683   1.922   1.922
  749    HE   ARG  92           HE       ARG  92  11.568   3.539   3.539
  750   1HH1  ARG  92           HH1      ARG  92  11.305   0.788   0.788
  751   2HH1  ARG  92           HH1      ARG  92  12.827   1.109   1.109
  752   1HH2  ARG  92           HH2      ARG  92  13.491   4.002   4.002
  753   2HH2  ARG  92           HH2      ARG  92  14.065   2.927   2.927
  754    H    ILE  93           HN       ILE  93   7.167   2.116   2.116
  755    HA   ILE  93           HA       ILE  93  10.035   1.958   1.958
  756    HB   ILE  93           HB       ILE  93   7.715   0.825   0.825
  757   1HG1  ILE  93           HG1      ILE  93   8.697  -1.249  -1.249
  758   2HG1  ILE  93           HG1      ILE  93   8.664   0.157   0.157
  759   1HG2  ILE  93           HMG      ILE  93  10.619   0.001   0.001
  760   2HG2  ILE  93           HMG      ILE  93   9.349  -0.953  -0.953
  761   3HG2  ILE  93           HMG      ILE  93   9.774   0.667   0.667
  762   1HD1  ILE  93           HMD      ILE  93   6.262  -0.434  -0.434
  763   2HD1  ILE  93           HMD      ILE  93   6.574  -1.413  -1.413
  764   3HD1  ILE  93           HMD      ILE  93   6.374   0.354   0.354
  765    H    ASP  94           HN       ASP  94  10.998   2.464   2.464
  766    HA   ASP  94           HA       ASP  94   9.380   3.896   3.896
  767   1HB   ASP  94           HBR      ASP  94  11.887   5.290   5.290
  768   2HB   ASP  94           HBS      ASP  94  10.845   5.762   5.762
  769    H    VAL  95           HN       VAL  95  10.145   3.760   3.760
  770    HA   VAL  95           HA       VAL  95  12.107   1.547   1.547
  771    HB   VAL  95           HB       VAL  95  10.613   0.375   0.375
  772   1HG1  VAL  95           HMG      VAL  95   9.957   1.005   1.005
  773   2HG1  VAL  95           HMG      VAL  95   8.443   1.375   1.375
  774   3HG1  VAL  95           HMG      VAL  95   9.168  -0.246  -0.246
  775   1HG2  VAL  95           HMG      VAL  95   9.378   2.982   2.982
  776   2HG2  VAL  95           HMG      VAL  95   9.525   1.518   1.518
  777   3HG2  VAL  95           HMG      VAL  95   8.228   1.640   1.640
  778    H    LYS  96           HN       LYS  96  12.102   1.158   1.158
  779    HA   LYS  96           HA       LYS  96  13.455   3.631   3.631
  780   1HB   LYS  96           HBS      LYS  96  14.664   0.929   0.929
  781   2HB   LYS  96           HBR      LYS  96  15.003   1.782   1.782
  782   1HG   LYS  96           HGR      LYS  96  16.772   2.506   2.506
  783   2HG   LYS  96           HGS      LYS  96  15.580   3.794   3.794
  784   1HD   LYS  96           HDR      LYS  96  14.921   2.074   2.074
  785   2HD   LYS  96           HDS      LYS  96  16.596   1.625   1.625
  786   1HE   LYS  96           HES      LYS  96  16.014   3.411   3.411
  787   2HE   LYS  96           HER      LYS  96  17.346   3.771   3.771
  788   1HZ   LYS  96           HZC      LYS  96  14.773   4.589   4.589
  789   2HZ   LYS  96           HZA      LYS  96  15.244   5.353   5.353
  790   3HZ   LYS  96           HZB      LYS  96  16.184   5.413   5.413
  791    H    ASP  97           HN       ASP  97  12.711   0.267   0.267
  792    HA   ASP  97           HA       ASP  97  11.152   1.426   1.426
  793   1HB   ASP  97           HBS      ASP  97  11.736  -0.396  -0.396
  794   2HB   ASP  97           HBR      ASP  97  13.220   0.056   0.056
  795    H    THR  98           HN       THR  98   9.368   0.054   0.054
  796    HA   THR  98           HA       THR  98   7.367  -0.464  -0.464
  797    HB   THR  98           HB       THR  98   7.790  -1.679  -1.679
  798    HG1  THR  98           HG1      THR  98   7.794   0.267   0.267
  799   1HG2  THR  98           HMG      THR  98   5.421  -1.850  -1.850
  800   2HG2  THR  98           HMG      THR  98   5.210  -1.837  -1.837
  801   3HG2  THR  98           HMG      THR  98   6.177  -3.119  -3.119
  802    H    LYS  99           HN       LYS  99   9.674  -2.803  -2.803
  803    HA   LYS  99           HA       LYS  99   8.423  -5.104  -5.104
  804   1HB   LYS  99           HBR      LYS  99  10.792  -4.508  -4.508
  805   2HB   LYS  99           HBS      LYS  99  11.277  -5.495  -5.495
  806   1HG   LYS  99           HGS      LYS  99  10.375  -7.367  -7.367
  807   2HG   LYS  99           HGR      LYS  99   8.885  -6.523  -6.523
  808   1HD   LYS  99           HDR      LYS  99  11.536  -6.713  -6.713
  809   2HD   LYS  99           HDS      LYS  99  10.044  -7.473  -7.473
  810   1HE   LYS  99           HES      LYS  99  10.826  -4.571  -4.571
  811   2HE   LYS  99           HER      LYS  99  10.266  -5.648  -5.648
  812   1HZ   LYS  99           HZC      LYS  99   8.149  -5.721  -5.721
  813   2HZ   LYS  99           HZA      LYS  99   8.705  -4.341  -4.341
  814   3HZ   LYS  99           HZB      LYS  99   8.430  -4.412  -4.412
  815    H    GLU 100           HN       GLU 100  10.718  -2.889  -2.889
  816    HA   GLU 100           HA       GLU 100  11.275  -4.573  -4.573
  817   1HB   GLU 100           HBR      GLU 100  11.693  -1.700  -1.700
  818   2HB   GLU 100           HBS      GLU 100  11.950  -2.170  -2.170
  819   1HG   GLU 100           HGS      GLU 100  13.667  -3.581  -3.581
  820   2HG   GLU 100           HGR      GLU 100  13.489  -3.406  -3.406
  821    H    ALA 101           HN       ALA 101   9.152  -1.732  -1.732
  822    HA   ALA 101           HA       ALA 101   8.036  -1.718  -1.718
  823   1HB   ALA 101           HMB      ALA 101   7.821  -0.116  -0.116
  824   2HB   ALA 101           HMB      ALA 101   6.245  -0.947  -0.947
  825   3HB   ALA 101           HMB      ALA 101   6.788  -0.035  -0.035
  826    H    LEU 102           HN       LEU 102   6.846  -3.058  -3.058
  827    HA   LEU 102           HA       LEU 102   4.480  -4.135  -4.135
  828   1HB   LEU 102           HBS      LEU 102   5.721  -3.830  -3.830
  829   2HB   LEU 102           HBR      LEU 102   5.574  -5.600  -5.600
  830    HG   LEU 102           HG       LEU 102   3.167  -5.388  -5.388
  831   1HD1  LEU 102           HMD      LEU 102   3.226  -3.096  -3.096
  832   2HD1  LEU 102           HMD      LEU 102   3.556  -2.445  -2.445
  833   3HD1  LEU 102           HMD      LEU 102   2.023  -3.293  -3.293
  834   1HD2  LEU 102           HMD      LEU 102   4.357  -3.991  -3.991
  835   2HD2  LEU 102           HMD      LEU 102   4.035  -5.733  -5.733
  836   3HD2  LEU 102           HMD      LEU 102   2.679  -4.581  -4.581
  837    H    ASP 103           HN       ASP 103   7.738  -5.293  -5.293
  838    HA   ASP 103           HA       ASP 103   6.959  -7.896  -7.896
  839   1HB   ASP 103           HBS      ASP 103   9.199  -7.132  -7.132
  840   2HB   ASP 103           HBR      ASP 103   9.653  -6.746  -6.746
  841    H    LYS 104           HN       LYS 104   8.517  -5.067  -5.067
  842    HA   LYS 104           HA       LYS 104   8.173  -5.996  -5.996
  843   1HB   LYS 104           HBS      LYS 104   9.383  -3.828  -3.828
  844   2HB   LYS 104           HBR      LYS 104   8.018  -3.067  -3.067
  845   1HG   LYS 104           HGR      LYS 104   9.756  -5.068  -5.068
  846   2HG   LYS 104           HGS      LYS 104  10.337  -3.395  -3.395
  847   1HD   LYS 104           HDS      LYS 104   8.386  -2.511  -2.511
  848   2HD   LYS 104           HDR      LYS 104   7.704  -4.108  -4.108
  849   1HE   LYS 104           HER      LYS 104   9.438  -4.828  -4.828
  850   2HE   LYS 104           HES      LYS 104  10.298  -3.275  -3.275
  851   1HZ   LYS 104           HZB      LYS 104   7.634  -2.866  -2.866
  852   2HZ   LYS 104           HZC      LYS 104   8.370  -3.873  -3.873
  853   3HZ   LYS 104           HZA      LYS 104   9.010  -2.402  -2.402
  854    H    ILE 105           HN       ILE 105   5.866  -4.755  -4.755
  855    HA   ILE 105           HA       ILE 105   3.961  -4.046  -4.046
  856    HB   ILE 105           HB       ILE 105   3.810  -4.230  -4.230
  857   1HG1  ILE 105           HG1      ILE 105   5.264  -2.499  -2.499
  858   2HG1  ILE 105           HG1      ILE 105   3.810  -1.775  -1.775
  859   1HG2  ILE 105           HMG      ILE 105   1.631  -3.784  -3.784
  860   2HG2  ILE 105           HMG      ILE 105   1.744  -2.618  -2.618
  861   3HG2  ILE 105           HMG      ILE 105   1.571  -4.360  -4.360
  862   1HD1  ILE 105           HMD      ILE 105   2.863  -1.745  -1.745
  863   2HD1  ILE 105           HMD      ILE 105   4.554  -1.993  -1.993
  864   3HD1  ILE 105           HMD      ILE 105   4.111  -0.547  -0.547
  865    H    GLU 106           HN       GLU 106   3.905  -6.531  -6.531
  866    HA   GLU 106           HA       GLU 106   1.911  -8.138  -8.138
  867   1HB   GLU 106           HBS      GLU 106   3.694  -8.092  -8.092
  868   2HB   GLU 106           HBR      GLU 106   4.318  -9.408  -9.408
  869   1HG   GLU 106           HGS      GLU 106   2.747  -9.572  -9.572
  870   2HG   GLU 106           HGR      GLU 106   2.594 -10.774 -10.774
  871    H    GLU 107           HN       GLU 107   5.396  -8.193  -8.193
  872    HA   GLU 107           HA       GLU 107   5.271 -10.746 -10.746
  873   1HB   GLU 107           HBR      GLU 107   7.126  -9.024  -9.024
  874   2HB   GLU 107           HBS      GLU 107   7.466  -8.886  -8.886
  875   1HG   GLU 107           HGS      GLU 107   8.962 -10.299 -10.299
  876   2HG   GLU 107           HGR      GLU 107   7.702 -11.442 -11.442
  877    H    GLU 108           HN       GLU 108   4.608  -7.534  -7.534
  878    HA   GLU 108           HA       GLU 108   5.263  -8.103  -8.103
  879   1HB   GLU 108           HBR      GLU 108   5.909  -5.453  -5.453
  880   2HB   GLU 108           HBS      GLU 108   6.492  -6.236  -6.236
  881   1HG   GLU 108           HGS      GLU 108   7.309  -7.590  -7.590
  882   2HG   GLU 108           HGR      GLU 108   7.879  -5.899  -5.899
  883    H    GLN 109           HN       GLN 109   4.273  -5.268  -5.268
  884    HA   GLN 109           HA       GLN 109   2.132  -4.508  -4.508
  885   1HB   GLN 109           HBR      GLN 109   3.106  -3.623  -3.623
  886   2HB   GLN 109           HBS      GLN 109   1.405  -3.288  -3.288
  887   1HG   GLN 109           HGS      GLN 109   2.947  -1.426  -1.426
  888   2HG   GLN 109           HGR      GLN 109   2.088  -2.071  -2.071
  889   1HE2  GLN 109           HE2      GLN 109   6.103  -2.921  -2.921
  890   2HE2  GLN 109           HE2      GLN 109   5.105  -2.511  -2.511
  891    H    ASN 110           HN       ASN 110  -0.136  -4.332  -4.332
  892    HA   ASN 110           HA       ASN 110  -2.068  -5.478  -5.478
  893   1HB   ASN 110           HBS      ASN 110  -1.051  -6.093  -6.093
  894   2HB   ASN 110           HBR      ASN 110  -0.635  -7.660  -7.660
  895   1HD2  ASN 110           HD2      ASN 110  -3.744  -8.644  -8.644
  896   2HD2  ASN 110           HD2      ASN 110  -2.028  -8.627  -8.627
  897    H    LYS 111           HN       LYS 111   0.568  -7.860  -7.860
  898    HA   LYS 111           HA       LYS 111   1.016  -9.293  -9.293
  899   1HB   LYS 111           HBR      LYS 111  -1.286  -8.017  -8.017
  900   2HB   LYS 111           HBS      LYS 111  -0.023  -9.107  -9.107
  901   1HG   LYS 111           HGR      LYS 111   1.683  -7.362  -7.362
  902   2HG   LYS 111           HGS      LYS 111   0.368  -6.269  -6.269
  903   1HD   LYS 111           HDS      LYS 111   0.273  -7.500  -7.500
  904   2HD   LYS 111           HDR      LYS 111   1.390  -6.198  -6.198
  905   1HE   LYS 111           HES      LYS 111  -1.310  -5.669  -5.669
  906   2HE   LYS 111           HER      LYS 111  -1.191  -5.890  -5.890
  907   1HZ   LYS 111           HZC      LYS 111   0.776  -4.292  -4.292
  908   2HZ   LYS 111           HZA      LYS 111   0.061  -3.869  -3.869
  909   3HZ   LYS 111           HZB      LYS 111  -0.741  -3.690  -3.690
  910    H    SER 112           HN       SER 112   0.459 -11.080 -11.080
  911    HA   SER 112           HA       SER 112  -1.776 -12.469 -12.469
  912   1HB   SER 112           HBS      SER 112  -2.479 -13.158 -13.158
  913   2HB   SER 112           HBR      SER 112  -3.294 -11.880 -11.880
  914    HG   SER 112           HG       SER 112  -1.486 -11.833 -11.833
  915    H    LYS 113           HN       LYS 113  -0.128 -12.840 -12.840
  916    HA   LYS 113           HA       LYS 113   1.312 -14.421 -14.421
  917   1HB   LYS 113           HBR      LYS 113   3.275 -14.763 -14.763
  918   2HB   LYS 113           HBS      LYS 113   2.721 -13.084 -13.084
  919   1HG   LYS 113           HGR      LYS 113   2.166 -13.440 -13.440
  920   2HG   LYS 113           HGS      LYS 113   1.938 -15.199 -15.199
  921   1HD   LYS 113           HDS      LYS 113   4.657 -14.489 -14.489
  922   2HD   LYS 113           HDR      LYS 113   4.198 -13.799 -13.799
  923   1HE   LYS 113           HES      LYS 113   5.161 -15.991 -15.991
  924   2HE   LYS 113           HER      LYS 113   3.440 -15.958 -15.958
  925   1HZ   LYS 113           HZC      LYS 113   4.011 -16.736 -16.736
  926   2HZ   LYS 113           HZA      LYS 113   4.452 -17.801 -17.801
  927   3HZ   LYS 113           HZB      LYS 113   2.897 -17.316 -17.316
  928    H    LYS 114           HN       LYS 114  -1.169 -15.439 -15.439
  929    HA   LYS 114           HA       LYS 114  -0.194 -18.163 -18.163
  930   1HB   LYS 114           HBR      LYS 114  -1.994 -16.408 -16.408
  931   2HB   LYS 114           HBS      LYS 114  -2.979 -17.721 -17.721
  932   1HG   LYS 114           HGR      LYS 114  -0.669 -17.969 -17.969
  933   2HG   LYS 114           HGS      LYS 114  -2.389 -18.373 -18.373
  934   1HD   LYS 114           HDS      LYS 114  -2.184 -20.110 -20.110
  935   2HD   LYS 114           HDR      LYS 114  -0.476 -19.774 -19.774
  936   1HE   LYS 114           HES      LYS 114  -0.009 -20.873 -20.873
  937   2HE   LYS 114           HER      LYS 114  -1.510 -20.317 -20.317
  938   1HZ   LYS 114           HZA      LYS 114  -2.691 -21.925 -21.925
  939   2HZ   LYS 114           HZB      LYS 114  -1.276 -22.484 -22.484
  940   3HZ   LYS 114           HZC      LYS 114  -1.617 -22.642 -22.642
  941    H    LYS 115           HN       LYS 115  -1.943 -16.292 -16.292
  942    HA   LYS 115           HA       LYS 115  -3.784 -18.384 -18.384
  943   1HB   LYS 115           HBR      LYS 115  -3.519 -15.564 -15.564
  944   2HB   LYS 115           HBS      LYS 115  -3.597 -16.351 -16.351
  945   1HG   LYS 115           HGR      LYS 115  -5.827 -15.652 -15.652
  946   2HG   LYS 115           HGS      LYS 115  -5.704 -17.400 -17.400
  947   1HD   LYS 115           HDS      LYS 115  -6.785 -17.394 -17.394
  948   2HD   LYS 115           HDR      LYS 115  -5.123 -17.701 -17.701
  949   1HE   LYS 115           HES      LYS 115  -4.832 -15.283 -15.283
  950   2HE   LYS 115           HER      LYS 115  -6.586 -15.089 -15.089
  951   1HZ   LYS 115           HZB      LYS 115  -5.414 -16.936 -16.936
  952   2HZ   LYS 115           HZC      LYS 115  -5.972 -15.445 -15.445
  953   3HZ   LYS 115           HZA      LYS 115  -6.998 -16.589 -16.589
  954    H    ALA 116           HN       ALA 116  -1.562 -16.483 -16.483
  955    HA   ALA 116           HA       ALA 116  -0.118 -17.070 -17.070
  956   1HB   ALA 116           HMB      ALA 116   0.290 -18.790 -18.790
  957   2HB   ALA 116           HMB      ALA 116   0.519 -19.743 -19.743
  958   3HB   ALA 116           HMB      ALA 116   1.458 -18.250 -18.250
  959    H    GLN 117           HN       GLN 117  -2.898 -17.545 -17.545
  960    HA   GLN 117           HA       GLN 117  -4.113 -18.272 -18.272
  961   1HB   GLN 117           HBR      GLN 117  -1.828 -17.904 -17.904
  962   2HB   GLN 117           HBS      GLN 117  -1.712 -19.687 -19.687
  963   1HG   GLN 117           HGS      GLN 117  -3.254 -19.932 -19.932
  964   2HG   GLN 117           HGR      GLN 117  -4.264 -18.592 -18.592
  965   1HE2  GLN 117           HE2      GLN 117  -1.995 -18.118 -18.118
  966   2HE2  GLN 117           HE2      GLN 117  -2.451 -19.632 -19.632
  967    H    GLN 118           HN       GLN 118  -3.878 -19.819 -19.819
  968    HA   GLN 118           HA       GLN 118  -4.897 -21.680 -21.680
  969   1HB   GLN 118           HBR      GLN 118  -5.852 -21.656 -21.656
  970   2HB   GLN 118           HBS      GLN 118  -6.176 -23.078 -23.078
  971   1HG   GLN 118           HGS      GLN 118  -8.065 -21.596 -21.596
  972   2HG   GLN 118           HGR      GLN 118  -7.227 -21.573 -21.573
  973   1HE2  GLN 118           HE2      GLN 118  -6.580 -18.321 -18.321
  974   2HE2  GLN 118           HE2      GLN 118  -6.450 -19.937 -19.937
  975    H    ALA 119           HN       ALA 119  -4.277 -23.146 -23.146
  976    HA   ALA 119           HA       ALA 119  -2.449 -25.072 -25.072
  977   1HB   ALA 119           HMB      ALA 119  -5.055 -25.494 -25.494
  978   2HB   ALA 119           HMB      ALA 119  -4.022 -26.193 -26.193
  979   3HB   ALA 119           HMB      ALA 119  -3.841 -26.729 -26.729
  980    H    ALA 120           HN       ALA 120  -3.225 -23.177 -23.177
  981    HA   ALA 120           HA       ALA 120  -2.181 -22.811 -22.811
  982   1HB   ALA 120           HMB      ALA 120  -0.042 -23.385 -23.385
  983   2HB   ALA 120           HMB      ALA 120   0.300 -24.154 -24.154
  984   3HB   ALA 120           HMB      ALA 120  -0.034 -22.406 -22.406
  985    H    ALA 121           HN       ALA 121  -3.560 -24.077 -24.077
  986    HA   ALA 121           HA       ALA 121  -2.769 -26.884 -26.884
  987   1HB   ALA 121           HMB      ALA 121  -5.148 -25.243 -25.243
  988   2HB   ALA 121           HMB      ALA 121  -4.826 -26.941 -26.941
  989   3HB   ALA 121           HMB      ALA 121  -5.137 -26.496 -26.496
  990    H    ASP 122           HN       ASP 122  -3.636 -23.906 -23.906
  991    HA   ASP 122           HA       ASP 122  -2.935 -23.079 -23.079
  992   1HB   ASP 122           HBS      ASP 122  -0.626 -25.001 -25.001
  993   2HB   ASP 122           HBR      ASP 122  -0.804 -23.408 -23.408
  994    H    THR 123           HN       THR 123  -2.204 -26.586 -26.586
  995    HA   THR 123           HA       THR 123  -2.513 -28.160 -28.160
  996    HB   THR 123           HB       THR 123  -4.713 -28.609 -28.609
  997    HG1  THR 123           HG1      THR 123  -5.166 -26.003 -26.003
  998   1HG2  THR 123           HMG      THR 123  -4.325 -28.214 -28.214
  999   2HG2  THR 123           HMG      THR 123  -5.665 -27.071 -27.071
 1000   3HG2  THR 123           HMG      THR 123  -5.858 -28.791 -28.791
 1001    H    GLY 124           HN       GLY 124  -3.936 -28.080 -28.080
 1002   1HA   GLY 124           HAR      GLY 124  -1.926 -26.537 -26.537
 1003   2HA   GLY 124           HAS      GLY 124  -2.708 -28.061 -28.061
 1004    H    ASN 125           HN       ASN 125  -2.816 -26.394 -26.394
 1005    HA   ASN 125           HA       ASN 125  -5.453 -25.048 -25.048
 1006   1HB   ASN 125           HBS      ASN 125  -3.474 -24.845 -24.845
 1007   2HB   ASN 125           HBR      ASN 125  -4.921 -23.847 -23.847
 1008   1HD2  ASN 125           HD2      ASN 125  -3.329 -21.604 -21.604
 1009   2HD2  ASN 125           HD2      ASN 125  -4.800 -22.129 -22.129
 1010    H    ASN 126           HN       ASN 126  -3.731 -26.743 -26.743
 1011    HA   ASN 126           HA       ASN 126  -4.228 -28.578 -28.578
 1012   1HB   ASN 126           HBS      ASN 126  -5.134 -29.153 -29.153
 1013   2HB   ASN 126           HBR      ASN 126  -6.172 -29.967 -29.967
 1014   1HD2  ASN 126           HD2      ASN 126  -2.142 -30.786 -30.786
 1015   2HD2  ASN 126           HD2      ASN 126  -2.703 -29.152 -29.152
 1016    H    SER 127           HN       SER 127  -7.373 -27.786 -27.786
 1017    HA   SER 127           HA       SER 127  -9.441 -27.440 -27.440
 1018   1HB   SER 127           HBS      SER 127  -8.485 -25.450 -25.450
 1019   2HB   SER 127           HBR      SER 127  -7.698 -26.318 -26.318
 1020    HG   SER 127           HG       SER 127  -9.446 -26.474 -26.474
 1021    H    GLN 128           HN       GLN 128 -10.469 -29.284 -29.284
 1022    HA   GLN 128           HA       GLN 128  -9.960 -31.134 -31.134
 1023   1HB   GLN 128           HBR      GLN 128 -12.366 -30.823 -30.823
 1024   2HB   GLN 128           HBS      GLN 128 -12.135 -32.118 -32.118
 1025   1HG   GLN 128           HGS      GLN 128 -10.230 -31.586 -31.586
 1026   2HG   GLN 128           HGR      GLN 128 -11.593 -32.737 -32.737
 1027   1HE2  GLN 128           HE2      GLN 128  -9.533 -35.282 -35.282
 1028   2HE2  GLN 128           HE2      GLN 128 -10.708 -34.669 -34.669
 1029    H    VAL 129           HN       VAL 129 -13.035 -29.467 -29.467
 1030    HA   VAL 129           HA       VAL 129 -14.571 -28.554 -28.554
 1031    HB   VAL 129           HB       VAL 129 -13.772 -26.712 -26.712
 1032   1HG1  VAL 129           HMG      VAL 129 -13.629 -26.559 -26.559
 1033   2HG1  VAL 129           HMG      VAL 129 -11.917 -27.041 -27.041
 1034   3HG1  VAL 129           HMG      VAL 129 -12.453 -25.516 -25.516
 1035   1HG2  VAL 129           HMG      VAL 129 -11.854 -28.115 -28.115
 1036   2HG2  VAL 129           HMG      VAL 129 -11.675 -26.356 -26.356
 1037   3HG2  VAL 129           HMG      VAL 129 -10.885 -27.468 -27.468
 1038    H    SER 130           HN       SER 130 -14.172 -27.754 -27.754
 1039    HA   SER 130           HA       SER 130 -14.645 -28.558 -28.558
 1040   1HB   SER 130           HBS      SER 130 -12.540 -30.107 -30.107
 1041   2HB   SER 130           HBR      SER 130 -13.810 -31.353 -31.353
 1042    HG   SER 130           HG       SER 130 -13.121 -31.277 -31.277
 1043    H    GLN 131           HN       GLN 131 -16.720 -28.653 -28.653
 1044    HA   GLN 131           HA       GLN 131 -18.136 -31.097 -31.097
 1045   1HB   GLN 131           HBR      GLN 131 -20.241 -29.859 -29.859
 1046   2HB   GLN 131           HBS      GLN 131 -19.034 -29.359 -29.359
 1047   1HG   GLN 131           HGS      GLN 131 -19.052 -27.784 -27.784
 1048   2HG   GLN 131           HGR      GLN 131 -20.523 -27.651 -27.651
 1049   1HE2  GLN 131           HE2      GLN 131 -17.920 -25.073 -25.073
 1050   2HE2  GLN 131           HE2      GLN 131 -18.645 -25.584 -25.584
 1051    H    ASN 132           HN       ASN 132 -20.447 -30.819 -30.819
 1052    HA   ASN 132           HA       ASN 132 -21.462 -30.934 -30.934
 1053   1HB   ASN 132           HBS      ASN 132 -19.157 -29.619 -29.619
 1054   2HB   ASN 132           HBR      ASN 132 -20.897 -29.629 -29.629
 1055   1HD2  ASN 132           HD2      ASN 132 -19.527 -26.411 -26.411
 1056   2HD2  ASN 132           HD2      ASN 132 -18.730 -27.481 -27.481
 1057    H    TYR 133           HN       TYR 133 -20.943 -31.863 -31.863
 1058    HA   TYR 133           HA       TYR 133 -20.179 -33.609 -33.609
 1059   1HB   TYR 133           HBS      TYR 133 -17.848 -32.607 -32.607
 1060   2HB   TYR 133           HBR      TYR 133 -17.823 -34.252 -34.252
 1061    HD1  TYR 133           HD1      TYR 133 -17.982 -32.363 -32.363
 1062    HD2  TYR 133           HD2      TYR 133 -17.381 -36.143 -36.143
 1063    HE1  TYR 133           HE1      TYR 133 -17.148 -33.268 -33.268
 1064    HE2  TYR 133           HE2      TYR 133 -16.519 -37.052 -37.052
 1065    HH   TYR 133           HH       TYR 133 -15.207 -36.018 -36.018

  Start of MODEL    3
    1   1H    HIS   1           HNC      HIS   1   5.557  22.585  22.585
    2   2H    HIS   1           HNB      HIS   1   5.564  24.137  24.137
    3   3H    HIS   1           HN       HIS   1   4.292  23.173  23.173
    4    HA   HIS   1           HA       HIS   1   5.383  23.243  23.243
    5   1HB   HIS   1           HBS      HIS   1   7.972  22.799  22.799
    6   2HB   HIS   1           HBR      HIS   1   7.819  22.916  22.916
    7    HD1  HIS   1           HD1      HIS   1   5.630  25.420  25.420
    8    HD2  HIS   1           HD2      HIS   1   9.555  25.113  25.113
    9    HE1  HIS   1           HE1      HIS   1   6.449  27.765  27.765
   10    HE2  HIS   1           HE2      HIS   1   8.830  27.586  27.586
   11    H    MET   2           HN       MET   2   5.809  21.463  21.463
   12    HA   MET   2           HA       MET   2   5.040  19.422  19.422
   13   1HB   MET   2           HBR      MET   2   6.330  17.575  17.575
   14   2HB   MET   2           HBS      MET   2   7.386  18.981  18.981
   15   1HG   MET   2           HGR      MET   2   6.338  18.501  18.501
   16   2HG   MET   2           HGS      MET   2   7.420  17.236  17.236
   17   1HE   MET   2           HME      MET   2   8.221  18.538  18.538
   18   2HE   MET   2           HME      MET   2   9.517  17.639  17.639
   19   3HE   MET   2           HME      MET   2   9.835  19.269  19.269
   20    H    GLY   3           HN       GLY   3   3.563  20.743  20.743
   21   1HA   GLY   3           HAS      GLY   3   2.054  18.313  18.313
   22   2HA   GLY   3           HAR      GLY   3   2.392  19.561  19.561
   23    H    ALA   4           HN       ALA   4   1.161  21.348  21.348
   24    HA   ALA   4           HA       ALA   4  -0.705  22.647  22.647
   25   1HB   ALA   4           HMB      ALA   4   0.417  22.608  22.608
   26   2HB   ALA   4           HMB      ALA   4  -1.241  22.026  22.026
   27   3HB   ALA   4           HMB      ALA   4  -0.979  23.591  23.591
   28    H    ARG   5           HN       ARG   5  -1.691  21.060  21.060
   29    HA   ARG   5           HA       ARG   5  -3.237  19.484  19.484
   30   1HB   ARG   5           HBR      ARG   5  -4.229  19.900  19.900
   31   2HB   ARG   5           HBS      ARG   5  -4.975  18.769  18.769
   32   1HG   ARG   5           HGS      ARG   5  -4.843  21.153  21.153
   33   2HG   ARG   5           HGR      ARG   5  -5.240  21.675  21.675
   34   1HD   ARG   5           HDS      ARG   5  -7.188  20.415  20.415
   35   2HD   ARG   5           HDR      ARG   5  -6.686  19.402  19.402
   36    HE   ARG   5           HE       ARG   5  -7.367  21.095  21.095
   37   1HH1  ARG   5           HH1      ARG   5  -7.954  21.968  21.968
   38   2HH1  ARG   5           HH1      ARG   5  -8.831  23.403  23.403
   39   1HH2  ARG   5           HH2      ARG   5  -8.409  23.046  23.046
   40   2HH2  ARG   5           HH2      ARG   5  -9.090  24.014  24.014
   41    H    ALA   6           HN       ALA   6  -3.016  18.519  18.519
   42    HA   ALA   6           HA       ALA   6  -0.700  16.988  16.988
   43   1HB   ALA   6           HMB      ALA   6  -2.471  15.668  15.668
   44   2HB   ALA   6           HMB      ALA   6  -2.932  15.019  15.019
   45   3HB   ALA   6           HMB      ALA   6  -1.257  14.843  14.843
   46    H    SER   7           HN       SER   7  -0.101  16.195  16.195
   47    HA   SER   7           HA       SER   7  -2.055  16.418  16.418
   48   1HB   SER   7           HBS      SER   7   0.109  17.589  17.589
   49   2HB   SER   7           HBR      SER   7   0.945  16.014  16.014
   50    HG   SER   7           HG       SER   7  -0.151  17.285  17.285
   51    H    VAL   8           HN       VAL   8  -0.864  14.578  14.578
   52    HA   VAL   8           HA       VAL   8  -1.687  11.998  11.998
   53    HB   VAL   8           HB       VAL   8  -0.092  12.839  12.839
   54   1HG1  VAL   8           HMG      VAL   8  -1.186  10.106  10.106
   55   2HG1  VAL   8           HMG      VAL   8  -0.592  10.581  10.581
   56   3HG1  VAL   8           HMG      VAL   8   0.520  10.565  10.565
   57   1HG2  VAL   8           HMG      VAL   8  -2.421  13.629  13.629
   58   2HG2  VAL   8           HMG      VAL   8  -2.126  12.461  12.461
   59   3HG2  VAL   8           HMG      VAL   8  -2.972  11.945  11.945
   60    H    LEU   9           HN       LEU   9   1.521  13.358  13.358
   61    HA   LEU   9           HA       LEU   9   2.724  11.032  11.032
   62   1HB   LEU   9           HBR      LEU   9   3.519  13.045  13.045
   63   2HB   LEU   9           HBS      LEU   9   4.732  11.970  11.970
   64    HG   LEU   9           HG       LEU   9   2.290  11.072  11.072
   65   1HD1  LEU   9           HMD      LEU   9   5.089  11.713  11.713
   66   2HD1  LEU   9           HMD      LEU   9   4.439  10.179  10.179
   67   3HD1  LEU   9           HMD      LEU   9   3.603  11.712  11.712
   68   1HD2  LEU   9           HMD      LEU   9   4.146   9.784   9.784
   69   2HD2  LEU   9           HMD      LEU   9   2.659   9.151   9.151
   70   3HD2  LEU   9           HMD      LEU   9   4.211   9.047   9.047
   71    H    SER  10           HN       SER  10   5.268  11.891  11.891
   72    HA   SER  10           HA       SER  10   4.953  13.980  13.980
   73   1HB   SER  10           HBS      SER  10   6.310  12.899  12.899
   74   2HB   SER  10           HBR      SER  10   5.197  11.624  11.624
   75    HG   SER  10           HG       SER  10   7.499  11.093  11.093
   76    H    GLY  11           HN       GLY  11   7.314  14.673  14.673
   77   1HA   GLY  11           HAR      GLY  11   8.422  16.015  16.015
   78   2HA   GLY  11           HAS      GLY  11   9.293  15.697  15.697
   79    H    GLY  12           HN       GLY  12  10.193  13.402  13.402
   80   1HA   GLY  12           HAR      GLY  12  12.002  12.793  12.793
   81   2HA   GLY  12           HAS      GLY  12  11.497  11.658  11.658
   82    H    GLU  13           HN       GLU  13   8.771  11.428  11.428
   83    HA   GLU  13           HA       GLU  13   8.961   9.237   9.237
   84   1HB   GLU  13           HBR      GLU  13   6.699  10.852  10.852
   85   2HB   GLU  13           HBS      GLU  13   6.402   9.607   9.607
   86   1HG   GLU  13           HGS      GLU  13   7.264   7.961   7.961
   87   2HG   GLU  13           HGR      GLU  13   7.712   9.140   9.140
   88    H    LEU  14           HN       LEU  14   7.979  12.576  12.576
   89    HA   LEU  14           HA       LEU  14   7.022  12.227  12.227
   90   1HB   LEU  14           HBR      LEU  14   6.899  14.187  14.187
   91   2HB   LEU  14           HBS      LEU  14   8.338  14.732  14.732
   92    HG   LEU  14           HG       LEU  14   6.495  15.900  15.900
   93   1HD1  LEU  14           HMD      LEU  14   7.997  14.123  14.123
   94   2HD1  LEU  14           HMD      LEU  14   6.319  13.929  13.929
   95   3HD1  LEU  14           HMD      LEU  14   7.078  15.542  15.542
   96   1HD2  LEU  14           HMD      LEU  14   4.959  13.994  13.994
   97   2HD2  LEU  14           HMD      LEU  14   4.394  15.035  15.035
   98   3HD2  LEU  14           HMD      LEU  14   4.999  13.394  13.394
   99    H    ASP  15           HN       ASP  15  10.087  13.444  13.444
  100    HA   ASP  15           HA       ASP  15  11.388  13.626  13.626
  101   1HB   ASP  15           HBS      ASP  15  11.996  14.962  14.962
  102   2HB   ASP  15           HBR      ASP  15  12.670  13.492  13.492
  103    H    LYS  16           HN       LYS  16  10.654  10.974  10.974
  104    HA   LYS  16           HA       LYS  16  12.527   9.211   9.211
  105   1HB   LYS  16           HBR      LYS  16  11.116   9.074   9.074
  106   2HB   LYS  16           HBS      LYS  16  10.626   7.706   7.706
  107   1HG   LYS  16           HGS      LYS  16  13.449   8.449   8.449
  108   2HG   LYS  16           HGR      LYS  16  12.501   7.024   7.024
  109   1HD   LYS  16           HDR      LYS  16  13.423   5.907   5.907
  110   2HD   LYS  16           HDS      LYS  16  12.525   6.880   6.880
  111   1HE   LYS  16           HER      LYS  16  15.069   6.656   6.656
  112   2HE   LYS  16           HES      LYS  16  14.343   8.279   8.279
  113   1HZ   LYS  16           HZA      LYS  16  15.261   7.433   7.433
  114   2HZ   LYS  16           HZB      LYS  16  16.380   7.881   7.881
  115   3HZ   LYS  16           HZC      LYS  16  15.212   8.929   8.929
  116    H    TRP  17           HN       TRP  17   9.133  10.153  10.153
  117    HA   TRP  17           HA       TRP  17   8.150   8.232   8.232
  118   1HB   TRP  17           HBS      TRP  17   6.690   9.481   9.481
  119   2HB   TRP  17           HBR      TRP  17   7.127  11.010  11.010
  120    HD1  TRP  17           HD1      TRP  17   6.060  11.430  11.430
  121    HE1  TRP  17           HE1      TRP  17   4.252  10.251  10.251
  122    HE3  TRP  17           HE3      TRP  17   5.524   7.253   7.253
  123    HZ2  TRP  17           HZ2      TRP  17   2.771   7.873   7.873
  124    HZ3  TRP  17           HZ3      TRP  17   3.778   5.639   5.639
  125    HH2  TRP  17           HH2      TRP  17   2.496   5.882   5.882
  126    H    GLU  18           HN       GLU  18  10.182  10.907  10.907
  127    HA   GLU  18           HA       GLU  18   8.992  11.630  11.630
  128   1HB   GLU  18           HBR      GLU  18  11.313  12.596  12.596
  129   2HB   GLU  18           HBS      GLU  18  10.981  13.212  13.212
  130   1HG   GLU  18           HGR      GLU  18   8.600  13.506  13.506
  131   2HG   GLU  18           HGS      GLU  18  10.025  14.051  14.051
  132    H    LYS  19           HN       LYS  19  10.372   8.999   8.999
  133    HA   LYS  19           HA       LYS  19  11.110   8.929   8.929
  134   1HB   LYS  19           HBS      LYS  19  13.146  10.173  10.173
  135   2HB   LYS  19           HBR      LYS  19  13.598   8.923   8.923
  136   1HG   LYS  19           HGR      LYS  19  13.201   7.486   7.486
  137   2HG   LYS  19           HGS      LYS  19  13.993   8.994   8.994
  138   1HD   LYS  19           HDS      LYS  19  15.016   7.109   7.109
  139   2HD   LYS  19           HDR      LYS  19  15.568   7.199   7.199
  140   1HE   LYS  19           HES      LYS  19  17.164   8.461   8.461
  141   2HE   LYS  19           HER      LYS  19  15.981   9.715   9.715
  142   1HZ   LYS  19           HZA      LYS  19  15.810   8.443   8.443
  143   2HZ   LYS  19           HZB      LYS  19  16.870   9.662   9.662
  144   3HZ   LYS  19           HZC      LYS  19  15.272   9.912   9.912
  145    H    ILE  20           HN       ILE  20   9.554   7.287   7.287
  146    HA   ILE  20           HA       ILE  20  10.943   4.878   4.878
  147    HB   ILE  20           HB       ILE  20   8.198   5.874   5.874
  148   1HG1  ILE  20           HG1      ILE  20   8.823   3.574   3.574
  149   2HG1  ILE  20           HG1      ILE  20  10.294   4.579   4.579
  150   1HG2  ILE  20           HMG      ILE  20   7.585   4.142   4.142
  151   2HG2  ILE  20           HMG      ILE  20   8.397   2.923   2.923
  152   3HG2  ILE  20           HMG      ILE  20   6.985   3.811   3.811
  153   1HD1  ILE  20           HMD      ILE  20   7.977   6.228   6.228
  154   2HD1  ILE  20           HMD      ILE  20   8.118   4.937   4.937
  155   3HD1  ILE  20           HMD      ILE  20   9.480   6.054   6.054
  156    H    ARG  21           HN       ARG  21  11.992   3.919   3.919
  157    HA   ARG  21           HA       ARG  21  11.725   4.422   4.422
  158   1HB   ARG  21           HBR      ARG  21  13.615   3.241   3.241
  159   2HB   ARG  21           HBS      ARG  21  12.768   1.735   1.735
  160   1HG   ARG  21           HGS      ARG  21  14.053   1.784   1.784
  161   2HG   ARG  21           HGR      ARG  21  12.950   3.066   3.066
  162   1HD   ARG  21           HDS      ARG  21  15.385   3.596   3.596
  163   2HD   ARG  21           HDR      ARG  21  14.396   4.771   4.771
  164    HE   ARG  21           HE       ARG  21  15.553   4.212   4.212
  165   1HH1  ARG  21           HH1      ARG  21  16.502   2.069   2.069
  166   2HH1  ARG  21           HH1      ARG  21  17.692   1.248   1.248
  167   1HH2  ARG  21           HH2      ARG  21  17.030   3.032   3.032
  168   2HH2  ARG  21           HH2      ARG  21  17.992   1.792   1.792
  169    H    LEU  22           HN       LEU  22  10.652   3.684   3.684
  170    HA   LEU  22           HA       LEU  22   8.928   1.295   1.295
  171   1HB   LEU  22           HBS      LEU  22   7.385   2.502   2.502
  172   2HB   LEU  22           HBR      LEU  22   7.318   2.933   2.933
  173    HG   LEU  22           HG       LEU  22   8.992   4.834   4.834
  174   1HD1  LEU  22           HMD      LEU  22   7.488   4.021   4.021
  175   2HD1  LEU  22           HMD      LEU  22   8.083   5.681   5.681
  176   3HD1  LEU  22           HMD      LEU  22   9.233   4.322   4.322
  177   1HD2  LEU  22           HMD      LEU  22   6.396   4.624   4.624
  178   2HD2  LEU  22           HMD      LEU  22   7.219   6.164   6.164
  179   3HD2  LEU  22           HMD      LEU  22   6.201   5.387   5.387
  180    H    ARG  23           HN       ARG  23  11.683   1.975   1.975
  181    HA   ARG  23           HA       ARG  23  11.750  -0.242  -0.242
  182   1HB   ARG  23           HBR      ARG  23  12.511   0.950   0.950
  183   2HB   ARG  23           HBS      ARG  23  10.779   0.627   0.627
  184   1HG   ARG  23           HGS      ARG  23  10.761   3.054   3.054
  185   2HG   ARG  23           HGR      ARG  23  12.276   3.239   3.239
  186   1HD   ARG  23           HDR      ARG  23   9.922   2.024   2.024
  187   2HD   ARG  23           HDS      ARG  23   9.905   3.780   3.780
  188    HE   ARG  23           HE       ARG  23  11.709   4.053   4.053
  189   1HH1  ARG  23           HH1      ARG  23  11.118   0.618   0.618
  190   2HH1  ARG  23           HH1      ARG  23  11.910   0.144   0.144
  191   1HH2  ARG  23           HH2      ARG  23  12.629   3.404   3.404
  192   2HH2  ARG  23           HH2      ARG  23  12.771   1.719   1.719
  193    HA   PRO  24           HA       PRO  24  15.827   0.819   0.819
  194   1HB   PRO  24           HBS      PRO  24  16.317  -1.920  -1.920
  195   2HB   PRO  24           HBR      PRO  24  16.351  -0.931  -0.931
  196   1HG   PRO  24           HGR      PRO  24  14.497  -2.787  -2.787
  197   2HG   PRO  24           HGS      PRO  24  14.337  -1.526  -1.526
  198   1HD   PRO  24           HDS      PRO  24  13.156  -1.820  -1.820
  199   2HD   PRO  24           HDR      PRO  24  12.685  -0.843  -0.843
  200    H    GLY  25           HN       GLY  25  14.681  -0.439  -0.439
  201   1HA   GLY  25           HAR      GLY  25  17.353  -0.050  -0.050
  202   2HA   GLY  25           HAS      GLY  25  16.096  -1.137  -1.137
  203    H    GLY  26           HN       GLY  26  14.975   1.759   1.759
  204   1HA   GLY  26           HAS      GLY  26  14.752   3.149   3.149
  205   2HA   GLY  26           HAR      GLY  26  13.398   2.998   2.998
  206    H    LYS  27           HN       LYS  27  15.180   3.333   3.333
  207    HA   LYS  27           HA       LYS  27  15.989   4.994   4.994
  208   1HB   LYS  27           HBS      LYS  27  16.464   6.612   6.612
  209   2HB   LYS  27           HBR      LYS  27  17.085   6.953   6.953
  210   1HG   LYS  27           HGR      LYS  27  18.682   5.279   5.279
  211   2HG   LYS  27           HGS      LYS  27  17.764   4.331   4.331
  212   1HD   LYS  27           HDS      LYS  27  19.495   5.106   5.106
  213   2HD   LYS  27           HDR      LYS  27  18.213   6.234   6.234
  214   1HE   LYS  27           HES      LYS  27  19.353   7.972   7.972
  215   2HE   LYS  27           HER      LYS  27  19.783   7.106   7.106
  216   1HZ   LYS  27           HZC      LYS  27  21.143   6.788   6.788
  217   2HZ   LYS  27           HZA      LYS  27  21.707   7.658   7.658
  218   3HZ   LYS  27           HZB      LYS  27  21.547   6.038   6.038
  219    H    LYS  28           HN       LYS  28  13.227   4.692   4.692
  220    HA   LYS  28           HA       LYS  28  12.220   7.431   7.431
  221   1HB   LYS  28           HBR      LYS  28  10.956   4.995   4.995
  222   2HB   LYS  28           HBS      LYS  28   9.962   6.247   6.247
  223   1HG   LYS  28           HGS      LYS  28  10.057   6.660   6.660
  224   2HG   LYS  28           HGR      LYS  28  10.927   7.951   7.951
  225   1HD   LYS  28           HDS      LYS  28  13.043   6.634   6.634
  226   2HD   LYS  28           HDR      LYS  28  12.077   5.591   5.591
  227   1HE   LYS  28           HER      LYS  28  12.005   7.012   7.012
  228   2HE   LYS  28           HES      LYS  28  11.709   8.421   8.421
  229   1HZ   LYS  28           HZB      LYS  28  14.231   7.818   7.818
  230   2HZ   LYS  28           HZC      LYS  28  14.179   7.393   7.393
  231   3HZ   LYS  28           HZA      LYS  28  13.784   8.912   8.912
  232    H    GLN  29           HN       GLN  29  10.109   7.245   7.245
  233    HA   GLN  29           HA       GLN  29  10.045   5.446   5.446
  234   1HB   GLN  29           HBR      GLN  29  11.007   7.107   7.107
  235   2HB   GLN  29           HBS      GLN  29  12.165   6.198   6.198
  236   1HG   GLN  29           HGR      GLN  29  11.363   8.726   8.726
  237   2HG   GLN  29           HGS      GLN  29  12.090   8.948   8.948
  238   1HE2  GLN  29           HE2      GLN  29  14.690   9.041   9.041
  239   2HE2  GLN  29           HE2      GLN  29  13.186   9.861   9.861
  240    H    TYR  30           HN       TYR  30   8.923   6.572   6.572
  241    HA   TYR  30           HA       TYR  30   6.611   8.089   8.089
  242   1HB   TYR  30           HBS      TYR  30   7.161   7.260   7.260
  243   2HB   TYR  30           HBR      TYR  30   5.643   7.903   7.903
  244    HD1  TYR  30           HD2      TYR  30   6.931   5.489   5.489
  245    HD2  TYR  30           HD1      TYR  30   4.857   5.852   5.852
  246    HE1  TYR  30           HE2      TYR  30   6.449   3.082   3.082
  247    HE2  TYR  30           HE1      TYR  30   4.287   3.460   3.460
  248    HH   TYR  30           HH       TYR  30   5.755   1.473   1.473
  249    H    LYS  31           HN       LYS  31   6.273  10.159  10.159
  250    HA   LYS  31           HA       LYS  31   7.584  11.283  11.283
  251   1HB   LYS  31           HBR      LYS  31   6.851  12.823  12.823
  252   2HB   LYS  31           HBS      LYS  31   7.344  13.542  13.542
  253   1HG   LYS  31           HGR      LYS  31   9.561  12.811  12.811
  254   2HG   LYS  31           HGS      LYS  31   9.133  11.573  11.573
  255   1HD   LYS  31           HDS      LYS  31   8.384  13.726  13.726
  256   2HD   LYS  31           HDR      LYS  31   9.536  14.501  14.501
  257   1HE   LYS  31           HES      LYS  31  10.018  12.399  12.399
  258   2HE   LYS  31           HER      LYS  31  10.820  13.975  13.975
  259   1HZ   LYS  31           HZC      LYS  31  11.670  12.979  12.979
  260   2HZ   LYS  31           HZA      LYS  31  11.144  11.524  11.524
  261   3HZ   LYS  31           HZB      LYS  31  12.284  12.332  12.332
  262    H    LEU  32           HN       LEU  32   6.106  13.476  13.476
  263    HA   LEU  32           HA       LEU  32   3.697  12.398  12.398
  264   1HB   LEU  32           HBS      LEU  32   5.023  15.079  15.079
  265   2HB   LEU  32           HBR      LEU  32   3.309  15.003  15.003
  266    HG   LEU  32           HG       LEU  32   5.728  13.866  13.866
  267   1HD1  LEU  32           HMD      LEU  32   3.889  16.150  16.150
  268   2HD1  LEU  32           HMD      LEU  32   4.135  15.250  15.250
  269   3HD1  LEU  32           HMD      LEU  32   5.535  15.922  15.922
  270   1HD2  LEU  32           HMD      LEU  32   3.904  12.193  12.193
  271   2HD2  LEU  32           HMD      LEU  32   4.197  12.917  12.917
  272   3HD2  LEU  32           HMD      LEU  32   2.797  13.440  13.440
  273    H    LYS  33           HN       LYS  33   4.483  13.667  13.667
  274    HA   LYS  33           HA       LYS  33   1.810  14.302  14.302
  275   1HB   LYS  33           HBR      LYS  33   3.933  14.987  14.987
  276   2HB   LYS  33           HBS      LYS  33   4.105  13.290  13.290
  277   1HG   LYS  33           HGS      LYS  33   2.245  13.413  13.413
  278   2HG   LYS  33           HGR      LYS  33   1.570  14.835  14.835
  279   1HD   LYS  33           HDS      LYS  33   3.431  16.191  16.191
  280   2HD   LYS  33           HDR      LYS  33   4.081  14.778  14.778
  281   1HE   LYS  33           HES      LYS  33   1.309  15.782  15.782
  282   2HE   LYS  33           HER      LYS  33   2.771  16.361  16.361
  283   1HZ   LYS  33           HZB      LYS  33   3.189  13.932  13.932
  284   2HZ   LYS  33           HZC      LYS  33   1.639  13.664  13.664
  285   3HZ   LYS  33           HZA      LYS  33   1.970  14.620  14.620
  286    H    HIS  34           HN       DHI  34   3.642  11.368  11.368
  287    HA   HIS  34           HA       DHI  34   1.707   9.675   9.675
  288   1HB   HIS  34           HBS      DHI  34   4.060   9.052   9.052
  289   2HB   HIS  34           HBR      DHI  34   2.861   7.809   7.809
  290    HD2  HIS  34           HD2      DHI  34   3.204   6.722   6.722
  291    HE1  HIS  34           HE1      DHI  34   6.756   8.788   8.788
  292    HE2  HIS  34           HE2      DHI  34   5.227   6.908   6.908
  293    H    ILE  35           HN       ILE  35   2.497  10.560  10.560
  294    HA   ILE  35           HA       ILE  35   0.484   8.971   8.971
  295    HB   ILE  35           HB       ILE  35   2.508  10.329  10.329
  296   1HG1  ILE  35           HG1      ILE  35   0.051  10.148  10.148
  297   2HG1  ILE  35           HG1      ILE  35   0.679   8.683   8.683
  298   1HG2  ILE  35           HMG      ILE  35   0.269  12.326  12.326
  299   2HG2  ILE  35           HMG      ILE  35   1.469  12.187  12.187
  300   3HG2  ILE  35           HMG      ILE  35   2.000  12.578  12.578
  301   1HD1  ILE  35           HMD      ILE  35   2.811  10.157  10.157
  302   2HD1  ILE  35           HMD      ILE  35   1.509   9.750   9.750
  303   3HD1  ILE  35           HMD      ILE  35   2.303   8.460   8.460
  304    H    VAL  36           HN       VAL  36   0.385  12.236  12.236
  305    HA   VAL  36           HA       VAL  36  -2.161  12.916  12.916
  306    HB   VAL  36           HB       VAL  36  -0.468  14.291  14.291
  307   1HG1  VAL  36           HMG      VAL  36  -3.169  14.985  14.985
  308   2HG1  VAL  36           HMG      VAL  36  -2.006  16.298  16.298
  309   3HG1  VAL  36           HMG      VAL  36  -2.483  15.205  15.205
  310   1HG2  VAL  36           HMG      VAL  36   0.038  14.095  14.095
  311   2HG2  VAL  36           HMG      VAL  36   0.551  15.445  15.445
  312   3HG2  VAL  36           HMG      VAL  36  -0.925  15.591  15.591
  313    H    TRP  37           HN       TRP  37  -0.857  11.761  11.761
  314    HA   TRP  37           HA       TRP  37  -3.276  11.306  11.306
  315   1HB   TRP  37           HBR      TRP  37  -1.109  11.051  11.051
  316   2HB   TRP  37           HBS      TRP  37  -0.708   9.715   9.715
  317    HD1  TRP  37           HD1      TRP  37  -2.857  10.474  10.474
  318    HE1  TRP  37           HE1      TRP  37  -3.859   8.293   8.293
  319    HE3  TRP  37           HE3      TRP  37  -1.318   7.338   7.338
  320    HZ2  TRP  37           HZ2      TRP  37  -4.045   5.617   5.617
  321    HZ3  TRP  37           HZ3      TRP  37  -1.849   4.953   4.953
  322    HH2  TRP  37           HH2      TRP  37  -3.191   4.099   4.099
  323    H    ALA  38           HN       ALA  38  -1.545   9.361   9.361
  324    HA   ALA  38           HA       ALA  38  -3.135   6.968   6.968
  325   1HB   ALA  38           HMB      ALA  38  -1.033   7.917   7.917
  326   2HB   ALA  38           HMB      ALA  38  -2.024   6.497   6.497
  327   3HB   ALA  38           HMB      ALA  38  -1.041   6.487   6.487
  328    H    SER  39           HN       SER  39  -2.686   9.035   9.035
  329    HA   SER  39           HA       SER  39  -4.885   8.020   8.020
  330   1HB   SER  39           HBS      SER  39  -3.194   9.135   9.135
  331   2HB   SER  39           HBR      SER  39  -3.388  10.636  10.636
  332    HG   SER  39           HG       SER  39  -4.564  11.266  11.266
  333    H    ARG  40           HN       ARG  40  -4.755  10.349  10.349
  334    HA   ARG  40           HA       ARG  40  -7.475  11.309  11.309
  335   1HB   ARG  40           HBS      ARG  40  -5.820  12.457  12.457
  336   2HB   ARG  40           HBR      ARG  40  -5.732  11.019  11.019
  337   1HG   ARG  40           HGS      ARG  40  -7.734  11.455  11.455
  338   2HG   ARG  40           HGR      ARG  40  -8.419  12.239  12.239
  339   1HD   ARG  40           HDR      ARG  40  -6.460  13.973  13.973
  340   2HD   ARG  40           HDS      ARG  40  -6.808  13.355  13.355
  341    HE   ARG  40           HE       ARG  40  -8.746  14.736  14.736
  342   1HH1  ARG  40           HH1      ARG  40  -7.993  13.316  13.316
  343   2HH1  ARG  40           HH1      ARG  40  -9.200  14.240  14.240
  344   1HH2  ARG  40           HH2      ARG  40 -10.224  16.021  16.021
  345   2HH2  ARG  40           HH2      ARG  40 -10.464  15.769  15.769
  346    H    GLU  41           HN       GLU  41  -5.963   8.899   8.899
  347    HA   GLU  41           HA       GLU  41  -8.429   8.180   8.180
  348   1HB   GLU  41           HBR      GLU  41  -5.750   7.827   7.827
  349   2HB   GLU  41           HBS      GLU  41  -6.151   6.336   6.336
  350   1HG   GLU  41           HGS      GLU  41  -6.024   6.811   6.811
  351   2HG   GLU  41           HGR      GLU  41  -7.008   5.494   5.494
  352    H    LEU  42           HN       LEU  42  -6.874   7.211   7.211
  353    HA   LEU  42           HA       LEU  42  -8.330   4.742   4.742
  354   1HB   LEU  42           HBR      LEU  42  -6.275   5.234   5.234
  355   2HB   LEU  42           HBS      LEU  42  -6.938   6.795   6.795
  356    HG   LEU  42           HG       LEU  42  -8.737   4.844   4.844
  357   1HD1  LEU  42           HMD      LEU  42  -5.962   3.835   3.835
  358   2HD1  LEU  42           HMD      LEU  42  -6.726   3.718   3.718
  359   3HD1  LEU  42           HMD      LEU  42  -7.500   2.958   2.958
  360   1HD2  LEU  42           HMD      LEU  42  -6.779   6.752   6.752
  361   2HD2  LEU  42           HMD      LEU  42  -8.519   6.544   6.544
  362   3HD2  LEU  42           HMD      LEU  42  -7.339   5.455   5.455
  363    H    GLU  43           HN       GLU  43  -8.513   7.961   7.961
  364    HA   GLU  43           HA       GLU  43 -10.879   7.520   7.520
  365   1HB   GLU  43           HBR      GLU  43  -9.126   9.235   9.235
  366   2HB   GLU  43           HBS      GLU  43  -9.595   9.959   9.959
  367   1HG   GLU  43           HGS      GLU  43 -11.566   9.838   9.838
  368   2HG   GLU  43           HGR      GLU  43 -10.242  11.031  11.031
  369    H    ARG  44           HN       ARG  44 -10.323   8.501   8.501
  370    HA   ARG  44           HA       ARG  44 -13.159   9.120   9.120
  371   1HB   ARG  44           HBS      ARG  44 -11.226  10.444  10.444
  372   2HB   ARG  44           HBR      ARG  44 -10.955   9.060   9.060
  373   1HG   ARG  44           HGR      ARG  44 -13.733   9.793   9.793
  374   2HG   ARG  44           HGS      ARG  44 -12.733  11.253  11.253
  375   1HD   ARG  44           HDS      ARG  44 -13.019  10.420  10.420
  376   2HD   ARG  44           HDR      ARG  44 -11.409   9.814   9.814
  377    HE   ARG  44           HE       ARG  44 -12.266   7.635   7.635
  378   1HH1  ARG  44           HH1      ARG  44 -14.723   9.971   9.971
  379   2HH1  ARG  44           HH1      ARG  44 -15.895   8.750   8.750
  380   1HH2  ARG  44           HH2      ARG  44 -13.867   6.073   6.073
  381   2HH2  ARG  44           HH2      ARG  44 -15.410   6.544   6.544
  382    H    PHE  45           HN       PHE  45 -11.152   6.383   6.383
  383    HA   PHE  45           HA       PHE  45 -12.691   4.796   4.796
  384   1HB   PHE  45           HBS      PHE  45 -10.560   4.278   4.278
  385   2HB   PHE  45           HBR      PHE  45 -11.857   3.052   3.052
  386    HD1  PHE  45           HD2      PHE  45 -10.254   4.964   4.964
  387    HD2  PHE  45           HD1      PHE  45 -11.369   1.233   1.233
  388    HE1  PHE  45           HE2      PHE  45  -9.287   3.780   3.780
  389    HE2  PHE  45           HE1      PHE  45 -10.559   0.048   0.048
  390    HZ   PHE  45           HZ       PHE  45  -9.414   1.307   1.307
  391    H    ALA  46           HN       ALA  46 -12.550   4.806   4.806
  392    HA   ALA  46           HA       ALA  46 -15.471   4.724   4.724
  393   1HB   ALA  46           HMB      ALA  46 -13.644   2.333   2.333
  394   2HB   ALA  46           HMB      ALA  46 -15.128   2.353   2.353
  395   3HB   ALA  46           HMB      ALA  46 -15.230   2.550   2.550
  396    H    VAL  47           HN       VAL  47 -12.817   5.989   5.989
  397    HA   VAL  47           HA       VAL  47 -12.810   4.893   4.893
  398    HB   VAL  47           HB       VAL  47 -10.417   5.816   5.816
  399   1HG1  VAL  47           HMG      VAL  47 -10.731   4.335   4.335
  400   2HG1  VAL  47           HMG      VAL  47  -9.228   4.290   4.290
  401   3HG1  VAL  47           HMG      VAL  47  -9.843   5.840   5.840
  402   1HG2  VAL  47           HMG      VAL  47 -11.504   3.010   3.010
  403   2HG2  VAL  47           HMG      VAL  47 -11.424   3.975   3.975
  404   3HG2  VAL  47           HMG      VAL  47  -9.923   3.442   3.442
  405    H    ASN  48           HN       ASN  48 -11.630   6.277   6.277
  406    HA   ASN  48           HA       ASN  48 -12.114   9.159   9.159
  407   1HB   ASN  48           HBR      ASN  48 -13.688   8.459   8.459
  408   2HB   ASN  48           HBS      ASN  48 -12.411   7.641   7.641
  409   1HD2  ASN  48           HD2      ASN  48 -13.345  11.448  11.448
  410   2HD2  ASN  48           HD2      ASN  48 -14.329  10.330  10.330
  411    HA   PRO  49           HA       PRO  49  -7.982   9.662   9.662
  412   1HB   PRO  49           HBR      PRO  49  -7.775  12.266  12.266
  413   2HB   PRO  49           HBS      PRO  49  -8.224  11.648  11.648
  414   1HG   PRO  49           HGS      PRO  49  -9.809  12.938  12.938
  415   2HG   PRO  49           HGR      PRO  49 -10.121  12.696  12.696
  416   1HD   PRO  49           HDS      PRO  49 -11.211  11.319  11.319
  417   2HD   PRO  49           HDR      PRO  49 -11.372  10.962  10.962
  418    H    GLY  50           HN       GLY  50  -8.893  11.645  11.645
  419   1HA   GLY  50           HAS      GLY  50  -6.726  11.179  11.179
  420   2HA   GLY  50           HAR      GLY  50  -8.358  11.526  11.526
  421    H    LEU  51           HN       LEU  51  -9.315   9.059   9.059
  422    HA   LEU  51           HA       LEU  51  -9.236   7.176   7.176
  423   1HB   LEU  51           HBR      LEU  51 -10.930   7.786   7.786
  424   2HB   LEU  51           HBS      LEU  51 -10.012   6.511   6.511
  425    HG   LEU  51           HG       LEU  51 -11.709   6.285   6.285
  426   1HD1  LEU  51           HMD      LEU  51 -11.913   5.355   5.355
  427   2HD1  LEU  51           HMD      LEU  51 -12.673   4.410   4.410
  428   3HD1  LEU  51           HMD      LEU  51 -13.140   6.111   6.111
  429   1HD2  LEU  51           HMD      LEU  51  -9.901   4.229   4.229
  430   2HD2  LEU  51           HMD      LEU  51  -9.681   4.968   4.968
  431   3HD2  LEU  51           HMD      LEU  51 -11.075   3.900   3.900
  432    H    LEU  52           HN       LEU  52  -7.838   7.360   7.360
  433    HA   LEU  52           HA       LEU  52  -6.035   5.233   5.233
  434   1HB   LEU  52           HBS      LEU  52  -6.248   5.057   5.057
  435   2HB   LEU  52           HBR      LEU  52  -7.127   6.604   6.604
  436    HG   LEU  52           HG       LEU  52  -5.385   6.457   6.457
  437   1HD1  LEU  52           HMD      LEU  52  -5.994   8.643   8.643
  438   2HD1  LEU  52           HMD      LEU  52  -4.602   8.463   8.463
  439   3HD1  LEU  52           HMD      LEU  52  -4.342   8.576   8.576
  440   1HD2  LEU  52           HMD      LEU  52  -3.937   5.084   5.084
  441   2HD2  LEU  52           HMD      LEU  52  -3.220   5.943   5.943
  442   3HD2  LEU  52           HMD      LEU  52  -3.213   6.698   6.698
  443    H    GLU  53           HN       GLU  53  -5.890   8.580   8.580
  444    HA   GLU  53           HA       GLU  53  -3.064   9.009   9.009
  445   1HB   GLU  53           HBS      GLU  53  -4.736  10.675  10.675
  446   2HB   GLU  53           HBR      GLU  53  -5.388  10.186  10.186
  447   1HG   GLU  53           HGR      GLU  53  -3.820  11.345  11.345
  448   2HG   GLU  53           HGS      GLU  53  -2.601  11.024  11.024
  449    H    THR  54           HN       THR  54  -5.296   7.696   7.696
  450    HA   THR  54           HA       THR  54  -3.127   6.993   6.993
  451    HB   THR  54           HB       THR  54  -4.779   5.813   5.813
  452    HG1  THR  54           HG1      THR  54  -6.351   6.336   6.336
  453   1HG2  THR  54           HMG      THR  54  -5.098   8.515   8.515
  454   2HG2  THR  54           HMG      THR  54  -6.744   7.838   7.838
  455   3HG2  THR  54           HMG      THR  54  -5.786   7.613   7.613
  456    H    SER  55           HN       SER  55  -2.508   4.832   4.832
  457    HA   SER  55           HA       SER  55  -2.147   2.947   2.947
  458   1HB   SER  55           HBS      SER  55  -2.309   1.428   1.428
  459   2HB   SER  55           HBR      SER  55  -0.843   2.223   2.223
  460    HG   SER  55           HG       SER  55  -0.713   3.189   3.189
  461    H    GLU  56           HN       GLU  56  -4.804   3.410   3.410
  462    HA   GLU  56           HA       GLU  56  -5.828   0.779   0.779
  463   1HB   GLU  56           HBR      GLU  56  -6.279   3.126   3.126
  464   2HB   GLU  56           HBS      GLU  56  -7.651   3.019   3.019
  465   1HG   GLU  56           HGR      GLU  56  -8.120   0.746   0.746
  466   2HG   GLU  56           HGS      GLU  56  -6.830   1.186   1.186
  467    H    GLY  57           HN       GLY  57  -6.574   3.755   3.755
  468   1HA   GLY  57           HAR      GLY  57  -8.772   2.547   2.547
  469   2HA   GLY  57           HAS      GLY  57  -8.064   4.163   4.163
  470    H    CYS  58           HN       CYS  58  -5.397   3.529   3.529
  471    HA   CYS  58           HA       CYS  58  -5.148   2.542   2.542
  472   1HB   CYS  58           HBR      CYS  58  -3.497   3.827   3.827
  473   2HB   CYS  58           HBS      CYS  58  -2.905   2.173   2.173
  474    H    ARG  59           HN       ARG  59  -5.323   0.870   0.870
  475    HA   ARG  59           HA       ARG  59  -4.702  -1.676  -1.676
  476   1HB   ARG  59           HBR      ARG  59  -4.901  -0.586  -0.586
  477   2HB   ARG  59           HBS      ARG  59  -6.286  -1.705  -1.705
  478   1HG   ARG  59           HGS      ARG  59  -4.380  -3.328  -3.328
  479   2HG   ARG  59           HGR      ARG  59  -3.358  -2.269  -2.269
  480   1HD   ARG  59           HDS      ARG  59  -4.057  -3.234  -3.234
  481   2HD   ARG  59           HDR      ARG  59  -5.769  -3.023  -3.023
  482    HE   ARG  59           HE       ARG  59  -5.155  -5.132  -5.132
  483   1HH1  ARG  59           HH1      ARG  59  -3.931  -4.491  -4.491
  484   2HH1  ARG  59           HH1      ARG  59  -3.960  -6.160  -6.160
  485   1HH2  ARG  59           HH2      ARG  59  -5.319  -7.286  -7.286
  486   2HH2  ARG  59           HH2      ARG  59  -4.751  -7.742  -7.742
  487    H    GLN  60           HN       GLN  60  -7.676   0.113   0.113
  488    HA   GLN  60           HA       GLN  60  -9.464  -2.199  -2.199
  489   1HB   GLN  60           HBR      GLN  60 -10.172  -0.219  -0.219
  490   2HB   GLN  60           HBS      GLN  60 -10.116   0.754   0.754
  491   1HG   GLN  60           HGR      GLN  60 -12.231   0.192   0.192
  492   2HG   GLN  60           HGS      GLN  60 -11.670  -1.477  -1.477
  493   1HE2  GLN  60           HE2      GLN  60 -12.262  -2.378  -2.378
  494   2HE2  GLN  60           HE2      GLN  60 -10.931  -2.369  -2.369
  495    H    ILE  61           HN       ILE  61  -7.753   0.220   0.220
  496    HA   ILE  61           HA       ILE  61  -9.008  -0.522  -0.522
  497    HB   ILE  61           HB       ILE  61  -6.476   1.111   1.111
  498   1HG1  ILE  61           HG1      ILE  61  -8.214   2.346   2.346
  499   2HG1  ILE  61           HG1      ILE  61  -8.012   2.998   2.998
  500   1HG2  ILE  61           HMG      ILE  61  -6.714  -0.089  -0.089
  501   2HG2  ILE  61           HMG      ILE  61  -7.875   1.225   1.225
  502   3HG2  ILE  61           HMG      ILE  61  -6.191   1.613   1.613
  503   1HD1  ILE  61           HMD      ILE  61 -10.076   0.875   0.875
  504   2HD1  ILE  61           HMD      ILE  61 -10.395   2.589   2.589
  505   3HD1  ILE  61           HMD      ILE  61 -10.030   2.094   2.094
  506    H    LEU  62           HN       LEU  62  -5.669  -0.980  -0.980
  507    HA   LEU  62           HA       LEU  62  -4.816  -2.404  -2.404
  508   1HB   LEU  62           HBR      LEU  62  -3.585  -1.264  -1.264
  509   2HB   LEU  62           HBS      LEU  62  -3.671  -2.891  -2.891
  510    HG   LEU  62           HG       LEU  62  -2.336  -3.811  -3.811
  511   1HD1  LEU  62           HMD      LEU  62  -3.226  -1.888  -1.888
  512   2HD1  LEU  62           HMD      LEU  62  -1.720  -1.097  -1.097
  513   3HD1  LEU  62           HMD      LEU  62  -1.658  -2.693  -2.693
  514   1HD2  LEU  62           HMD      LEU  62  -1.315  -1.303  -1.303
  515   2HD2  LEU  62           HMD      LEU  62  -1.133  -2.998  -2.998
  516   3HD2  LEU  62           HMD      LEU  62  -0.261  -2.409  -2.409
  517    H    GLY  63           HN       GLY  63  -6.651  -3.454  -3.454
  518   1HA   GLY  63           HAR      GLY  63  -6.454  -6.284  -6.284
  519   2HA   GLY  63           HAS      GLY  63  -7.659  -5.480  -5.480
  520    H    GLN  64           HN       GLN  64  -9.117  -3.909  -3.909
  521    HA   GLN  64           HA       GLN  64 -10.751  -5.595  -5.595
  522   1HB   GLN  64           HBR      GLN  64 -11.035  -3.106  -3.106
  523   2HB   GLN  64           HBS      GLN  64 -10.988  -2.745  -2.745
  524   1HG   GLN  64           HGR      GLN  64 -13.096  -3.395  -3.395
  525   2HG   GLN  64           HGS      GLN  64 -12.671  -5.017  -5.017
  526   1HE2  GLN  64           HE2      GLN  64 -13.657  -4.365  -4.365
  527   2HE2  GLN  64           HE2      GLN  64 -12.392  -5.110  -5.110
  528    H    LEU  65           HN       LEU  65  -7.838  -4.048  -4.048
  529    HA   LEU  65           HA       LEU  65  -8.693  -3.368  -3.368
  530   1HB   LEU  65           HBR      LEU  65  -7.640  -1.839  -1.839
  531   2HB   LEU  65           HBS      LEU  65  -6.114  -2.732  -2.732
  532    HG   LEU  65           HG       LEU  65  -6.273  -2.042  -2.042
  533   1HD1  LEU  65           HMD      LEU  65  -8.667  -0.702  -0.702
  534   2HD1  LEU  65           HMD      LEU  65  -7.628   0.308   0.308
  535   3HD1  LEU  65           HMD      LEU  65  -8.303  -1.216  -1.216
  536   1HD2  LEU  65           HMD      LEU  65  -5.153  -0.915  -0.915
  537   2HD2  LEU  65           HMD      LEU  65  -4.912  -0.317  -0.317
  538   3HD2  LEU  65           HMD      LEU  65  -6.125   0.450   0.450
  539    H    GLN  66           HN       GLN  66  -6.171  -5.293  -5.293
  540    HA   GLN  66           HA       GLN  66  -4.792  -6.154  -6.154
  541   1HB   GLN  66           HBR      GLN  66  -4.984  -6.998  -6.998
  542   2HB   GLN  66           HBS      GLN  66  -5.060  -8.445  -8.445
  543   1HG   GLN  66           HGS      GLN  66  -3.006  -6.670  -6.670
  544   2HG   GLN  66           HGR      GLN  66  -2.787  -6.967  -6.967
  545   1HE2  GLN  66           HE2      GLN  66  -3.031 -10.389 -10.389
  546   2HE2  GLN  66           HE2      GLN  66  -4.298  -9.208  -9.208
  547    HA   PRO  67           HA       PRO  67  -8.381  -9.474  -9.474
  548   1HB   PRO  67           HBR      PRO  67 -10.483  -8.113  -8.113
  549   2HB   PRO  67           HBS      PRO  67 -10.127  -9.715  -9.715
  550   1HG   PRO  67           HGS      PRO  67  -9.775  -8.026  -8.026
  551   2HG   PRO  67           HGR      PRO  67  -9.034  -9.518  -9.518
  552   1HD   PRO  67           HDS      PRO  67  -7.904  -6.976  -6.976
  553   2HD   PRO  67           HDR      PRO  67  -7.133  -8.414  -8.414
  554    H    SER  68           HN       SER  68  -9.148  -6.094  -6.094
  555    HA   SER  68           HA       SER  68 -11.011  -6.127  -6.127
  556   1HB   SER  68           HBS      SER  68 -11.305  -3.865  -3.865
  557   2HB   SER  68           HBR      SER  68 -10.881  -4.480  -4.480
  558    HG   SER  68           HG       SER  68  -9.925  -2.408  -2.408
  559    H    LEU  69           HN       LEU  69  -7.592  -6.025  -6.025
  560    HA   LEU  69           HA       LEU  69  -7.024  -4.197  -4.197
  561   1HB   LEU  69           HBR      LEU  69  -5.504  -6.481  -6.481
  562   2HB   LEU  69           HBS      LEU  69  -4.802  -5.371  -5.371
  563    HG   LEU  69           HG       LEU  69  -5.870  -4.556  -4.556
  564   1HD1  LEU  69           HMD      LEU  69  -3.465  -5.836  -5.836
  565   2HD1  LEU  69           HMD      LEU  69  -3.044  -4.106  -4.106
  566   3HD1  LEU  69           HMD      LEU  69  -3.830  -4.877  -4.877
  567   1HD2  LEU  69           HMD      LEU  69  -6.099  -2.861  -2.861
  568   2HD2  LEU  69           HMD      LEU  69  -4.819  -2.407  -2.407
  569   3HD2  LEU  69           HMD      LEU  69  -4.386  -3.064  -3.064
  570    H    GLN  70           HN       GLN  70  -7.654  -7.675  -7.675
  571    HA   GLN  70           HA       GLN  70  -7.081  -8.320  -8.320
  572   1HB   GLN  70           HBR      GLN  70  -8.370 -10.273 -10.273
  573   2HB   GLN  70           HBS      GLN  70  -7.576  -9.960  -9.960
  574   1HG   GLN  70           HGS      GLN  70  -9.530  -9.725  -9.725
  575   2HG   GLN  70           HGR      GLN  70 -10.283  -8.819  -8.819
  576   1HE2  GLN  70           HE2      GLN  70 -11.545 -12.436 -12.436
  577   2HE2  GLN  70           HE2      GLN  70 -10.818 -11.331 -11.331
  578    H    THR  71           HN       THR  71  -9.539  -6.331  -6.331
  579    HA   THR  71           HA       THR  71 -11.022  -6.340  -6.340
  580    HB   THR  71           HB       THR  71 -12.202  -7.929  -7.929
  581    HG1  THR  71           HG1      THR  71 -13.961  -7.002  -7.002
  582   1HG2  THR  71           HMG      THR  71 -11.179  -7.415  -7.415
  583   2HG2  THR  71           HMG      THR  71 -12.235  -5.986  -5.986
  584   3HG2  THR  71           HMG      THR  71 -12.947  -7.619  -7.619
  585    H    GLY  72           HN       GLY  72  -9.269  -4.460  -4.460
  586   1HA   GLY  72           HAR      GLY  72 -10.964  -2.070  -2.070
  587   2HA   GLY  72           HAS      GLY  72  -9.409  -2.159  -2.159
  588    H    SER  73           HN       SER  73  -7.473  -2.626  -2.626
  589    HA   SER  73           HA       SER  73  -7.440  -2.877  -2.877
  590   1HB   SER  73           HBS      SER  73  -6.467  -0.649  -0.649
  591   2HB   SER  73           HBR      SER  73  -8.232  -0.699  -0.699
  592    HG   SER  73           HG       SER  73  -7.711   1.097   1.097
  593    H    GLU  74           HN       GLU  74  -5.188  -2.352  -2.352
  594    HA   GLU  74           HA       GLU  74  -2.958  -3.000  -3.000
  595   1HB   GLU  74           HBR      GLU  74  -3.440  -3.023  -3.023
  596   2HB   GLU  74           HBS      GLU  74  -2.945  -1.430  -1.430
  597   1HG   GLU  74           HGR      GLU  74  -0.973  -2.093  -2.093
  598   2HG   GLU  74           HGS      GLU  74  -0.874  -2.520  -2.520
  599    H    GLU  75           HN       GLU  75  -4.911  -0.232  -0.232
  600    HA   GLU  75           HA       GLU  75  -3.062   1.740   1.740
  601   1HB   GLU  75           HBR      GLU  75  -5.982   2.180   2.180
  602   2HB   GLU  75           HBS      GLU  75  -4.730   3.185   3.185
  603   1HG   GLU  75           HGS      GLU  75  -6.263   1.347   1.347
  604   2HG   GLU  75           HGR      GLU  75  -5.763   3.023   3.023
  605    H    LEU  76           HN       LEU  76  -5.640  -0.182  -0.182
  606    HA   LEU  76           HA       LEU  76  -5.395   0.985   0.985
  607   1HB   LEU  76           HBR      LEU  76  -7.053  -0.830  -0.830
  608   2HB   LEU  76           HBS      LEU  76  -6.137  -1.840  -1.840
  609    HG   LEU  76           HG       LEU  76  -8.000   0.465   0.465
  610   1HD1  LEU  76           HMD      LEU  76  -8.060  -2.488  -2.488
  611   2HD1  LEU  76           HMD      LEU  76  -8.669  -1.616  -1.616
  612   3HD1  LEU  76           HMD      LEU  76  -9.388  -1.312  -1.312
  613   1HD2  LEU  76           HMD      LEU  76  -5.671   0.076   0.076
  614   2HD2  LEU  76           HMD      LEU  76  -7.171   0.668   0.668
  615   3HD2  LEU  76           HMD      LEU  76  -6.738  -1.057  -1.057
  616    H    ARG  77           HN       ARG  77  -3.614  -1.273  -1.273
  617    HA   ARG  77           HA       ARG  77  -2.238  -2.676  -2.676
  618   1HB   ARG  77           HBR      ARG  77  -2.462  -3.144  -3.144
  619   2HB   ARG  77           HBS      ARG  77  -0.920  -2.241  -2.241
  620   1HG   ARG  77           HGS      ARG  77  -0.542  -4.045  -4.045
  621   2HG   ARG  77           HGR      ARG  77  -1.509  -4.982  -4.982
  622   1HD   ARG  77           HDS      ARG  77   0.721  -5.357  -5.357
  623   2HD   ARG  77           HDR      ARG  77   0.113  -4.160  -4.160
  624    HE   ARG  77           HE       ARG  77   1.619  -2.622  -2.622
  625   1HH1  ARG  77           HH1      ARG  77   1.138  -5.103  -5.103
  626   2HH1  ARG  77           HH1      ARG  77   2.524  -4.615  -4.615
  627   1HH2  ARG  77           HH2      ARG  77   3.496  -2.097  -2.097
  628   2HH2  ARG  77           HH2      ARG  77   3.857  -2.913  -2.913
  629    H    SER  78           HN       SER  78  -1.599   0.223   0.223
  630    HA   SER  78           HA       SER  78   0.799   0.923   0.923
  631   1HB   SER  78           HBR      SER  78  -0.989   2.881   2.881
  632   2HB   SER  78           HBS      SER  78   0.782   2.921   2.921
  633    HG   SER  78           HG       SER  78  -0.897   1.481   1.481
  634    H    LEU  79           HN       LEU  79  -2.636   1.709   1.709
  635    HA   LEU  79           HA       LEU  79  -2.432   3.504   3.504
  636   1HB   LEU  79           HBR      LEU  79  -4.391   2.509   2.509
  637   2HB   LEU  79           HBS      LEU  79  -4.654   1.534   1.534
  638    HG   LEU  79           HG       LEU  79  -5.156   3.440   3.440
  639   1HD1  LEU  79           HMD      LEU  79  -4.304   5.104   5.104
  640   2HD1  LEU  79           HMD      LEU  79  -5.038   5.730   5.730
  641   3HD1  LEU  79           HMD      LEU  79  -3.433   4.957   4.957
  642   1HD2  LEU  79           HMD      LEU  79  -6.358   3.467   3.467
  643   2HD2  LEU  79           HMD      LEU  79  -7.014   2.754   2.754
  644   3HD2  LEU  79           HMD      LEU  79  -6.953   4.525   4.525
  645    H    TYR  80           HN       TYR  80  -2.042   0.038   0.038
  646    HA   TYR  80           HA       TYR  80  -2.509  -0.456  -0.456
  647   1HB   TYR  80           HBS      TYR  80  -3.143  -2.129  -2.129
  648   2HB   TYR  80           HBR      TYR  80  -1.457  -2.241  -2.241
  649    HD1  TYR  80           HD1      TYR  80  -3.648  -2.919  -2.919
  650    HD2  TYR  80           HD2      TYR  80   0.129  -3.602  -3.602
  651    HE1  TYR  80           HE1      TYR  80  -3.152  -4.648  -4.648
  652    HE2  TYR  80           HE2      TYR  80   0.670  -5.269  -5.269
  653    HH   TYR  80           HH       TYR  80  -0.956  -6.906  -6.906
  654    H    ASN  81           HN       ASN  81   0.264  -0.080  -0.080
  655    HA   ASN  81           HA       ASN  81   2.190  -0.714  -0.714
  656   1HB   ASN  81           HBS      ASN  81   3.839   0.100   0.100
  657   2HB   ASN  81           HBR      ASN  81   2.586  -0.758  -0.758
  658   1HD2  ASN  81           HD2      ASN  81   3.103   1.960   1.960
  659   2HD2  ASN  81           HD2      ASN  81   3.595   0.341   0.341
  660    H    THR  82           HN       THR  82   0.672   2.356   2.356
  661    HA   THR  82           HA       THR  82   2.301   3.897   3.897
  662    HB   THR  82           HB       THR  82  -0.245   5.217   5.217
  663    HG1  THR  82           HG1      THR  82   0.967   3.987   3.987
  664   1HG2  THR  82           HMG      THR  82   2.557   5.686   5.686
  665   2HG2  THR  82           HMG      THR  82   1.457   6.328   6.328
  666   3HG2  THR  82           HMG      THR  82   1.254   6.811   6.811
  667    H    ILE  83           HN       ILE  83  -0.812   2.269   2.269
  668    HA   ILE  83           HA       ILE  83  -1.318   3.300   3.300
  669    HB   ILE  83           HB       ILE  83  -2.457   1.120   1.120
  670   1HG1  ILE  83           HG1      ILE  83  -3.134   3.385   3.385
  671   2HG1  ILE  83           HG1      ILE  83  -4.501   2.466   2.466
  672   1HG2  ILE  83           HMG      ILE  83  -2.365   0.430   0.430
  673   2HG2  ILE  83           HMG      ILE  83  -3.844   1.425   1.425
  674   3HG2  ILE  83           HMG      ILE  83  -3.696   0.014   0.014
  675   1HD1  ILE  83           HMD      ILE  83  -3.819   3.384   3.384
  676   2HD1  ILE  83           HMD      ILE  83  -2.690   4.463   4.463
  677   3HD1  ILE  83           HMD      ILE  83  -4.446   4.597   4.597
  678    H    ALA  84           HN       ALA  84   0.113   0.212   0.212
  679    HA   ALA  84           HA       ALA  84   0.538  -0.812  -0.812
  680   1HB   ALA  84           HMB      ALA  84   1.840  -1.405  -1.405
  681   2HB   ALA  84           HMB      ALA  84   2.324  -2.230  -2.230
  682   3HB   ALA  84           HMB      ALA  84   0.647  -2.359  -2.359
  683    H    VAL  85           HN       VAL  85   2.535   1.275   1.275
  684    HA   VAL  85           HA       VAL  85   4.767   1.429   1.429
  685    HB   VAL  85           HB       VAL  85   3.779   3.244   3.244
  686   1HG1  VAL  85           HMG      VAL  85   5.101   4.389   4.389
  687   2HG1  VAL  85           HMG      VAL  85   6.503   3.584   3.584
  688   3HG1  VAL  85           HMG      VAL  85   5.518   4.720   4.720
  689   1HG2  VAL  85           HMG      VAL  85   4.906   0.877   0.877
  690   2HG2  VAL  85           HMG      VAL  85   5.293   2.253   2.253
  691   3HG2  VAL  85           HMG      VAL  85   6.394   1.817   1.817
  692    H    LEU  86           HN       LEU  86   1.968   3.601   3.601
  693    HA   LEU  86           HA       LEU  86   2.711   5.426   5.426
  694   1HB   LEU  86           HBR      LEU  86   1.027   5.527   5.527
  695   2HB   LEU  86           HBS      LEU  86  -0.154   4.970   4.970
  696    HG   LEU  86           HG       LEU  86  -0.042   6.952   6.952
  697   1HD1  LEU  86           HMD      LEU  86   2.478   7.584   7.584
  698   2HD1  LEU  86           HMD      LEU  86   1.596   8.773   8.773
  699   3HD1  LEU  86           HMD      LEU  86   2.312   7.334   7.334
  700   1HD2  LEU  86           HMD      LEU  86  -1.156   7.042   7.042
  701   2HD2  LEU  86           HMD      LEU  86  -0.576   8.626   8.626
  702   3HD2  LEU  86           HMD      LEU  86   0.335   7.747   7.747
  703    H    TYR  87           HN       TYR  87   0.872   2.438   2.438
  704    HA   TYR  87           HA       TYR  87   0.463   2.535   2.535
  705   1HB   TYR  87           HBS      TYR  87  -0.511   0.882   0.882
  706   2HB   TYR  87           HBR      TYR  87   1.011  -0.037  -0.037
  707    HD1  TYR  87           HD1      TYR  87   1.659  -0.134  -0.134
  708    HD2  TYR  87           HD2      TYR  87  -2.275   0.410   0.410
  709    HE1  TYR  87           HE1      TYR  87   0.739  -0.913  -0.913
  710    HE2  TYR  87           HE2      TYR  87  -3.201  -0.166  -0.166
  711    HH   TYR  87           HH       TYR  87  -2.630  -0.316  -0.316
  712    H    CYS  88           HN       CYS  88   3.203   1.368   1.368
  713    HA   CYS  88           HA       CYS  88   4.898   0.491   0.491
  714   1HB   CYS  88           HBS      CYS  88   5.022   0.885   0.885
  715   2HB   CYS  88           HBR      CYS  88   6.274   1.968   1.968
  716    H    VAL  89           HN       VAL  89   4.187   3.721   3.721
  717    HA   VAL  89           HA       VAL  89   6.245   4.917   4.917
  718    HB   VAL  89           HB       VAL  89   4.054   6.323   6.323
  719   1HG1  VAL  89           HMG      VAL  89   6.810   7.113   7.113
  720   2HG1  VAL  89           HMG      VAL  89   6.013   7.935   7.935
  721   3HG1  VAL  89           HMG      VAL  89   5.253   7.940   7.940
  722   1HG2  VAL  89           HMG      VAL  89   5.920   4.475   4.475
  723   2HG2  VAL  89           HMG      VAL  89   4.779   5.536   5.536
  724   3HG2  VAL  89           HMG      VAL  89   6.427   6.104   6.104
  725    H    HIS  90           HN       HIS  90   2.703   4.726   4.726
  726    HA   HIS  90           HA       HIS  90   2.389   6.689   6.689
  727   1HB   HIS  90           HBS      HIS  90   0.542   4.386   4.386
  728   2HB   HIS  90           HBR      HIS  90   0.144   5.680   5.680
  729    HD1  HIS  90           HD1      HIS  90   1.210   8.147   8.147
  730    HD2  HIS  90           HD2      HIS  90  -1.140   5.077   5.077
  731    HE1  HIS  90           HE1      HIS  90   0.014   9.102   9.102
  732    HE2  HIS  90           HE2      HIS  90  -1.518   7.290   7.290
  733    H    GLN  91           HN       GLN  91   3.268   3.322   3.322
  734    HA   GLN  91           HA       GLN  91   3.059   2.859   2.859
  735   1HB   GLN  91           HBR      GLN  91   3.969   1.379   1.379
  736   2HB   GLN  91           HBS      GLN  91   5.193   1.327   1.327
  737   1HG   GLN  91           HGS      GLN  91   3.593  -0.550  -0.550
  738   2HG   GLN  91           HGR      GLN  91   3.572   0.479   0.479
  739   1HE2  GLN  91           HE2      GLN  91   0.088  -0.070  -0.070
  740   2HE2  GLN  91           HE2      GLN  91   1.518  -0.719  -0.719
  741    H    ARG  92           HN       ARG  92   5.851   3.642   3.642
  742    HA   ARG  92           HA       ARG  92   7.574   4.891   4.891
  743   1HB   ARG  92           HBR      ARG  92   7.195   3.126   3.126
  744   2HB   ARG  92           HBS      ARG  92   7.680   1.893   1.893
  745   1HG   ARG  92           HGR      ARG  92   9.543   2.200   2.200
  746   2HG   ARG  92           HGS      ARG  92   9.931   3.068   3.068
  747   1HD   ARG  92           HDR      ARG  92  10.574   4.416   4.416
  748   2HD   ARG  92           HDS      ARG  92   9.163   5.160   5.160
  749    HE   ARG  92           HE       ARG  92   8.123   3.574   3.574
  750   1HH1  ARG  92           HH1      ARG  92  10.576   6.105   6.105
  751   2HH1  ARG  92           HH1      ARG  92  10.076   6.783   6.783
  752   1HH2  ARG  92           HH2      ARG  92   7.415   4.568   4.568
  753   2HH2  ARG  92           HH2      ARG  92   8.289   5.913   5.913
  754    H    ILE  93           HN       ILE  93   7.138   2.123   2.123
  755    HA   ILE  93           HA       ILE  93   9.953   1.849   1.849
  756    HB   ILE  93           HB       ILE  93   7.509   0.738   0.738
  757   1HG1  ILE  93           HG1      ILE  93   8.430  -1.314  -1.314
  758   2HG1  ILE  93           HG1      ILE  93   8.545   0.127   0.127
  759   1HG2  ILE  93           HMG      ILE  93  10.431   0.076   0.076
  760   2HG2  ILE  93           HMG      ILE  93   9.232  -1.207  -1.207
  761   3HG2  ILE  93           HMG      ILE  93   9.286   0.237   0.237
  762   1HD1  ILE  93           HMD      ILE  93   6.053  -0.671  -0.671
  763   2HD1  ILE  93           HMD      ILE  93   6.380  -1.117  -1.117
  764   3HD1  ILE  93           HMD      ILE  93   6.209   0.600   0.600
  765    H    ASP  94           HN       ASP  94  10.959   2.608   2.608
  766    HA   ASP  94           HA       ASP  94   9.334   3.922   3.922
  767   1HB   ASP  94           HBR      ASP  94  11.807   5.303   5.303
  768   2HB   ASP  94           HBS      ASP  94  10.910   5.728   5.728
  769    H    VAL  95           HN       VAL  95  10.142   3.717   3.717
  770    HA   VAL  95           HA       VAL  95  12.079   1.474   1.474
  771    HB   VAL  95           HB       VAL  95  10.625   0.317   0.317
  772   1HG1  VAL  95           HMG      VAL  95   9.411   1.529   1.529
  773   2HG1  VAL  95           HMG      VAL  95   8.300   0.691   0.691
  774   3HG1  VAL  95           HMG      VAL  95   9.697  -0.175  -0.175
  775   1HG2  VAL  95           HMG      VAL  95   9.348   2.943   2.943
  776   2HG2  VAL  95           HMG      VAL  95   9.700   1.578   1.578
  777   3HG2  VAL  95           HMG      VAL  95   8.294   1.510   1.510
  778    H    LYS  96           HN       LYS  96  12.168   1.034   1.034
  779    HA   LYS  96           HA       LYS  96  13.596   3.485   3.485
  780   1HB   LYS  96           HBR      LYS  96  14.429   0.669   0.669
  781   2HB   LYS  96           HBS      LYS  96  15.318   2.203   2.203
  782   1HG   LYS  96           HGS      LYS  96  16.415   1.719   1.719
  783   2HG   LYS  96           HGR      LYS  96  14.887   2.045   2.045
  784   1HD   LYS  96           HDS      LYS  96  15.143  -0.036  -0.036
  785   2HD   LYS  96           HDR      LYS  96  14.470  -0.490  -0.490
  786   1HE   LYS  96           HES      LYS  96  16.448  -1.809  -1.809
  787   2HE   LYS  96           HER      LYS  96  16.655  -0.831  -0.831
  788   1HZ   LYS  96           HZC      LYS  96  17.573   0.134   0.134
  789   2HZ   LYS  96           HZA      LYS  96  18.511  -0.835  -0.835
  790   3HZ   LYS  96           HZB      LYS  96  18.035   0.620   0.620
  791    H    ASP  97           HN       ASP  97  11.169   1.170   1.170
  792    HA   ASP  97           HA       ASP  97  10.812   1.779   1.779
  793   1HB   ASP  97           HBS      ASP  97  12.675   0.359   0.359
  794   2HB   ASP  97           HBR      ASP  97  12.024  -0.735  -0.735
  795    H    THR  98           HN       THR  98   9.095   0.256   0.256
  796    HA   THR  98           HA       THR  98   6.799  -0.131  -0.131
  797    HB   THR  98           HB       THR  98   7.436  -1.702  -1.702
  798    HG1  THR  98           HG1      THR  98   7.847   0.100   0.100
  799   1HG2  THR  98           HMG      THR  98   5.045  -1.308  -1.308
  800   2HG2  THR  98           HMG      THR  98   4.787  -0.977  -0.977
  801   3HG2  THR  98           HMG      THR  98   5.424  -2.559  -2.559
  802    H    LYS  99           HN       LYS  99   8.690  -2.694  -2.694
  803    HA   LYS  99           HA       LYS  99   7.432  -4.666  -4.666
  804   1HB   LYS  99           HBR      LYS  99   9.004  -6.250  -6.250
  805   2HB   LYS  99           HBS      LYS  99   8.478  -5.104  -5.104
  806   1HG   LYS  99           HGR      LYS  99  10.562  -4.149  -4.149
  807   2HG   LYS  99           HGS      LYS  99  11.015  -4.509  -4.509
  808   1HD   LYS  99           HDS      LYS  99  12.363  -5.831  -5.831
  809   2HD   LYS  99           HDR      LYS  99  11.288  -6.837  -6.837
  810   1HE   LYS  99           HER      LYS  99  11.493  -7.582  -7.582
  811   2HE   LYS  99           HES      LYS  99   9.813  -7.159  -7.159
  812   1HZ   LYS  99           HZA      LYS  99  11.479  -5.112  -5.112
  813   2HZ   LYS  99           HZB      LYS  99  10.907  -6.290  -6.290
  814   3HZ   LYS  99           HZC      LYS  99   9.870  -5.353  -5.353
  815    H    GLU 100           HN       GLU 100  10.128  -2.662  -2.662
  816    HA   GLU 100           HA       GLU 100  11.177  -4.238  -4.238
  817   1HB   GLU 100           HBR      GLU 100  11.253  -1.353  -1.353
  818   2HB   GLU 100           HBS      GLU 100  11.840  -1.804  -1.804
  819   1HG   GLU 100           HGR      GLU 100  13.434  -1.528  -1.528
  820   2HG   GLU 100           HGS      GLU 100  13.674  -2.619  -2.619
  821    H    ALA 101           HN       ALA 101   8.977  -1.412  -1.412
  822    HA   ALA 101           HA       ALA 101   8.104  -1.487  -1.487
  823   1HB   ALA 101           HMB      ALA 101   7.543   0.017   0.017
  824   2HB   ALA 101           HMB      ALA 101   6.011  -0.797  -0.797
  825   3HB   ALA 101           HMB      ALA 101   6.836   0.208   0.208
  826    H    LEU 102           HN       LEU 102   6.773  -2.950  -2.950
  827    HA   LEU 102           HA       LEU 102   4.598  -4.175  -4.175
  828   1HB   LEU 102           HBS      LEU 102   5.487  -3.747  -3.747
  829   2HB   LEU 102           HBR      LEU 102   5.592  -5.524  -5.524
  830    HG   LEU 102           HG       LEU 102   3.190  -5.521  -5.521
  831   1HD1  LEU 102           HMD      LEU 102   3.581  -2.766  -2.766
  832   2HD1  LEU 102           HMD      LEU 102   2.617  -2.976  -2.976
  833   3HD1  LEU 102           HMD      LEU 102   2.024  -3.630  -3.630
  834   1HD2  LEU 102           HMD      LEU 102   4.322  -4.792  -4.792
  835   2HD2  LEU 102           HMD      LEU 102   3.357  -6.208  -6.208
  836   3HD2  LEU 102           HMD      LEU 102   2.554  -4.650  -4.650
  837    H    ASP 103           HN       ASP 103   7.908  -5.035  -5.035
  838    HA   ASP 103           HA       ASP 103   7.399  -7.773  -7.773
  839   1HB   ASP 103           HBR      ASP 103   9.403  -6.992  -6.992
  840   2HB   ASP 103           HBS      ASP 103  10.022  -6.305  -6.305
  841    H    LYS 104           HN       LYS 104   8.353  -4.802  -4.802
  842    HA   LYS 104           HA       LYS 104   8.049  -5.698  -5.698
  843   1HB   LYS 104           HBR      LYS 104   8.692  -3.347  -3.347
  844   2HB   LYS 104           HBS      LYS 104   6.946  -3.083  -3.083
  845   1HG   LYS 104           HGS      LYS 104   7.811  -2.236  -2.236
  846   2HG   LYS 104           HGR      LYS 104   6.465  -3.403  -3.403
  847   1HD   LYS 104           HDS      LYS 104   8.212  -3.780  -3.780
  848   2HD   LYS 104           HDR      LYS 104   7.955  -5.142  -5.142
  849   1HE   LYS 104           HES      LYS 104  10.259  -5.037  -5.037
  850   2HE   LYS 104           HER      LYS 104   9.897  -4.250  -4.250
  851   1HZ   LYS 104           HZB      LYS 104   9.947  -2.483  -2.483
  852   2HZ   LYS 104           HZC      LYS 104  11.389  -3.180  -3.180
  853   3HZ   LYS 104           HZA      LYS 104  10.623  -2.317  -2.317
  854    H    ILE 105           HN       ILE 105   5.630  -4.714  -4.714
  855    HA   ILE 105           HA       ILE 105   3.530  -4.735  -4.735
  856    HB   ILE 105           HB       ILE 105   3.344  -4.166  -4.166
  857   1HG1  ILE 105           HG1      ILE 105   5.161  -2.936  -2.936
  858   2HG1  ILE 105           HG1      ILE 105   4.029  -1.952  -1.952
  859   1HG2  ILE 105           HMG      ILE 105   1.500  -3.734  -3.734
  860   2HG2  ILE 105           HMG      ILE 105   1.596  -2.459  -2.459
  861   3HG2  ILE 105           HMG      ILE 105   1.156  -4.123  -4.123
  862   1HD1  ILE 105           HMD      ILE 105   2.748  -1.775  -1.775
  863   2HD1  ILE 105           HMD      ILE 105   4.359  -2.166  -2.166
  864   3HD1  ILE 105           HMD      ILE 105   4.144  -0.728  -0.728
  865    H    GLU 106           HN       GLU 106   4.793  -6.881  -6.881
  866    HA   GLU 106           HA       GLU 106   2.502  -8.655  -8.655
  867   1HB   GLU 106           HBR      GLU 106   4.192  -8.520  -8.520
  868   2HB   GLU 106           HBS      GLU 106   5.408  -8.717  -8.717
  869   1HG   GLU 106           HGR      GLU 106   5.128 -10.621 -10.621
  870   2HG   GLU 106           HGS      GLU 106   5.202 -10.903 -10.903
  871    H    GLU 107           HN       GLU 107   5.445  -8.369  -8.369
  872    HA   GLU 107           HA       GLU 107   5.132 -10.609 -10.609
  873   1HB   GLU 107           HBR      GLU 107   6.927  -8.774  -8.774
  874   2HB   GLU 107           HBS      GLU 107   5.962  -7.833  -7.833
  875   1HG   GLU 107           HGS      GLU 107   6.580  -8.619  -8.619
  876   2HG   GLU 107           HGR      GLU 107   6.669 -10.319 -10.319
  877    H    GLU 108           HN       GLU 108   3.132  -7.845  -7.845
  878    HA   GLU 108           HA       GLU 108   1.413  -6.884  -6.884
  879   1HB   GLU 108           HBR      GLU 108   1.342  -9.531  -9.531
  880   2HB   GLU 108           HBS      GLU 108   1.631  -8.660  -8.660
  881   1HG   GLU 108           HGS      GLU 108  -0.320  -8.089  -8.089
  882   2HG   GLU 108           HGR      GLU 108  -0.618  -7.502  -7.502
  883    H    GLN 109           HN       GLN 109   4.476  -6.921  -6.921
  884    HA   GLN 109           HA       GLN 109   5.931  -5.488  -5.488
  885   1HB   GLN 109           HBR      GLN 109   4.547  -4.068  -4.068
  886   2HB   GLN 109           HBS      GLN 109   3.257  -4.077  -4.077
  887   1HG   GLN 109           HGS      GLN 109   5.484  -3.065  -3.065
  888   2HG   GLN 109           HGR      GLN 109   5.591  -2.356  -2.356
  889   1HE2  GLN 109           HE2      GLN 109   2.322  -1.593  -1.593
  890   2HE2  GLN 109           HE2      GLN 109   2.834  -3.226  -3.226
  891    H    ASN 110           HN       ASN 110   6.531  -6.668  -6.668
  892    HA   ASN 110           HA       ASN 110   6.771  -7.164  -7.164
  893   1HB   ASN 110           HBS      ASN 110   4.842  -4.977  -4.977
  894   2HB   ASN 110           HBR      ASN 110   6.091  -5.770  -5.770
  895   1HD2  ASN 110           HD2      ASN 110   7.262  -2.376  -2.376
  896   2HD2  ASN 110           HD2      ASN 110   5.854  -2.968  -2.968
  897    H    LYS 111           HN       LYS 111   5.927  -8.820  -8.820
  898    HA   LYS 111           HA       LYS 111   4.535 -10.609 -10.609
  899   1HB   LYS 111           HBR      LYS 111   2.313  -8.638  -8.638
  900   2HB   LYS 111           HBS      LYS 111   2.085 -10.322 -10.322
  901   1HG   LYS 111           HGR      LYS 111   3.873  -8.885  -8.885
  902   2HG   LYS 111           HGS      LYS 111   2.324  -8.017  -8.017
  903   1HD   LYS 111           HDS      LYS 111   2.754 -10.846 -10.846
  904   2HD   LYS 111           HDR      LYS 111   2.192  -9.478  -9.478
  905   1HE   LYS 111           HES      LYS 111   0.162  -9.344  -9.344
  906   2HE   LYS 111           HER      LYS 111   0.730 -10.756 -10.756
  907   1HZ   LYS 111           HZC      LYS 111   0.861 -11.484 -11.484
  908   2HZ   LYS 111           HZA      LYS 111  -0.563 -10.695 -10.695
  909   3HZ   LYS 111           HZB      LYS 111  -0.247 -11.973 -11.973
  910    H    SER 112           HN       SER 112   4.657 -12.166 -12.166
  911    HA   SER 112           HA       SER 112   3.749 -11.641 -11.641
  912   1HB   SER 112           HBS      SER 112   5.841 -13.673 -13.673
  913   2HB   SER 112           HBR      SER 112   5.692 -12.401 -12.401
  914    HG   SER 112           HG       SER 112   6.302 -10.812 -10.812
  915    H    LYS 113           HN       LYS 113   2.982 -13.388 -13.388
  916    HA   LYS 113           HA       LYS 113   1.956 -15.380 -15.380
  917   1HB   LYS 113           HBR      LYS 113   3.794 -16.120 -16.120
  918   2HB   LYS 113           HBS      LYS 113   2.637 -17.309 -17.309
  919   1HG   LYS 113           HGR      LYS 113   4.345 -15.843 -15.843
  920   2HG   LYS 113           HGS      LYS 113   5.158 -17.038 -17.038
  921   1HD   LYS 113           HDS      LYS 113   4.516 -18.630 -18.630
  922   2HD   LYS 113           HDR      LYS 113   2.884 -18.345 -18.345
  923   1HE   LYS 113           HES      LYS 113   3.120 -18.361 -18.361
  924   2HE   LYS 113           HER      LYS 113   2.419 -16.861 -16.861
  925   1HZ   LYS 113           HZA      LYS 113   5.009 -16.299 -16.299
  926   2HZ   LYS 113           HZB      LYS 113   4.900 -17.256 -17.256
  927   3HZ   LYS 113           HZC      LYS 113   3.970 -15.920 -15.920
  928    H    LYS 114           HN       LYS 114  -0.142 -15.497 -15.497
  929    HA   LYS 114           HA       LYS 114  -1.351 -15.629 -15.629
  930   1HB   LYS 114           HBR      LYS 114  -2.382 -14.202 -14.202
  931   2HB   LYS 114           HBS      LYS 114  -2.751 -15.713 -15.713
  932   1HG   LYS 114           HGR      LYS 114  -4.698 -15.727 -15.727
  933   2HG   LYS 114           HGS      LYS 114  -3.748 -16.188 -16.188
  934   1HD   LYS 114           HDS      LYS 114  -3.820 -14.121 -14.121
  935   2HD   LYS 114           HDR      LYS 114  -3.879 -13.312 -13.312
  936   1HE   LYS 114           HES      LYS 114  -6.242 -14.158 -14.158
  937   2HE   LYS 114           HER      LYS 114  -6.135 -14.662 -14.662
  938   1HZ   LYS 114           HZC      LYS 114  -5.473 -11.928 -11.928
  939   2HZ   LYS 114           HZA      LYS 114  -7.037 -12.361 -12.361
  940   3HZ   LYS 114           HZB      LYS 114  -5.997 -12.500 -12.500
  941    H    LYS 115           HN       LYS 115  -1.268 -17.414 -17.414
  942    HA   LYS 115           HA       LYS 115  -2.276 -19.905 -19.905
  943   1HB   LYS 115           HBR      LYS 115  -1.827 -19.022 -19.022
  944   2HB   LYS 115           HBS      LYS 115  -0.285 -19.882 -19.882
  945   1HG   LYS 115           HGR      LYS 115  -1.852 -21.841 -21.841
  946   2HG   LYS 115           HGS      LYS 115  -3.091 -20.970 -20.970
  947   1HD   LYS 115           HDS      LYS 115  -2.168 -21.469 -21.469
  948   2HD   LYS 115           HDR      LYS 115  -0.539 -21.319 -21.319
  949   1HE   LYS 115           HES      LYS 115  -0.308 -23.502 -23.502
  950   2HE   LYS 115           HER      LYS 115  -1.797 -23.597 -23.597
  951   1HZ   LYS 115           HZC      LYS 115  -3.039 -23.618 -23.618
  952   2HZ   LYS 115           HZA      LYS 115  -1.658 -23.603 -23.603
  953   3HZ   LYS 115           HZB      LYS 115  -2.009 -24.883 -24.883
  954    H    ALA 116           HN       ALA 116  -1.339 -21.151 -21.151
  955    HA   ALA 116           HA       ALA 116   1.604 -20.897 -20.897
  956   1HB   ALA 116           HMB      ALA 116  -0.666 -20.498 -20.498
  957   2HB   ALA 116           HMB      ALA 116   0.380 -21.797 -21.797
  958   3HB   ALA 116           HMB      ALA 116   1.064 -20.187 -20.187
  959    H    GLN 117           HN       GLN 117   1.762 -22.883 -22.883
  960    HA   GLN 117           HA       GLN 117   2.252 -25.105 -25.105
  961   1HB   GLN 117           HBR      GLN 117  -0.087 -25.610 -25.610
  962   2HB   GLN 117           HBS      GLN 117   0.333 -25.580 -25.580
  963   1HG   GLN 117           HGS      GLN 117   0.202 -27.866 -27.866
  964   2HG   GLN 117           HGR      GLN 117   1.849 -27.457 -27.457
  965   1HE2  GLN 117           HE2      GLN 117   3.299 -27.419 -27.419
  966   2HE2  GLN 117           HE2      GLN 117   3.362 -26.672 -26.672
  967    H    GLN 118           HN       GLN 118   1.641 -25.242 -25.242
  968    HA   GLN 118           HA       GLN 118   4.449 -24.990 -24.990
  969   1HB   GLN 118           HBR      GLN 118   3.191 -27.669 -27.669
  970   2HB   GLN 118           HBS      GLN 118   4.332 -27.443 -27.443
  971   1HG   GLN 118           HGS      GLN 118   5.932 -26.454 -26.454
  972   2HG   GLN 118           HGR      GLN 118   4.828 -27.123 -27.123
  973   1HE2  GLN 118           HE2      GLN 118   5.789 -30.447 -30.447
  974   2HE2  GLN 118           HE2      GLN 118   4.664 -29.315 -29.315
  975    H    ALA 119           HN       ALA 119   2.084 -27.213 -27.213
  976    HA   ALA 119           HA       ALA 119   0.696 -25.385 -25.385
  977   1HB   ALA 119           HMB      ALA 119   3.256 -26.307 -26.307
  978   2HB   ALA 119           HMB      ALA 119   1.823 -26.381 -26.381
  979   3HB   ALA 119           HMB      ALA 119   2.299 -24.836 -24.836
  980    H    ALA 120           HN       ALA 120  -0.969 -26.677 -26.677
  981    HA   ALA 120           HA       ALA 120  -2.578 -28.281 -28.281
  982   1HB   ALA 120           HMB      ALA 120  -1.845 -27.455 -27.455
  983   2HB   ALA 120           HMB      ALA 120  -1.292 -29.142 -29.142
  984   3HB   ALA 120           HMB      ALA 120  -2.998 -28.794 -28.794
  985    H    ALA 121           HN       ALA 121  -2.517 -30.743 -30.743
  986    HA   ALA 121           HA       ALA 121  -1.416 -32.260 -32.260
  987   1HB   ALA 121           HMB      ALA 121  -3.693 -32.513 -32.513
  988   2HB   ALA 121           HMB      ALA 121  -2.777 -33.438 -33.438
  989   3HB   ALA 121           HMB      ALA 121  -2.799 -33.977 -33.977
  990    H    ASP 122           HN       ASP 122   0.773 -32.322 -32.322
  991    HA   ASP 122           HA       ASP 122   1.723 -34.222 -34.222
  992   1HB   ASP 122           HBS      ASP 122   3.783 -33.161 -33.161
  993   2HB   ASP 122           HBR      ASP 122   2.495 -31.950 -31.950
  994    H    THR 123           HN       THR 123   0.689 -34.387 -34.387
  995    HA   THR 123           HA       THR 123   2.750 -36.276 -36.276
  996    HB   THR 123           HB       THR 123   2.351 -35.488 -35.488
  997    HG1  THR 123           HG1      THR 123   2.136 -33.499 -33.499
  998   1HG2  THR 123           HMG      THR 123   4.403 -34.911 -34.911
  999   2HG2  THR 123           HMG      THR 123   4.139 -33.449 -33.449
 1000   3HG2  THR 123           HMG      THR 123   4.512 -35.001 -35.001
 1001    H    GLY 124           HN       GLY 124   1.032 -37.560 -37.560
 1002   1HA   GLY 124           HAR      GLY 124  -1.198 -38.102 -38.102
 1003   2HA   GLY 124           HAS      GLY 124  -1.542 -37.720 -37.720
 1004    H    ASN 125           HN       ASN 125  -2.348 -39.650 -39.650
 1005    HA   ASN 125           HA       ASN 125  -0.532 -41.974 -41.974
 1006   1HB   ASN 125           HBS      ASN 125  -3.356 -42.326 -42.326
 1007   2HB   ASN 125           HBR      ASN 125  -1.947 -43.415 -43.415
 1008   1HD2  ASN 125           HD2      ASN 125  -0.576 -41.796 -41.796
 1009   2HD2  ASN 125           HD2      ASN 125  -0.190 -42.734 -42.734
 1010    H    ASN 126           HN       ASN 126  -3.860 -40.985 -40.985
 1011    HA   ASN 126           HA       ASN 126  -4.971 -41.034 -41.034
 1012   1HB   ASN 126           HBS      ASN 126  -2.433 -41.521 -41.521
 1013   2HB   ASN 126           HBR      ASN 126  -3.934 -40.690 -40.690
 1014   1HD2  ASN 126           HD2      ASN 126  -2.665 -37.556 -37.556
 1015   2HD2  ASN 126           HD2      ASN 126  -3.682 -38.571 -38.571
 1016    H    SER 127           HN       SER 127  -4.110 -43.383 -43.383
 1017    HA   SER 127           HA       SER 127  -5.825 -45.163 -45.163
 1018   1HB   SER 127           HBS      SER 127  -4.239 -47.054 -47.054
 1019   2HB   SER 127           HBR      SER 127  -4.247 -45.702 -45.702
 1020    HG   SER 127           HG       SER 127  -2.389 -46.412 -46.412
 1021    H    GLN 128           HN       GLN 128  -5.618 -47.448 -47.448
 1022    HA   GLN 128           HA       GLN 128  -4.438 -47.248 -47.248
 1023   1HB   GLN 128           HBR      GLN 128  -6.218 -48.674 -48.674
 1024   2HB   GLN 128           HBS      GLN 128  -6.804 -47.076 -47.076
 1025   1HG   GLN 128           HGS      GLN 128  -8.451 -48.378 -48.378
 1026   2HG   GLN 128           HGR      GLN 128  -7.297 -48.432 -48.432
 1027   1HE2  GLN 128           HE2      GLN 128  -6.968 -51.849 -51.849
 1028   2HE2  GLN 128           HE2      GLN 128  -6.729 -50.322 -50.322
 1029    H    VAL 129           HN       VAL 129  -3.706 -48.332 -48.332
 1030    HA   VAL 129           HA       VAL 129  -2.901 -51.007 -51.007
 1031    HB   VAL 129           HB       VAL 129  -2.420 -51.443 -51.443
 1032   1HG1  VAL 129           HMG      VAL 129  -4.987 -51.632 -51.632
 1033   2HG1  VAL 129           HMG      VAL 129  -5.041 -51.936 -51.936
 1034   3HG1  VAL 129           HMG      VAL 129  -3.967 -52.904 -52.904
 1035   1HG2  VAL 129           HMG      VAL 129  -4.456 -49.218 -49.218
 1036   2HG2  VAL 129           HMG      VAL 129  -2.809 -49.261 -49.261
 1037   3HG2  VAL 129           HMG      VAL 129  -4.055 -50.366 -50.366
 1038    H    SER 130           HN       SER 130  -1.767 -48.483 -48.483
 1039    HA   SER 130           HA       SER 130   0.980 -49.114 -49.114
 1040   1HB   SER 130           HBS      SER 130   0.005 -46.313 -46.313
 1041   2HB   SER 130           HBR      SER 130   1.652 -46.806 -46.806
 1042    HG   SER 130           HG       SER 130   1.013 -47.402 -47.402
 1043    H    GLN 131           HN       GLN 131  -1.188 -47.813 -47.813
 1044    HA   GLN 131           HA       GLN 131  -0.046 -49.462 -49.462
 1045   1HB   GLN 131           HBR      GLN 131   0.627 -47.479 -47.479
 1046   2HB   GLN 131           HBS      GLN 131   1.797 -48.210 -48.210
 1047   1HG   GLN 131           HGS      GLN 131   1.322 -46.383 -46.383
 1048   2HG   GLN 131           HGR      GLN 131   0.249 -45.633 -45.633
 1049   1HE2  GLN 131           HE2      GLN 131   2.893 -43.697 -43.697
 1050   2HE2  GLN 131           HE2      GLN 131   1.271 -43.811 -43.811
 1051    H    ASN 132           HN       ASN 132  -0.770 -48.405 -48.405
 1052    HA   ASN 132           HA       ASN 132  -3.090 -46.746 -46.746
 1053   1HB   ASN 132           HBS      ASN 132  -3.502 -49.661 -49.661
 1054   2HB   ASN 132           HBR      ASN 132  -4.442 -48.596 -48.596
 1055   1HD2  ASN 132           HD2      ASN 132  -6.362 -49.223 -49.223
 1056   2HD2  ASN 132           HD2      ASN 132  -5.654 -50.231 -50.231
 1057    H    TYR 133           HN       TYR 133  -2.731 -49.188 -49.188
 1058    HA   TYR 133           HA       TYR 133  -2.341 -48.995 -48.995
 1059   1HB   TYR 133           HBS      TYR 133  -0.132 -47.919 -47.919
 1060   2HB   TYR 133           HBR      TYR 133  -0.383 -46.895 -46.895
 1061    HD1  TYR 133           HD1      TYR 133  -0.123 -50.532 -50.532
 1062    HD2  TYR 133           HD2      TYR 133   0.621 -47.540 -47.540
 1063    HE1  TYR 133           HE1      TYR 133   0.996 -52.202 -52.202
 1064    HE2  TYR 133           HE2      TYR 133   1.715 -49.203 -49.203
 1065    HH   TYR 133           HH       TYR 133   2.799 -51.167 -51.167

  Start of MODEL    4
    1   1H    HIS   1           HN       HIS   1  -7.591  15.606  15.606
    2   2H    HIS   1           HNB      HIS   1  -8.857  16.570  16.570
    3   3H    HIS   1           HNC      HIS   1  -7.779  17.032  17.032
    4    HA   HIS   1           HA       HIS   1  -7.317  18.291  18.291
    5   1HB   HIS   1           HBR      HIS   1  -6.518  16.896  16.896
    6   2HB   HIS   1           HBS      HIS   1  -8.252  17.256  17.256
    7    HD1  HIS   1           HD1      HIS   1  -5.773  14.370  14.370
    8    HD2  HIS   1           HD2      HIS   1  -9.838  15.082  15.082
    9    HE1  HIS   1           HE1      HIS   1  -6.846  12.127  12.127
   10    HE2  HIS   1           HE2      HIS   1  -9.302  12.553  12.553
   11    H    MET   2           HN       MET   2  -5.557  18.855  18.855
   12    HA   MET   2           HA       MET   2  -3.391  18.945  18.945
   13   1HB   MET   2           HBS      MET   2  -1.782  18.558  18.558
   14   2HB   MET   2           HBR      MET   2  -3.262  19.243  19.243
   15   1HG   MET   2           HGS      MET   2  -3.906  17.084  17.084
   16   2HG   MET   2           HGR      MET   2  -2.625  16.268  16.268
   17   1HE   MET   2           HME      MET   2  -0.534  16.100  16.100
   18   2HE   MET   2           HME      MET   2   0.418  17.540  17.540
   19   3HE   MET   2           HME      MET   2   0.252  16.195  16.195
   20    H    GLY   3           HN       GLY   3  -4.932  16.539  16.539
   21   1HA   GLY   3           HAR      GLY   3  -3.156  14.264  14.264
   22   2HA   GLY   3           HAS      GLY   3  -4.563  14.610  14.610
   23    H    ALA   4           HN       ALA   4  -2.540  13.576  13.576
   24    HA   ALA   4           HA       ALA   4  -0.619  15.632  15.632
   25   1HB   ALA   4           HMB      ALA   4   0.081  13.340  13.340
   26   2HB   ALA   4           HMB      ALA   4  -0.812  12.708  12.708
   27   3HB   ALA   4           HMB      ALA   4   0.571  13.806  13.806
   28    H    ARG   5           HN       ARG   5  -2.725  13.240  13.240
   29    HA   ARG   5           HA       ARG   5  -4.055  13.421  13.421
   30   1HB   ARG   5           HBR      ARG   5  -3.450  16.394  16.394
   31   2HB   ARG   5           HBS      ARG   5  -4.736  15.539  15.539
   32   1HG   ARG   5           HGS      ARG   5  -5.080  14.918  14.918
   33   2HG   ARG   5           HGR      ARG   5  -4.811  16.681  16.681
   34   1HD   ARG   5           HDS      ARG   5  -6.497  16.303  16.303
   35   2HD   ARG   5           HDR      ARG   5  -7.040  15.006  15.006
   36    HE   ARG   5           HE       ARG   5  -7.210  17.906  17.906
   37   1HH1  ARG   5           HH1      ARG   5  -7.869  14.621  14.621
   38   2HH1  ARG   5           HH1      ARG   5  -8.793  15.145  15.145
   39   1HH2  ARG   5           HH2      ARG   5  -8.314  18.555  18.555
   40   2HH2  ARG   5           HH2      ARG   5  -9.045  17.372  17.372
   41    H    ALA   6           HN       ALA   6  -1.512  15.923  15.923
   42    HA   ALA   6           HA       ALA   6  -0.031  16.337  16.337
   43   1HB   ALA   6           HMB      ALA   6   0.792  14.035  14.035
   44   2HB   ALA   6           HMB      ALA   6  -0.385  13.427  13.427
   45   3HB   ALA   6           HMB      ALA   6   0.912  14.535  14.535
   46    H    SER   7           HN       SER   7  -0.035  15.375  15.375
   47    HA   SER   7           HA       SER   7  -2.774  16.100  16.100
   48   1HB   SER   7           HBR      SER   7  -0.205  16.364  16.364
   49   2HB   SER   7           HBS      SER   7  -1.850  16.878  16.878
   50    HG   SER   7           HG       SER   7  -1.765  18.618  18.618
   51    H    VAL   8           HN       VAL   8  -0.482  14.702  14.702
   52    HA   VAL   8           HA       VAL   8  -1.559  11.990  11.990
   53    HB   VAL   8           HB       VAL   8   0.307  13.231  13.231
   54   1HG1  VAL   8           HMG      VAL   8   0.150  10.520  10.520
   55   2HG1  VAL   8           HMG      VAL   8  -0.839  10.692  10.692
   56   3HG1  VAL   8           HMG      VAL   8   0.854  11.242  11.242
   57   1HG2  VAL   8           HMG      VAL   8  -1.985  14.011  14.011
   58   2HG2  VAL   8           HMG      VAL   8  -1.535  12.975  12.975
   59   3HG2  VAL   8           HMG      VAL   8  -2.571  12.331  12.331
   60    H    LEU   9           HN       LEU   9   1.592  13.633  13.633
   61    HA   LEU   9           HA       LEU   9   2.829  11.268  11.268
   62   1HB   LEU   9           HBR      LEU   9   3.456  13.111  13.111
   63   2HB   LEU   9           HBS      LEU   9   4.797  12.281  12.281
   64    HG   LEU   9           HG       LEU   9   2.469  10.975  10.975
   65   1HD1  LEU   9           HMD      LEU   9   4.288  12.063  12.063
   66   2HD1  LEU   9           HMD      LEU   9   5.425  10.903  10.903
   67   3HD1  LEU   9           HMD      LEU   9   4.062  10.314  10.314
   68   1HD2  LEU   9           HMD      LEU   9   4.323  10.066  10.066
   69   2HD2  LEU   9           HMD      LEU   9   2.925   9.232   9.232
   70   3HD2  LEU   9           HMD      LEU   9   4.521   9.140   9.140
   71    H    SER  10           HN       SER  10   5.398  12.325  12.325
   72    HA   SER  10           HA       SER  10   5.041  14.229  14.229
   73   1HB   SER  10           HBS      SER  10   6.027  12.888  12.888
   74   2HB   SER  10           HBR      SER  10   4.844  11.815  11.815
   75    HG   SER  10           HG       SER  10   6.665  10.647  10.647
   76    H    GLY  11           HN       GLY  11   7.413  14.405  14.405
   77   1HA   GLY  11           HAR      GLY  11   8.990  15.779  15.779
   78   2HA   GLY  11           HAS      GLY  11   9.602  15.107  15.107
   79    H    GLY  12           HN       GLY  12  10.031  12.658  12.658
   80   1HA   GLY  12           HAR      GLY  12  11.933  12.071  12.071
   81   2HA   GLY  12           HAS      GLY  12  11.241  10.895  10.895
   82    H    GLU  13           HN       GLU  13   8.489  11.327  11.327
   83    HA   GLU  13           HA       GLU  13   8.523   9.114   9.114
   84   1HB   GLU  13           HBR      GLU  13   6.388  10.924  10.924
   85   2HB   GLU  13           HBS      GLU  13   6.032   9.691   9.691
   86   1HG   GLU  13           HGS      GLU  13   6.943   8.043   8.043
   87   2HG   GLU  13           HGR      GLU  13   7.042   9.294   9.294
   88    H    LEU  14           HN       LEU  14   7.616  12.538  12.538
   89    HA   LEU  14           HA       LEU  14   6.941  12.425  12.425
   90   1HB   LEU  14           HBR      LEU  14   6.724  14.230  14.230
   91   2HB   LEU  14           HBS      LEU  14   8.222  14.819  14.819
   92    HG   LEU  14           HG       LEU  14   6.513  16.110  16.110
   93   1HD1  LEU  14           HMD      LEU  14   7.968  14.418  14.418
   94   2HD1  LEU  14           HMD      LEU  14   6.295  14.183  14.183
   95   3HD1  LEU  14           HMD      LEU  14   7.001  15.817  15.817
   96   1HD2  LEU  14           HMD      LEU  14   4.832  14.269  14.269
   97   2HD2  LEU  14           HMD      LEU  14   4.368  15.417  15.417
   98   3HD2  LEU  14           HMD      LEU  14   4.856  13.756  13.756
   99    H    ASP  15           HN       ASP  15   9.909  13.395  13.395
  100    HA   ASP  15           HA       ASP  15  11.405  13.862  13.862
  101   1HB   ASP  15           HBR      ASP  15  12.469  13.192  13.192
  102   2HB   ASP  15           HBS      ASP  15  13.348  13.989  13.989
  103    H    LYS  16           HN       LYS  16  10.668  10.917  10.917
  104    HA   LYS  16           HA       LYS  16  12.412   9.240   9.240
  105   1HB   LYS  16           HBR      LYS  16  11.146   8.700   8.700
  106   2HB   LYS  16           HBS      LYS  16   9.823   8.269   8.269
  107   1HG   LYS  16           HGR      LYS  16  12.607   7.057   7.057
  108   2HG   LYS  16           HGS      LYS  16  11.043   6.264   6.264
  109   1HD   LYS  16           HDS      LYS  16  11.226   5.465   5.465
  110   2HD   LYS  16           HDR      LYS  16  10.575   7.017   7.017
  111   1HE   LYS  16           HES      LYS  16  12.880   7.881   7.881
  112   2HE   LYS  16           HER      LYS  16  13.475   6.228   6.228
  113   1HZ   LYS  16           HZC      LYS  16  12.052   5.521   5.521
  114   2HZ   LYS  16           HZA      LYS  16  11.746   7.087   7.087
  115   3HZ   LYS  16           HZB      LYS  16  13.271   6.511   6.511
  116    H    TRP  17           HN       TRP  17   9.030  10.379  10.379
  117    HA   TRP  17           HA       TRP  17   8.091   8.539   8.539
  118   1HB   TRP  17           HBS      TRP  17   6.607   9.708   9.708
  119   2HB   TRP  17           HBR      TRP  17   6.979  11.266  11.266
  120    HD1  TRP  17           HD1      TRP  17   5.972  11.610  11.610
  121    HE1  TRP  17           HE1      TRP  17   4.246  10.344  10.344
  122    HE3  TRP  17           HE3      TRP  17   5.421   7.521   7.521
  123    HZ2  TRP  17           HZ2      TRP  17   2.849   7.918   7.918
  124    HZ3  TRP  17           HZ3      TRP  17   3.788   5.811   5.811
  125    HH2  TRP  17           HH2      TRP  17   2.592   5.950   5.950
  126    H    GLU  18           HN       GLU  18   9.976  11.364  11.364
  127    HA   GLU  18           HA       GLU  18   8.899  12.019  12.019
  128   1HB   GLU  18           HBR      GLU  18  10.116  13.224  13.224
  129   2HB   GLU  18           HBS      GLU  18  11.437  13.036  13.036
  130   1HG   GLU  18           HGS      GLU  18   9.443  14.230  14.230
  131   2HG   GLU  18           HGR      GLU  18   9.660  15.154  15.154
  132    H    LYS  19           HN       LYS  19  10.297   9.385   9.385
  133    HA   LYS  19           HA       LYS  19  10.870   9.290   9.290
  134   1HB   LYS  19           HBR      LYS  19  13.298  10.107  10.107
  135   2HB   LYS  19           HBS      LYS  19  13.512   8.662   8.662
  136   1HG   LYS  19           HGS      LYS  19  13.486   9.881   9.881
  137   2HG   LYS  19           HGR      LYS  19  12.037  10.791  10.791
  138   1HD   LYS  19           HDS      LYS  19  13.648  12.431  12.431
  139   2HD   LYS  19           HDR      LYS  19  13.614  12.099  12.099
  140   1HE   LYS  19           HES      LYS  19  15.528  10.345  10.345
  141   2HE   LYS  19           HER      LYS  19  15.751  11.665  11.665
  142   1HZ   LYS  19           HZA      LYS  19  15.634  12.059  12.059
  143   2HZ   LYS  19           HZB      LYS  19  17.021  11.943  11.943
  144   3HZ   LYS  19           HZC      LYS  19  15.995  13.184  13.184
  145    H    ILE  20           HN       ILE  20   9.488   7.568   7.568
  146    HA   ILE  20           HA       ILE  20  11.037   5.251   5.251
  147    HB   ILE  20           HB       ILE  20   8.063   5.905   5.905
  148   1HG1  ILE  20           HG1      ILE  20   9.973   5.076   5.076
  149   2HG1  ILE  20           HG1      ILE  20   9.575   6.765   6.765
  150   1HG2  ILE  20           HMG      ILE  20   8.580   3.444   3.444
  151   2HG2  ILE  20           HMG      ILE  20   9.020   3.266   3.266
  152   3HG2  ILE  20           HMG      ILE  20   7.379   3.799   3.799
  153   1HD1  ILE  20           HMD      ILE  20   7.092   5.839   5.839
  154   2HD1  ILE  20           HMD      ILE  20   7.972   4.720   4.720
  155   3HD1  ILE  20           HMD      ILE  20   8.092   6.482   6.482
  156    H    ARG  21           HN       ARG  21  12.053   4.302   4.302
  157    HA   ARG  21           HA       ARG  21  11.405   4.475   4.475
  158   1HB   ARG  21           HBR      ARG  21  13.382   3.148   3.148
  159   2HB   ARG  21           HBS      ARG  21  12.759   1.990   1.990
  160   1HG   ARG  21           HGS      ARG  21  13.135   3.966   3.966
  161   2HG   ARG  21           HGR      ARG  21  14.227   4.585   4.585
  162   1HD   ARG  21           HDR      ARG  21  14.878   1.908   1.908
  163   2HD   ARG  21           HDS      ARG  21  14.571   2.402   2.402
  164    HE   ARG  21           HE       ARG  21  16.316   4.049   4.049
  165   1HH1  ARG  21           HH1      ARG  21  15.951   2.100   2.100
  166   2HH1  ARG  21           HH1      ARG  21  17.597   2.327   2.327
  167   1HH2  ARG  21           HH2      ARG  21  18.495   4.215   4.215
  168   2HH2  ARG  21           HH2      ARG  21  19.036   3.527   3.527
  169    H    LEU  22           HN       LEU  22   9.765   3.759   3.759
  170    HA   LEU  22           HA       LEU  22   7.763   2.178   2.178
  171   1HB   LEU  22           HBR      LEU  22   8.026   2.682   2.682
  172   2HB   LEU  22           HBS      LEU  22   6.551   2.574   2.574
  173    HG   LEU  22           HG       LEU  22   8.281   4.778   4.778
  174   1HD1  LEU  22           HMD      LEU  22   8.821   4.714   4.714
  175   2HD1  LEU  22           HMD      LEU  22   7.081   4.849   4.849
  176   3HD1  LEU  22           HMD      LEU  22   7.921   6.174   6.174
  177   1HD2  LEU  22           HMD      LEU  22   5.743   4.095   4.095
  178   2HD2  LEU  22           HMD      LEU  22   6.249   5.802   5.802
  179   3HD2  LEU  22           HMD      LEU  22   5.529   5.033   5.033
  180    H    ARG  23           HN       ARG  23  10.600   1.282   1.282
  181    HA   ARG  23           HA       ARG  23  10.090  -1.483  -1.483
  182   1HB   ARG  23           HBR      ARG  23  10.958  -2.092  -2.092
  183   2HB   ARG  23           HBS      ARG  23   9.222  -2.011  -2.011
  184   1HG   ARG  23           HGS      ARG  23  10.125   0.590   0.590
  185   2HG   ARG  23           HGR      ARG  23  10.616  -0.627  -0.627
  186   1HD   ARG  23           HDS      ARG  23   7.836  -0.438  -0.438
  187   2HD   ARG  23           HDR      ARG  23   8.359   0.425   0.425
  188    HE   ARG  23           HE       ARG  23   8.956  -1.923  -1.923
  189   1HH1  ARG  23           HH1      ARG  23   6.195  -1.131  -1.131
  190   2HH1  ARG  23           HH1      ARG  23   5.340  -2.582  -2.582
  191   1HH2  ARG  23           HH2      ARG  23   7.866  -3.868  -3.868
  192   2HH2  ARG  23           HH2      ARG  23   6.285  -4.132  -4.132
  193    HA   PRO  24           HA       PRO  24  14.425  -1.412  -1.412
  194   1HB   PRO  24           HBR      PRO  24  14.870  -4.042  -4.042
  195   2HB   PRO  24           HBS      PRO  24  14.532  -3.324  -3.324
  196   1HG   PRO  24           HGS      PRO  24  12.861  -4.897  -4.897
  197   2HG   PRO  24           HGR      PRO  24  12.721  -4.544  -4.544
  198   1HD   PRO  24           HDS      PRO  24  11.215  -3.470  -3.470
  199   2HD   PRO  24           HDR      PRO  24  11.359  -2.870  -2.870
  200    H    GLY  25           HN       GLY  25  15.364  -0.208  -0.208
  201   1HA   GLY  25           HAS      GLY  25  16.657   0.213   0.213
  202   2HA   GLY  25           HAR      GLY  25  16.664  -1.543  -1.543
  203    H    GLY  26           HN       GLY  26  13.564  -0.083  -0.083
  204   1HA   GLY  26           HAS      GLY  26  12.628  -0.477  -0.477
  205   2HA   GLY  26           HAR      GLY  26  11.906   0.627   0.627
  206    H    LYS  27           HN       LYS  27  12.681   2.789   2.789
  207    HA   LYS  27           HA       LYS  27  14.430   4.054   4.054
  208   1HB   LYS  27           HBS      LYS  27  12.438   5.095   5.095
  209   2HB   LYS  27           HBR      LYS  27  13.126   3.524   3.524
  210   1HG   LYS  27           HGS      LYS  27  10.901   2.996   2.996
  211   2HG   LYS  27           HGR      LYS  27  11.201   2.601   2.601
  212   1HD   LYS  27           HDR      LYS  27   9.948   4.297   4.297
  213   2HD   LYS  27           HDS      LYS  27  10.476   5.406   5.406
  214   1HE   LYS  27           HES      LYS  27   8.910   3.434   3.434
  215   2HE   LYS  27           HER      LYS  27   8.061   3.891   3.891
  216   1HZ   LYS  27           HZC      LYS  27   8.529   6.239   6.239
  217   2HZ   LYS  27           HZA      LYS  27   8.828   5.599   5.599
  218   3HZ   LYS  27           HZB      LYS  27   7.359   5.412   5.412
  219    H    LYS  28           HN       LYS  28  11.457   4.119   4.119
  220    HA   LYS  28           HA       LYS  28  11.993   6.955   6.955
  221   1HB   LYS  28           HBR      LYS  28   9.479   5.726   5.726
  222   2HB   LYS  28           HBS      LYS  28   9.436   7.187   7.187
  223   1HG   LYS  28           HGS      LYS  28  11.393   7.314   7.314
  224   2HG   LYS  28           HGR      LYS  28   9.691   7.180   7.180
  225   1HD   LYS  28           HDR      LYS  28  10.343   9.111   9.111
  226   2HD   LYS  28           HDS      LYS  28  10.983   9.492   9.492
  227   1HE   LYS  28           HES      LYS  28   8.102   8.719   8.719
  228   2HE   LYS  28           HER      LYS  28   8.626  10.330  10.330
  229   1HZ   LYS  28           HZC      LYS  28   9.754  10.383  10.383
  230   2HZ   LYS  28           HZA      LYS  28   8.670   9.230   9.230
  231   3HZ   LYS  28           HZB      LYS  28   8.154  10.692  10.692
  232    H    GLN  29           HN       GLN  29   9.939   7.476   7.476
  233    HA   GLN  29           HA       GLN  29   9.918   5.405   5.405
  234   1HB   GLN  29           HBS      GLN  29  10.572   7.458   7.458
  235   2HB   GLN  29           HBR      GLN  29  11.787   6.379   6.379
  236   1HG   GLN  29           HGS      GLN  29  11.180   8.504   8.504
  237   2HG   GLN  29           HGR      GLN  29  11.541   9.199   9.199
  238   1HE2  GLN  29           HE2      GLN  29  14.843   7.622   7.622
  239   2HE2  GLN  29           HE2      GLN  29  13.397   7.592   7.592
  240    H    TYR  30           HN       TYR  30   8.965   6.844   6.844
  241    HA   TYR  30           HA       TYR  30   6.328   7.845   7.845
  242   1HB   TYR  30           HBS      TYR  30   7.292   7.383   7.383
  243   2HB   TYR  30           HBR      TYR  30   5.667   7.901   7.901
  244    HD1  TYR  30           HD2      TYR  30   6.867   5.316   5.316
  245    HD2  TYR  30           HD1      TYR  30   5.024   6.004   6.004
  246    HE1  TYR  30           HE2      TYR  30   6.413   2.912   2.912
  247    HE2  TYR  30           HE1      TYR  30   4.534   3.605   3.605
  248    HH   TYR  30           HH       TYR  30   5.981   1.519   1.519
  249    H    LYS  31           HN       LYS  31   5.725   9.901   9.901
  250    HA   LYS  31           HA       LYS  31   7.526  11.530  11.530
  251   1HB   LYS  31           HBS      LYS  31   6.329  12.399  12.399
  252   2HB   LYS  31           HBR      LYS  31   6.719  13.559  13.559
  253   1HG   LYS  31           HGR      LYS  31   9.088  12.635  12.635
  254   2HG   LYS  31           HGS      LYS  31   8.625  11.760  11.760
  255   1HD   LYS  31           HDS      LYS  31   9.114  13.529  13.529
  256   2HD   LYS  31           HDR      LYS  31   7.776  14.353  14.353
  257   1HE   LYS  31           HER      LYS  31   9.672  15.733  15.733
  258   2HE   LYS  31           HES      LYS  31   9.285  15.081  15.081
  259   1HZ   LYS  31           HZC      LYS  31  11.170  13.604  13.604
  260   2HZ   LYS  31           HZA      LYS  31  11.690  15.022  15.022
  261   3HZ   LYS  31           HZB      LYS  31  11.141  13.844  13.844
  262    H    LEU  32           HN       LEU  32   6.066  13.717  13.717
  263    HA   LEU  32           HA       LEU  32   3.788  12.541  12.541
  264   1HB   LEU  32           HBS      LEU  32   5.677  13.487  13.487
  265   2HB   LEU  32           HBR      LEU  32   5.406  15.071  15.071
  266    HG   LEU  32           HG       LEU  32   3.027  14.844  14.844
  267   1HD1  LEU  32           HMD      LEU  32   3.409  12.572  12.572
  268   2HD1  LEU  32           HMD      LEU  32   4.773  13.173  13.173
  269   3HD1  LEU  32           HMD      LEU  32   3.118  13.738  13.738
  270   1HD2  LEU  32           HMD      LEU  32   5.659  15.817  15.817
  271   2HD2  LEU  32           HMD      LEU  32   4.115  16.681  16.681
  272   3HD2  LEU  32           HMD      LEU  32   4.404  15.704  15.704
  273    H    LYS  33           HN       LYS  33   4.414  14.647  14.647
  274    HA   LYS  33           HA       LYS  33   1.677  15.769  15.769
  275   1HB   LYS  33           HBS      LYS  33   3.430  16.967  16.967
  276   2HB   LYS  33           HBR      LYS  33   3.853  15.465  15.465
  277   1HG   LYS  33           HGS      LYS  33   1.448  15.469  15.469
  278   2HG   LYS  33           HGR      LYS  33   1.334  17.137  17.137
  279   1HD   LYS  33           HDR      LYS  33   3.615  16.358  16.358
  280   2HD   LYS  33           HDS      LYS  33   2.049  16.533  16.533
  281   1HE   LYS  33           HES      LYS  33   3.574  18.560  18.560
  282   2HE   LYS  33           HER      LYS  33   1.907  18.808  18.808
  283   1HZ   LYS  33           HZC      LYS  33   4.250  18.373  18.373
  284   2HZ   LYS  33           HZA      LYS  33   3.581  19.831  19.831
  285   3HZ   LYS  33           HZB      LYS  33   2.728  18.698  18.698
  286    H    HIS  34           HN       DHI  34   3.588  12.938  12.938
  287    HA   HIS  34           HA       DHI  34   1.551  11.664  11.664
  288   1HB   HIS  34           HBS      DHI  34   3.765  11.397  11.397
  289   2HB   HIS  34           HBR      DHI  34   4.402  11.023  11.023
  290    HD2  HIS  34           HD2      DHI  34   1.679   9.120   9.120
  291    HE1  HIS  34           HE1      DHI  34   4.385   6.331   6.331
  292    HE2  HIS  34           HE2      DHI  34   2.325   6.623   6.623
  293    H    ILE  35           HN       ILE  35   2.526  11.762  11.762
  294    HA   ILE  35           HA       ILE  35   0.871   9.525   9.525
  295    HB   ILE  35           HB       ILE  35   2.664  10.893  10.893
  296   1HG1  ILE  35           HG1      ILE  35   0.128  10.230  10.230
  297   2HG1  ILE  35           HG1      ILE  35   0.998   8.969   8.969
  298   1HG2  ILE  35           HMG      ILE  35   0.426  12.801  12.801
  299   2HG2  ILE  35           HMG      ILE  35   1.024  12.347  12.347
  300   3HG2  ILE  35           HMG      ILE  35   2.149  13.016  13.016
  301   1HD1  ILE  35           HMD      ILE  35   2.929  10.351  10.351
  302   2HD1  ILE  35           HMD      ILE  35   1.548   9.996   9.996
  303   3HD1  ILE  35           HMD      ILE  35   2.353   8.674   8.674
  304    H    VAL  36           HN       VAL  36   0.478  12.980  12.980
  305    HA   VAL  36           HA       VAL  36  -2.133  13.172  13.172
  306    HB   VAL  36           HB       VAL  36  -0.668  14.841  14.841
  307   1HG1  VAL  36           HMG      VAL  36  -3.406  15.194  15.194
  308   2HG1  VAL  36           HMG      VAL  36  -2.391  16.627  16.627
  309   3HG1  VAL  36           HMG      VAL  36  -2.790  15.532  15.532
  310   1HG2  VAL  36           HMG      VAL  36  -0.230  14.567  14.567
  311   2HG2  VAL  36           HMG      VAL  36   0.323  15.896  15.896
  312   3HG2  VAL  36           HMG      VAL  36  -1.195  16.057  16.057
  313    H    TRP  37           HN       TRP  37  -0.878  12.364  12.364
  314    HA   TRP  37           HA       TRP  37  -3.320  11.751  11.751
  315   1HB   TRP  37           HBR      TRP  37  -1.305  11.834  11.834
  316   2HB   TRP  37           HBS      TRP  37  -0.551  10.570  10.570
  317    HD1  TRP  37           HD1      TRP  37  -2.980  11.012  11.012
  318    HE1  TRP  37           HE1      TRP  37  -3.576   8.718   8.718
  319    HE3  TRP  37           HE3      TRP  37  -0.717   8.082   8.082
  320    HZ2  TRP  37           HZ2      TRP  37  -3.198   6.024   6.024
  321    HZ3  TRP  37           HZ3      TRP  37  -0.826   5.649   5.649
  322    HH2  TRP  37           HH2      TRP  37  -2.012   4.630   4.630
  323    H    ALA  38           HN       ALA  38  -1.300   9.873   9.873
  324    HA   ALA  38           HA       ALA  38  -2.569   7.321   7.321
  325   1HB   ALA  38           HMB      ALA  38  -0.312   8.294   8.294
  326   2HB   ALA  38           HMB      ALA  38  -1.363   7.503   7.503
  327   3HB   ALA  38           HMB      ALA  38  -0.811   6.598   6.598
  328    H    SER  39           HN       SER  39  -2.416   9.291   9.291
  329    HA   SER  39           HA       SER  39  -4.472   7.925   7.925
  330   1HB   SER  39           HBR      SER  39  -3.566  10.782  10.782
  331   2HB   SER  39           HBS      SER  39  -4.473   9.744   9.744
  332    HG   SER  39           HG       SER  39  -1.948  10.100  10.100
  333    H    ARG  40           HN       ARG  40  -4.630  10.409  10.409
  334    HA   ARG  40           HA       ARG  40  -7.391  11.038  11.038
  335   1HB   ARG  40           HBS      ARG  40  -5.787  12.569  12.569
  336   2HB   ARG  40           HBR      ARG  40  -5.759  11.475  11.475
  337   1HG   ARG  40           HGR      ARG  40  -7.574  12.443  12.443
  338   2HG   ARG  40           HGS      ARG  40  -8.484  12.139  12.139
  339   1HD   ARG  40           HDS      ARG  40  -6.506  14.328  14.328
  340   2HD   ARG  40           HDR      ARG  40  -7.929  14.583  14.583
  341    HE   ARG  40           HE       ARG  40  -7.998  14.101  14.101
  342   1HH1  ARG  40           HH1      ARG  40  -9.706  14.872  14.872
  343   2HH1  ARG  40           HH1      ARG  40 -11.024  15.637  15.637
  344   1HH2  ARG  40           HH2      ARG  40  -9.672  15.226  15.226
  345   2HH2  ARG  40           HH2      ARG  40 -11.007  15.835  15.835
  346    H    GLU  41           HN       GLU  41  -5.728   9.122   9.122
  347    HA   GLU  41           HA       GLU  41  -8.002   8.175   8.175
  348   1HB   GLU  41           HBR      GLU  41  -5.322   7.968   7.968
  349   2HB   GLU  41           HBS      GLU  41  -5.625   6.508   6.508
  350   1HG   GLU  41           HGR      GLU  41  -5.669   5.592   5.592
  351   2HG   GLU  41           HGS      GLU  41  -7.328   6.252   6.252
  352    H    LEU  42           HN       LEU  42  -6.553   7.212   7.212
  353    HA   LEU  42           HA       LEU  42  -7.994   4.730   4.730
  354   1HB   LEU  42           HBR      LEU  42  -5.993   5.214   5.214
  355   2HB   LEU  42           HBS      LEU  42  -6.660   6.782   6.782
  356    HG   LEU  42           HG       LEU  42  -8.479   4.830   4.830
  357   1HD1  LEU  42           HMD      LEU  42  -5.747   3.790   3.790
  358   2HD1  LEU  42           HMD      LEU  42  -6.398   3.785   3.785
  359   3HD1  LEU  42           HMD      LEU  42  -7.280   2.953   2.953
  360   1HD2  LEU  42           HMD      LEU  42  -6.480   6.685   6.685
  361   2HD2  LEU  42           HMD      LEU  42  -8.254   6.631   6.631
  362   3HD2  LEU  42           HMD      LEU  42  -7.250   5.459   5.459
  363    H    GLU  43           HN       GLU  43  -8.290   7.940   7.940
  364    HA   GLU  43           HA       GLU  43 -10.670   7.437   7.437
  365   1HB   GLU  43           HBR      GLU  43  -9.120   9.174   9.174
  366   2HB   GLU  43           HBS      GLU  43  -9.230   9.804   9.804
  367   1HG   GLU  43           HGS      GLU  43 -11.637  10.343  10.343
  368   2HG   GLU  43           HGR      GLU  43 -11.033  10.315  10.315
  369    H    ARG  44           HN       ARG  44 -10.080   8.428   8.428
  370    HA   ARG  44           HA       ARG  44 -12.928   8.942   8.942
  371   1HB   ARG  44           HBR      ARG  44 -10.441   9.771   9.771
  372   2HB   ARG  44           HBS      ARG  44 -11.438   8.982   8.982
  373   1HG   ARG  44           HGS      ARG  44 -13.333  10.534  10.534
  374   2HG   ARG  44           HGR      ARG  44 -11.948  11.495  11.495
  375   1HD   ARG  44           HDR      ARG  44 -11.742  10.606  10.606
  376   2HD   ARG  44           HDS      ARG  44 -13.088  11.730  11.730
  377    HE   ARG  44           HE       ARG  44 -10.443  12.491  12.491
  378   1HH1  ARG  44           HH1      ARG  44 -13.055  13.016  13.016
  379   2HH1  ARG  44           HH1      ARG  44 -12.342  14.457  14.457
  380   1HH2  ARG  44           HH2      ARG  44  -9.476  14.304  14.304
  381   2HH2  ARG  44           HH2      ARG  44 -10.321  15.191  15.191
  382    H    PHE  45           HN       PHE  45 -10.838   6.275   6.275
  383    HA   PHE  45           HA       PHE  45 -12.301   4.636   4.636
  384   1HB   PHE  45           HBS      PHE  45 -10.203   4.172   4.172
  385   2HB   PHE  45           HBR      PHE  45 -11.487   2.933   2.933
  386    HD1  PHE  45           HD2      PHE  45 -12.012   1.690   1.690
  387    HD2  PHE  45           HD1      PHE  45  -8.570   4.119   4.119
  388    HE1  PHE  45           HE2      PHE  45 -10.933   0.674   0.674
  389    HE2  PHE  45           HE1      PHE  45  -7.578   3.292   3.292
  390    HZ   PHE  45           HZ       PHE  45  -8.681   1.448   1.448
  391    H    ALA  46           HN       ALA  46 -12.230   4.673   4.673
  392    HA   ALA  46           HA       ALA  46 -15.160   4.618   4.618
  393   1HB   ALA  46           HMB      ALA  46 -13.348   2.209   2.209
  394   2HB   ALA  46           HMB      ALA  46 -14.908   2.271   2.271
  395   3HB   ALA  46           HMB      ALA  46 -14.864   2.426   2.426
  396    H    VAL  47           HN       VAL  47 -12.501   5.865   5.865
  397    HA   VAL  47           HA       VAL  47 -12.551   4.767   4.767
  398    HB   VAL  47           HB       VAL  47 -10.153   5.746   5.746
  399   1HG1  VAL  47           HMG      VAL  47 -10.467   4.317   4.317
  400   2HG1  VAL  47           HMG      VAL  47  -8.953   4.269   4.269
  401   3HG1  VAL  47           HMG      VAL  47  -9.596   5.826   5.826
  402   1HG2  VAL  47           HMG      VAL  47 -11.112   3.851   3.851
  403   2HG2  VAL  47           HMG      VAL  47  -9.592   3.389   3.389
  404   3HG2  VAL  47           HMG      VAL  47 -11.152   2.912   2.912
  405    H    ASN  48           HN       ASN  48 -11.679   6.093   6.093
  406    HA   ASN  48           HA       ASN  48 -12.101   8.994   8.994
  407   1HB   ASN  48           HBS      ASN  48 -13.656   8.338   8.338
  408   2HB   ASN  48           HBR      ASN  48 -12.440   7.375   7.375
  409   1HD2  ASN  48           HD2      ASN  48 -13.154  11.139  11.139
  410   2HD2  ASN  48           HD2      ASN  48 -14.195  10.152  10.152
  411    HA   PRO  49           HA       PRO  49  -7.916   9.568   9.568
  412   1HB   PRO  49           HBR      PRO  49  -7.854  12.141  12.141
  413   2HB   PRO  49           HBS      PRO  49  -8.072  11.613  11.613
  414   1HG   PRO  49           HGS      PRO  49  -9.914  12.816  12.816
  415   2HG   PRO  49           HGR      PRO  49 -10.073  12.467  12.467
  416   1HD   PRO  49           HDR      PRO  49 -11.175  11.097  11.097
  417   2HD   PRO  49           HDS      PRO  49 -11.401  10.804  10.804
  418    H    GLY  50           HN       GLY  50  -9.237  11.117  11.117
  419   1HA   GLY  50           HAR      GLY  50  -6.983  10.734  10.734
  420   2HA   GLY  50           HAS      GLY  50  -8.667  10.931  10.931
  421    H    LEU  51           HN       LEU  51  -9.271   8.512   8.512
  422    HA   LEU  51           HA       LEU  51  -9.267   6.459   6.459
  423   1HB   LEU  51           HBR      LEU  51 -10.786   7.186   7.186
  424   2HB   LEU  51           HBS      LEU  51  -9.748   5.965   5.965
  425    HG   LEU  51           HG       LEU  51 -11.528   5.519   5.519
  426   1HD1  LEU  51           HMD      LEU  51 -11.904   5.019   5.019
  427   2HD1  LEU  51           HMD      LEU  51 -12.716   4.008   4.008
  428   3HD1  LEU  51           HMD      LEU  51 -13.017   5.763   5.763
  429   1HD2  LEU  51           HMD      LEU  51  -9.370   4.016   4.016
  430   2HD2  LEU  51           HMD      LEU  51 -10.234   3.727   3.727
  431   3HD2  LEU  51           HMD      LEU  51 -10.898   3.101   3.101
  432    H    LEU  52           HN       LEU  52  -7.692   7.017   7.017
  433    HA   LEU  52           HA       LEU  52  -5.732   5.039   5.039
  434   1HB   LEU  52           HBS      LEU  52  -5.916   4.899   4.899
  435   2HB   LEU  52           HBR      LEU  52  -6.851   6.413   6.413
  436    HG   LEU  52           HG       LEU  52  -5.034   6.357   6.357
  437   1HD1  LEU  52           HMD      LEU  52  -5.814   8.487   8.487
  438   2HD1  LEU  52           HMD      LEU  52  -4.372   8.369   8.369
  439   3HD1  LEU  52           HMD      LEU  52  -4.188   8.532   8.532
  440   1HD2  LEU  52           HMD      LEU  52  -3.609   5.043   5.043
  441   2HD2  LEU  52           HMD      LEU  52  -2.873   5.918   5.918
  442   3HD2  LEU  52           HMD      LEU  52  -2.965   6.689   6.689
  443    H    GLU  53           HN       GLU  53  -5.900   8.358   8.358
  444    HA   GLU  53           HA       GLU  53  -3.147   9.104   9.104
  445   1HB   GLU  53           HBR      GLU  53  -5.064  10.587  10.587
  446   2HB   GLU  53           HBS      GLU  53  -5.598   9.723   9.723
  447   1HG   GLU  53           HGR      GLU  53  -4.265  12.067  12.067
  448   2HG   GLU  53           HGS      GLU  53  -4.744  10.924  10.924
  449    H    THR  54           HN       THR  54  -5.285   7.452   7.452
  450    HA   THR  54           HA       THR  54  -3.043   6.821   6.821
  451    HB   THR  54           HB       THR  54  -4.647   5.899   5.899
  452    HG1  THR  54           HG1      THR  54  -6.278   5.975   5.975
  453   1HG2  THR  54           HMG      THR  54  -5.021   8.433   8.433
  454   2HG2  THR  54           HMG      THR  54  -6.660   7.732   7.732
  455   3HG2  THR  54           HMG      THR  54  -5.751   7.770   7.770
  456    H    SER  55           HN       SER  55  -2.361   4.718   4.718
  457    HA   SER  55           HA       SER  55  -1.916   2.764   2.764
  458   1HB   SER  55           HBS      SER  55  -1.108   1.388   1.388
  459   2HB   SER  55           HBR      SER  55  -0.752   3.046   3.046
  460    HG   SER  55           HG       SER  55  -1.755   1.190   1.190
  461    H    GLU  56           HN       GLU  56  -4.598   3.230   3.230
  462    HA   GLU  56           HA       GLU  56  -5.555   0.539   0.539
  463   1HB   GLU  56           HBS      GLU  56  -5.928   2.732   2.732
  464   2HB   GLU  56           HBR      GLU  56  -7.265   2.964   2.964
  465   1HG   GLU  56           HGR      GLU  56  -7.552   0.368   0.368
  466   2HG   GLU  56           HGS      GLU  56  -6.789   1.371   1.371
  467    H    GLY  57           HN       GLY  57  -6.611   3.522   3.522
  468   1HA   GLY  57           HAR      GLY  57  -8.601   2.109   2.109
  469   2HA   GLY  57           HAS      GLY  57  -8.131   3.821   3.821
  470    H    CYS  58           HN       CYS  58  -5.266   3.170   3.170
  471    HA   CYS  58           HA       CYS  58  -4.973   2.440   2.440
  472   1HB   CYS  58           HBR      CYS  58  -3.353   3.593   3.593
  473   2HB   CYS  58           HBS      CYS  58  -2.747   1.919   1.919
  474    H    ARG  59           HN       ARG  59  -5.072   0.542   0.542
  475    HA   ARG  59           HA       ARG  59  -4.593  -1.949  -1.949
  476   1HB   ARG  59           HBR      ARG  59  -4.310  -1.426  -1.426
  477   2HB   ARG  59           HBS      ARG  59  -6.081  -1.637  -1.637
  478   1HG   ARG  59           HGS      ARG  59  -4.736  -3.838  -3.838
  479   2HG   ARG  59           HGR      ARG  59  -4.187  -3.624  -3.624
  480   1HD   ARG  59           HDR      ARG  59  -6.949  -3.313  -3.313
  481   2HD   ARG  59           HDS      ARG  59  -6.675  -4.666  -4.666
  482    HE   ARG  59           HE       ARG  59  -5.782  -5.937  -5.937
  483   1HH1  ARG  59           HH1      ARG  59  -6.835  -2.754  -2.754
  484   2HH1  ARG  59           HH1      ARG  59  -6.579  -3.124  -3.124
  485   1HH2  ARG  59           HH2      ARG  59  -5.347  -6.343  -6.343
  486   2HH2  ARG  59           HH2      ARG  59  -5.741  -5.156  -5.156
  487    H    GLN  60           HN       GLN  60  -7.384   0.066   0.066
  488    HA   GLN  60           HA       GLN  60  -9.392  -2.046  -2.046
  489   1HB   GLN  60           HBR      GLN  60  -9.862   0.085   0.085
  490   2HB   GLN  60           HBS      GLN  60  -9.788   0.938   0.938
  491   1HG   GLN  60           HGS      GLN  60 -12.087   0.439   0.439
  492   2HG   GLN  60           HGR      GLN  60 -11.629  -0.408  -0.408
  493   1HE2  GLN  60           HE2      GLN  60 -11.681  -2.725  -2.725
  494   2HE2  GLN  60           HE2      GLN  60 -10.844  -1.210  -1.210
  495    H    ILE  61           HN       ILE  61  -7.434   0.242   0.242
  496    HA   ILE  61           HA       ILE  61  -8.650  -0.506  -0.506
  497    HB   ILE  61           HB       ILE  61  -6.149   1.161   1.161
  498   1HG1  ILE  61           HG1      ILE  61  -7.872   2.430   2.430
  499   2HG1  ILE  61           HG1      ILE  61  -7.710   2.992   2.992
  500   1HG2  ILE  61           HMG      ILE  61  -6.273  -0.078  -0.078
  501   2HG2  ILE  61           HMG      ILE  61  -7.455   1.196   1.196
  502   3HG2  ILE  61           HMG      ILE  61  -5.800   1.640   1.640
  503   1HD1  ILE  61           HMD      ILE  61  -9.731   0.871   0.871
  504   2HD1  ILE  61           HMD      ILE  61 -10.067   2.593   2.593
  505   3HD1  ILE  61           HMD      ILE  61  -9.734   2.045   2.045
  506    H    LEU  62           HN       LEU  62  -5.334  -0.970  -0.970
  507    HA   LEU  62           HA       LEU  62  -4.447  -2.494  -2.494
  508   1HB   LEU  62           HBR      LEU  62  -3.278  -1.311  -1.311
  509   2HB   LEU  62           HBS      LEU  62  -3.399  -2.926  -2.926
  510    HG   LEU  62           HG       LEU  62  -2.029  -3.875  -3.875
  511   1HD1  LEU  62           HMD      LEU  62  -2.844  -1.960  -1.960
  512   2HD1  LEU  62           HMD      LEU  62  -1.383  -1.137  -1.137
  513   3HD1  LEU  62           HMD      LEU  62  -1.246  -2.724  -2.724
  514   1HD2  LEU  62           HMD      LEU  62  -1.002  -1.384  -1.384
  515   2HD2  LEU  62           HMD      LEU  62  -0.911  -3.072  -3.072
  516   3HD2  LEU  62           HMD      LEU  62   0.054  -2.549  -2.549
  517    H    GLY  63           HN       GLY  63  -6.470  -3.378  -3.378
  518   1HA   GLY  63           HAR      GLY  63  -6.351  -6.243  -6.243
  519   2HA   GLY  63           HAS      GLY  63  -7.595  -5.346  -5.346
  520    H    GLN  64           HN       GLN  64  -8.899  -3.798  -3.798
  521    HA   GLN  64           HA       GLN  64 -10.475  -5.481  -5.481
  522   1HB   GLN  64           HBS      GLN  64 -10.811  -2.997  -2.997
  523   2HB   GLN  64           HBR      GLN  64 -10.556  -2.617  -2.617
  524   1HG   GLN  64           HGS      GLN  64 -12.379  -4.857  -4.857
  525   2HG   GLN  64           HGR      GLN  64 -12.941  -3.386  -3.386
  526   1HE2  GLN  64           HE2      GLN  64 -13.292  -3.821  -3.821
  527   2HE2  GLN  64           HE2      GLN  64 -12.955  -5.088  -5.088
  528    H    LEU  65           HN       LEU  65  -7.490  -3.979  -3.979
  529    HA   LEU  65           HA       LEU  65  -8.145  -3.434  -3.434
  530   1HB   LEU  65           HBR      LEU  65  -7.169  -1.869  -1.869
  531   2HB   LEU  65           HBS      LEU  65  -5.634  -2.749  -2.749
  532    HG   LEU  65           HG       LEU  65  -5.800  -2.080  -2.080
  533   1HD1  LEU  65           HMD      LEU  65  -8.199  -0.771  -0.771
  534   2HD1  LEU  65           HMD      LEU  65  -7.146   0.300   0.300
  535   3HD1  LEU  65           HMD      LEU  65  -7.789  -1.196  -1.196
  536   1HD2  LEU  65           HMD      LEU  65  -4.564  -1.011  -1.011
  537   2HD2  LEU  65           HMD      LEU  65  -4.506  -0.254  -0.254
  538   3HD2  LEU  65           HMD      LEU  65  -5.637   0.361   0.361
  539    H    GLN  66           HN       GLN  66  -5.830  -5.339  -5.339
  540    HA   GLN  66           HA       GLN  66  -4.246  -6.289  -6.289
  541   1HB   GLN  66           HBR      GLN  66  -4.822  -7.112  -7.112
  542   2HB   GLN  66           HBS      GLN  66  -4.661  -8.542  -8.542
  543   1HG   GLN  66           HGS      GLN  66  -2.557  -6.803  -6.803
  544   2HG   GLN  66           HGR      GLN  66  -2.630  -6.806  -6.806
  545   1HE2  GLN  66           HE2      GLN  66  -2.325 -10.510 -10.510
  546   2HE2  GLN  66           HE2      GLN  66  -3.481  -9.339  -9.339
  547    HA   PRO  67           HA       PRO  67  -7.723  -9.609  -9.609
  548   1HB   PRO  67           HBS      PRO  67  -9.968  -8.424  -8.424
  549   2HB   PRO  67           HBR      PRO  67  -9.513 -10.000 -10.000
  550   1HG   PRO  67           HGR      PRO  67  -9.404  -8.310  -8.310
  551   2HG   PRO  67           HGS      PRO  67  -8.544  -9.738  -9.738
  552   1HD   PRO  67           HDS      PRO  67  -7.608  -7.100  -7.100
  553   2HD   PRO  67           HDR      PRO  67  -6.746  -8.463  -8.463
  554    H    SER  68           HN       SER  68  -8.479  -6.245  -6.245
  555    HA   SER  68           HA       SER  68 -10.304  -6.268  -6.268
  556   1HB   SER  68           HBR      SER  68 -10.686  -4.779  -4.779
  557   2HB   SER  68           HBS      SER  68  -9.134  -3.950  -3.950
  558    HG   SER  68           HG       SER  68 -11.664  -3.719  -3.719
  559    H    LEU  69           HN       LEU  69  -6.939  -6.193  -6.193
  560    HA   LEU  69           HA       LEU  69  -6.320  -4.463  -4.463
  561   1HB   LEU  69           HBR      LEU  69  -4.824  -6.684  -6.684
  562   2HB   LEU  69           HBS      LEU  69  -4.101  -5.624  -5.624
  563    HG   LEU  69           HG       LEU  69  -5.269  -4.663  -4.663
  564   1HD1  LEU  69           HMD      LEU  69  -2.863  -6.035  -6.035
  565   2HD1  LEU  69           HMD      LEU  69  -2.408  -4.313  -4.313
  566   3HD1  LEU  69           HMD      LEU  69  -3.304  -5.023  -5.023
  567   1HD2  LEU  69           HMD      LEU  69  -4.659  -3.384  -3.384
  568   2HD2  LEU  69           HMD      LEU  69  -5.053  -2.632  -2.632
  569   3HD2  LEU  69           HMD      LEU  69  -3.355  -2.951  -2.951
  570    H    GLN  70           HN       GLN  70  -6.939  -7.939  -7.939
  571    HA   GLN  70           HA       GLN  70  -6.576  -8.582  -8.582
  572   1HB   GLN  70           HBR      GLN  70  -7.762 -10.580 -10.580
  573   2HB   GLN  70           HBS      GLN  70  -6.753 -10.263 -10.263
  574   1HG   GLN  70           HGS      GLN  70  -8.522 -10.347 -10.347
  575   2HG   GLN  70           HGR      GLN  70  -9.375  -9.116  -9.116
  576   1HE2  GLN  70           HE2      GLN  70 -10.718 -11.758 -11.758
  577   2HE2  GLN  70           HE2      GLN  70  -9.695 -10.371 -10.371
  578    H    THR  71           HN       THR  71  -8.863  -6.644  -6.644
  579    HA   THR  71           HA       THR  71 -10.818  -7.007  -7.007
  580    HB   THR  71           HB       THR  71 -12.563  -6.433  -6.433
  581    HG1  THR  71           HG1      THR  71 -12.054  -4.985  -4.985
  582   1HG2  THR  71           HMG      THR  71 -11.044  -8.653  -8.653
  583   2HG2  THR  71           HMG      THR  71 -11.042  -7.892  -7.892
  584   3HG2  THR  71           HMG      THR  71 -12.587  -8.288  -8.288
  585    H    GLY  72           HN       GLY  72  -8.555  -4.806  -4.806
  586   1HA   GLY  72           HAR      GLY  72 -10.172  -2.416  -2.416
  587   2HA   GLY  72           HAS      GLY  72  -8.655  -2.500  -2.500
  588    H    SER  73           HN       SER  73  -6.681  -3.080  -3.080
  589    HA   SER  73           HA       SER  73  -6.447  -3.125  -3.125
  590   1HB   SER  73           HBR      SER  73  -5.573  -0.860  -0.860
  591   2HB   SER  73           HBS      SER  73  -7.332  -0.936  -0.936
  592    HG   SER  73           HG       SER  73  -6.615   0.889   0.889
  593    H    GLU  74           HN       GLU  74  -4.195  -2.679  -2.679
  594    HA   GLU  74           HA       GLU  74  -2.041  -3.211  -3.211
  595   1HB   GLU  74           HBS      GLU  74  -1.981  -3.745  -3.745
  596   2HB   GLU  74           HBR      GLU  74  -2.369  -2.206  -2.206
  597   1HG   GLU  74           HGR      GLU  74   0.218  -2.745  -2.745
  598   2HG   GLU  74           HGS      GLU  74  -0.095  -3.232  -3.232
  599    H    GLU  75           HN       GLU  75  -3.959  -0.491  -0.491
  600    HA   GLU  75           HA       GLU  75  -2.151   1.492   1.492
  601   1HB   GLU  75           HBR      GLU  75  -4.916   1.383   1.383
  602   2HB   GLU  75           HBS      GLU  75  -4.455   2.724   2.724
  603   1HG   GLU  75           HGR      GLU  75  -2.442   2.861   2.861
  604   2HG   GLU  75           HGS      GLU  75  -3.612   1.919   1.919
  605    H    LEU  76           HN       LEU  76  -4.572  -0.592  -0.592
  606    HA   LEU  76           HA       LEU  76  -4.747   0.875   0.875
  607   1HB   LEU  76           HBS      LEU  76  -6.333  -0.990  -0.990
  608   2HB   LEU  76           HBR      LEU  76  -5.437  -1.987  -1.987
  609    HG   LEU  76           HG       LEU  76  -7.370   0.274   0.274
  610   1HD1  LEU  76           HMD      LEU  76  -7.366  -2.648  -2.648
  611   2HD1  LEU  76           HMD      LEU  76  -7.875  -1.880  -1.880
  612   3HD1  LEU  76           HMD      LEU  76  -8.725  -1.495  -1.495
  613   1HD2  LEU  76           HMD      LEU  76  -5.090   0.127   0.127
  614   2HD2  LEU  76           HMD      LEU  76  -6.656   0.506   0.506
  615   3HD2  LEU  76           HMD      LEU  76  -6.004  -1.150  -1.150
  616    H    ARG  77           HN       ARG  77  -2.768  -1.374  -1.374
  617    HA   ARG  77           HA       ARG  77  -1.392  -2.560  -2.560
  618   1HB   ARG  77           HBR      ARG  77  -1.379  -2.898  -2.898
  619   2HB   ARG  77           HBS      ARG  77   0.261  -2.368  -2.368
  620   1HG   ARG  77           HGS      ARG  77   0.304  -4.211  -4.211
  621   2HG   ARG  77           HGR      ARG  77  -1.261  -4.780  -4.780
  622   1HD   ARG  77           HDS      ARG  77   0.161  -6.079  -6.079
  623   2HD   ARG  77           HDR      ARG  77   0.038  -4.669  -4.669
  624    HE   ARG  77           HE       ARG  77   2.221  -4.466  -4.466
  625   1HH1  ARG  77           HH1      ARG  77   1.284  -6.075  -6.075
  626   2HH1  ARG  77           HH1      ARG  77   2.884  -6.021  -6.021
  627   1HH2  ARG  77           HH2      ARG  77   4.275  -4.304  -4.304
  628   2HH2  ARG  77           HH2      ARG  77   4.579  -5.020  -5.020
  629    H    SER  78           HN       SER  78  -1.127   0.325   0.325
  630    HA   SER  78           HA       SER  78   1.177   1.427   1.427
  631   1HB   SER  78           HBR      SER  78  -0.624   2.226   2.226
  632   2HB   SER  78           HBS      SER  78  -0.657   3.479   3.479
  633    HG   SER  78           HG       SER  78   1.788   2.261   2.261
  634    H    LEU  79           HN       LEU  79  -2.338   1.976   1.976
  635    HA   LEU  79           HA       LEU  79  -2.117   3.591   3.591
  636   1HB   LEU  79           HBS      LEU  79  -4.133   2.245   2.245
  637   2HB   LEU  79           HBR      LEU  79  -4.522   2.115   2.115
  638    HG   LEU  79           HG       LEU  79  -4.680   4.456   4.456
  639   1HD1  LEU  79           HMD      LEU  79  -2.702   4.690   4.690
  640   2HD1  LEU  79           HMD      LEU  79  -4.106   5.102   5.102
  641   3HD1  LEU  79           HMD      LEU  79  -3.776   6.033   6.033
  642   1HD2  LEU  79           HMD      LEU  79  -6.515   3.184   3.184
  643   2HD2  LEU  79           HMD      LEU  79  -6.491   4.939   4.939
  644   3HD2  LEU  79           HMD      LEU  79  -5.871   3.807   3.807
  645    H    TYR  80           HN       TYR  80  -1.769   0.160   0.160
  646    HA   TYR  80           HA       TYR  80  -2.159  -0.428  -0.428
  647   1HB   TYR  80           HBS      TYR  80  -2.695  -2.075  -2.075
  648   2HB   TYR  80           HBR      TYR  80  -1.005  -2.081  -2.081
  649    HD1  TYR  80           HD1      TYR  80  -3.172  -2.992  -2.992
  650    HD2  TYR  80           HD2      TYR  80   0.593  -3.494  -3.494
  651    HE1  TYR  80           HE1      TYR  80  -2.586  -4.740  -4.740
  652    HE2  TYR  80           HE2      TYR  80   1.187  -5.247  -5.247
  653    HH   TYR  80           HH       TYR  80  -0.530  -6.967  -6.967
  654    H    ASN  81           HN       ASN  81   0.604   0.191   0.191
  655    HA   ASN  81           HA       ASN  81   2.552  -0.702  -0.702
  656   1HB   ASN  81           HBS      ASN  81   4.234  -0.073  -0.073
  657   2HB   ASN  81           HBR      ASN  81   2.926  -0.751  -0.751
  658   1HD2  ASN  81           HD2      ASN  81   3.894   1.966   1.966
  659   2HD2  ASN  81           HD2      ASN  81   4.499   0.422   0.422
  660    H    THR  82           HN       THR  82   1.044   2.352   2.352
  661    HA   THR  82           HA       THR  82   2.604   3.894   3.894
  662    HB   THR  82           HB       THR  82   0.078   5.213   5.213
  663    HG1  THR  82           HG1      THR  82   1.312   3.970   3.970
  664   1HG2  THR  82           HMG      THR  82   2.811   5.780   5.780
  665   2HG2  THR  82           HMG      THR  82   2.068   6.111   6.111
  666   3HG2  THR  82           HMG      THR  82   1.420   6.889   6.889
  667    H    ILE  83           HN       ILE  83  -0.429   2.138   2.138
  668    HA   ILE  83           HA       ILE  83  -1.034   3.217   3.217
  669    HB   ILE  83           HB       ILE  83  -2.125   1.030   1.030
  670   1HG1  ILE  83           HG1      ILE  83  -2.745   3.297   3.297
  671   2HG1  ILE  83           HG1      ILE  83  -4.163   2.418   2.418
  672   1HG2  ILE  83           HMG      ILE  83  -2.240   0.597   0.597
  673   2HG2  ILE  83           HMG      ILE  83  -3.810   1.313   1.313
  674   3HG2  ILE  83           HMG      ILE  83  -3.236  -0.158  -0.158
  675   1HD1  ILE  83           HMD      ILE  83  -2.701   3.574   3.574
  676   2HD1  ILE  83           HMD      ILE  83  -2.994   4.838   4.838
  677   3HD1  ILE  83           HMD      ILE  83  -4.365   3.929   3.929
  678    H    ALA  84           HN       ALA  84   0.387   0.087   0.087
  679    HA   ALA  84           HA       ALA  84   0.832  -0.901  -0.901
  680   1HB   ALA  84           HMB      ALA  84   1.505  -1.669  -1.669
  681   2HB   ALA  84           HMB      ALA  84   2.963  -1.782  -1.782
  682   3HB   ALA  84           HMB      ALA  84   1.478  -2.646  -2.646
  683    H    VAL  85           HN       VAL  85   2.736   1.265   1.265
  684    HA   VAL  85           HA       VAL  85   4.974   1.474   1.474
  685    HB   VAL  85           HB       VAL  85   3.954   3.216   3.216
  686   1HG1  VAL  85           HMG      VAL  85   5.201   4.517   4.517
  687   2HG1  VAL  85           HMG      VAL  85   6.643   3.623   3.623
  688   3HG1  VAL  85           HMG      VAL  85   5.767   4.671   4.671
  689   1HG2  VAL  85           HMG      VAL  85   4.936   0.974   0.974
  690   2HG2  VAL  85           HMG      VAL  85   5.772   2.358   2.358
  691   3HG2  VAL  85           HMG      VAL  85   6.472   1.562   1.562
  692    H    LEU  86           HN       LEU  86   2.146   3.605   3.605
  693    HA   LEU  86           HA       LEU  86   2.846   5.400   5.400
  694   1HB   LEU  86           HBS      LEU  86   1.197   5.531   5.531
  695   2HB   LEU  86           HBR      LEU  86  -0.009   5.007   5.007
  696    HG   LEU  86           HG       LEU  86   0.162   6.976   6.976
  697   1HD1  LEU  86           HMD      LEU  86   2.836   7.185   7.185
  698   2HD1  LEU  86           HMD      LEU  86   1.952   8.719   8.719
  699   3HD1  LEU  86           HMD      LEU  86   2.279   7.694   7.694
  700   1HD2  LEU  86           HMD      LEU  86   0.222   7.279   7.279
  701   2HD2  LEU  86           HMD      LEU  86  -1.119   7.519   7.519
  702   3HD2  LEU  86           HMD      LEU  86   0.168   8.745   8.745
  703    H    TYR  87           HN       TYR  87   1.048   2.387   2.387
  704    HA   TYR  87           HA       TYR  87   0.558   2.446   2.446
  705   1HB   TYR  87           HBS      TYR  87  -0.305   0.723   0.723
  706   2HB   TYR  87           HBR      TYR  87   1.282  -0.089  -0.089
  707    HD1  TYR  87           HD1      TYR  87   2.005  -0.201  -0.201
  708    HD2  TYR  87           HD2      TYR  87  -1.996   0.078   0.078
  709    HE1  TYR  87           HE1      TYR  87   1.187  -0.958  -0.958
  710    HE2  TYR  87           HE2      TYR  87  -2.826  -0.415  -0.415
  711    HH   TYR  87           HH       TYR  87  -1.726  -0.270  -0.270
  712    H    CYS  88           HN       CYS  88   3.414   1.450   1.450
  713    HA   CYS  88           HA       CYS  88   5.014   0.536   0.536
  714   1HB   CYS  88           HBS      CYS  88   5.246   0.857   0.857
  715   2HB   CYS  88           HBR      CYS  88   6.503   1.916   1.916
  716    H    VAL  89           HN       VAL  89   4.291   3.731   3.731
  717    HA   VAL  89           HA       VAL  89   6.444   4.964   4.964
  718    HB   VAL  89           HB       VAL  89   4.280   6.302   6.302
  719   1HG1  VAL  89           HMG      VAL  89   6.962   7.172   7.172
  720   2HG1  VAL  89           HMG      VAL  89   6.289   7.893   7.893
  721   3HG1  VAL  89           HMG      VAL  89   5.393   8.009   8.009
  722   1HG2  VAL  89           HMG      VAL  89   6.284   4.480   4.480
  723   2HG2  VAL  89           HMG      VAL  89   5.048   5.370   5.370
  724   3HG2  VAL  89           HMG      VAL  89   6.638   6.112   6.112
  725    H    HIS  90           HN       HIS  90   2.921   4.691   4.691
  726    HA   HIS  90           HA       HIS  90   2.504   6.725   6.725
  727   1HB   HIS  90           HBS      HIS  90   0.811   4.327   4.327
  728   2HB   HIS  90           HBR      HIS  90   0.337   5.470   5.470
  729    HD1  HIS  90           HD1      HIS  90   1.406   8.077   8.077
  730    HD2  HIS  90           HD2      HIS  90  -0.978   5.046   5.046
  731    HE1  HIS  90           HE1      HIS  90   0.230   9.056   9.056
  732    HE2  HIS  90           HE2      HIS  90  -1.346   7.279   7.279
  733    H    GLN  91           HN       GLN  91   3.275   3.285   3.285
  734    HA   GLN  91           HA       GLN  91   3.011   2.900   2.900
  735   1HB   GLN  91           HBR      GLN  91   3.968   1.381   1.381
  736   2HB   GLN  91           HBS      GLN  91   5.160   1.328   1.328
  737   1HG   GLN  91           HGS      GLN  91   3.496  -0.527  -0.527
  738   2HG   GLN  91           HGR      GLN  91   3.545   0.460   0.460
  739   1HE2  GLN  91           HE2      GLN  91   0.037   0.078   0.078
  740   2HE2  GLN  91           HE2      GLN  91   1.458  -0.673  -0.673
  741    H    ARG  92           HN       ARG  92   5.820   3.758   3.758
  742    HA   ARG  92           HA       ARG  92   7.535   4.958   4.958
  743   1HB   ARG  92           HBR      ARG  92   7.190   3.188   3.188
  744   2HB   ARG  92           HBS      ARG  92   7.684   1.960   1.960
  745   1HG   ARG  92           HGR      ARG  92   9.534   2.318   2.318
  746   2HG   ARG  92           HGS      ARG  92   9.921   3.127   3.127
  747   1HD   ARG  92           HDR      ARG  92  10.456   4.390   4.390
  748   2HD   ARG  92           HDS      ARG  92   9.504   5.251   5.251
  749    HE   ARG  92           HE       ARG  92   8.139   3.935   3.935
  750   1HH1  ARG  92           HH1      ARG  92   9.183   6.909   6.909
  751   2HH1  ARG  92           HH1      ARG  92   7.961   7.871   7.871
  752   1HH2  ARG  92           HH2      ARG  92   6.475   5.200   5.200
  753   2HH2  ARG  92           HH2      ARG  92   6.435   6.907   6.907
  754    H    ILE  93           HN       ILE  93   7.182   2.115   2.115
  755    HA   ILE  93           HA       ILE  93   9.984   1.777   1.777
  756    HB   ILE  93           HB       ILE  93   7.609   0.740   0.740
  757   1HG1  ILE  93           HG1      ILE  93   8.453  -1.318  -1.318
  758   2HG1  ILE  93           HG1      ILE  93   8.538   0.132   0.132
  759   1HG2  ILE  93           HMG      ILE  93  10.512  -0.010  -0.010
  760   2HG2  ILE  93           HMG      ILE  93   9.277  -1.230  -1.230
  761   3HG2  ILE  93           HMG      ILE  93   9.446   0.236   0.236
  762   1HD1  ILE  93           HMD      ILE  93   6.097  -0.667  -0.667
  763   2HD1  ILE  93           HMD      ILE  93   6.363  -1.100  -1.100
  764   3HD1  ILE  93           HMD      ILE  93   6.216   0.613   0.613
  765    H    ASP  94           HN       ASP  94  11.254   2.441   2.441
  766    HA   ASP  94           HA       ASP  94  10.016   4.160   4.160
  767   1HB   ASP  94           HBS      ASP  94  12.260   5.142   5.142
  768   2HB   ASP  94           HBR      ASP  94  11.457   5.603   5.603
  769    H    VAL  95           HN       VAL  95  10.626   3.846   3.846
  770    HA   VAL  95           HA       VAL  95  12.197   1.382   1.382
  771    HB   VAL  95           HB       VAL  95  10.531   0.422   0.422
  772   1HG1  VAL  95           HMG      VAL  95   9.213   1.974   1.974
  773   2HG1  VAL  95           HMG      VAL  95   8.360   0.733   0.733
  774   3HG1  VAL  95           HMG      VAL  95   9.807   0.295   0.295
  775   1HG2  VAL  95           HMG      VAL  95   9.605   3.152   3.152
  776   2HG2  VAL  95           HMG      VAL  95   9.673   1.670   1.670
  777   3HG2  VAL  95           HMG      VAL  95   8.339   1.912   1.912
  778    H    LYS  96           HN       LYS  96  12.214   1.208   1.208
  779    HA   LYS  96           HA       LYS  96  13.660   3.677   3.677
  780   1HB   LYS  96           HBR      LYS  96  15.171   1.913   1.913
  781   2HB   LYS  96           HBS      LYS  96  15.604   2.555   2.555
  782   1HG   LYS  96           HGS      LYS  96  14.486   0.492   0.492
  783   2HG   LYS  96           HGR      LYS  96  14.412  -0.155  -0.155
  784   1HD   LYS  96           HDS      LYS  96  16.691  -0.423  -0.423
  785   2HD   LYS  96           HDR      LYS  96  17.011   0.880   0.880
  786   1HE   LYS  96           HES      LYS  96  17.639  -1.040  -1.040
  787   2HE   LYS  96           HER      LYS  96  16.049  -0.573  -0.573
  788   1HZ   LYS  96           HZA      LYS  96  15.132  -2.192  -2.192
  789   2HZ   LYS  96           HZB      LYS  96  16.653  -2.748  -2.748
  790   3HZ   LYS  96           HZC      LYS  96  15.947  -2.843  -2.843
  791    H    ASP  97           HN       ASP  97  12.831   0.406   0.406
  792    HA   ASP  97           HA       ASP  97  11.227   1.768   1.768
  793   1HB   ASP  97           HBS      ASP  97  11.756   0.095   0.095
  794   2HB   ASP  97           HBR      ASP  97  13.267   0.407   0.407
  795    H    THR  98           HN       THR  98   9.442   0.357   0.357
  796    HA   THR  98           HA       THR  98   7.447  -0.171  -0.171
  797    HB   THR  98           HB       THR  98   7.833  -1.359  -1.359
  798    HG1  THR  98           HG1      THR  98   6.357   0.637   0.637
  799   1HG2  THR  98           HMG      THR  98   5.466  -1.478  -1.478
  800   2HG2  THR  98           HMG      THR  98   5.250  -1.455  -1.455
  801   3HG2  THR  98           HMG      THR  98   6.197  -2.757  -2.757
  802    H    LYS  99           HN       LYS  99   9.774  -2.454  -2.454
  803    HA   LYS  99           HA       LYS  99   8.507  -4.804  -4.804
  804   1HB   LYS  99           HBR      LYS  99  11.027  -4.094  -4.094
  805   2HB   LYS  99           HBS      LYS  99  11.259  -5.368  -5.368
  806   1HG   LYS  99           HGR      LYS  99   9.204  -6.497  -6.497
  807   2HG   LYS  99           HGS      LYS  99   9.641  -5.428  -5.428
  808   1HD   LYS  99           HDS      LYS  99  10.779  -7.341  -7.341
  809   2HD   LYS  99           HDR      LYS  99  11.984  -6.324  -6.324
  810   1HE   LYS  99           HES      LYS  99  12.221  -8.588  -8.588
  811   2HE   LYS  99           HER      LYS  99  11.742  -7.490  -7.490
  812   1HZ   LYS  99           HZB      LYS  99   9.401  -8.353  -8.353
  813   2HZ   LYS  99           HZC      LYS  99  10.321  -9.687  -9.687
  814   3HZ   LYS  99           HZA      LYS  99  10.185  -9.008  -9.008
  815    H    GLU 100           HN       GLU 100  10.920  -2.718  -2.718
  816    HA   GLU 100           HA       GLU 100  11.402  -4.492  -4.492
  817   1HB   GLU 100           HBR      GLU 100  13.047  -3.102  -3.102
  818   2HB   GLU 100           HBS      GLU 100  12.621  -2.542  -2.542
  819   1HG   GLU 100           HGR      GLU 100  12.804  -0.542  -0.542
  820   2HG   GLU 100           HGS      GLU 100  11.158  -0.889  -0.889
  821    H    ALA 101           HN       ALA 101   9.353  -1.587  -1.587
  822    HA   ALA 101           HA       ALA 101   8.277  -1.615  -1.615
  823   1HB   ALA 101           HMB      ALA 101   8.066   0.103   0.103
  824   2HB   ALA 101           HMB      ALA 101   6.530  -0.780  -0.780
  825   3HB   ALA 101           HMB      ALA 101   6.906   0.025   0.025
  826    H    LEU 102           HN       LEU 102   7.050  -2.925  -2.925
  827    HA   LEU 102           HA       LEU 102   4.749  -4.104  -4.104
  828   1HB   LEU 102           HBR      LEU 102   5.820  -3.668  -3.668
  829   2HB   LEU 102           HBS      LEU 102   5.948  -5.445  -5.445
  830    HG   LEU 102           HG       LEU 102   3.592  -5.675  -5.675
  831   1HD1  LEU 102           HMD      LEU 102   3.665  -2.683  -2.683
  832   2HD1  LEU 102           HMD      LEU 102   2.196  -3.496  -3.496
  833   3HD1  LEU 102           HMD      LEU 102   2.859  -3.915  -3.915
  834   1HD2  LEU 102           HMD      LEU 102   4.894  -4.622  -4.622
  835   2HD2  LEU 102           HMD      LEU 102   3.310  -5.438  -5.438
  836   3HD2  LEU 102           HMD      LEU 102   3.400  -3.661  -3.661
  837    H    ASP 103           HN       ASP 103   8.038  -5.068  -5.068
  838    HA   ASP 103           HA       ASP 103   7.399  -7.818  -7.818
  839   1HB   ASP 103           HBR      ASP 103   9.585  -6.835  -6.835
  840   2HB   ASP 103           HBS      ASP 103  10.048  -6.622  -6.622
  841    H    LYS 104           HN       LYS 104   8.282  -4.821  -4.821
  842    HA   LYS 104           HA       LYS 104   8.243  -6.016  -6.016
  843   1HB   LYS 104           HBS      LYS 104   9.290  -3.724  -3.724
  844   2HB   LYS 104           HBR      LYS 104   7.713  -3.108  -3.108
  845   1HG   LYS 104           HGS      LYS 104   8.388  -3.146  -3.146
  846   2HG   LYS 104           HGR      LYS 104   8.906  -4.850  -4.850
  847   1HD   LYS 104           HDR      LYS 104  10.536  -2.547  -2.547
  848   2HD   LYS 104           HDS      LYS 104  10.608  -2.997  -2.997
  849   1HE   LYS 104           HER      LYS 104  12.218  -4.404  -4.404
  850   2HE   LYS 104           HES      LYS 104  10.945  -5.411  -5.411
  851   1HZ   LYS 104           HZC      LYS 104  12.061  -3.205  -3.205
  852   2HZ   LYS 104           HZA      LYS 104  12.948  -4.568  -4.568
  853   3HZ   LYS 104           HZB      LYS 104  11.462  -4.632  -4.632
  854    H    ILE 105           HN       ILE 105   6.000  -4.619  -4.619
  855    HA   ILE 105           HA       ILE 105   3.825  -4.530  -4.530
  856    HB   ILE 105           HB       ILE 105   3.840  -4.181  -4.181
  857   1HG1  ILE 105           HG1      ILE 105   5.419  -2.739  -2.739
  858   2HG1  ILE 105           HG1      ILE 105   4.277  -1.889  -1.889
  859   1HG2  ILE 105           HMG      ILE 105   1.734  -3.720  -3.720
  860   2HG2  ILE 105           HMG      ILE 105   1.881  -2.560  -2.560
  861   3HG2  ILE 105           HMG      ILE 105   1.596  -4.288  -4.288
  862   1HD1  ILE 105           HMD      ILE 105   2.816  -1.747  -1.747
  863   2HD1  ILE 105           HMD      ILE 105   4.381  -2.008  -2.008
  864   3HD1  ILE 105           HMD      ILE 105   4.163  -0.609  -0.609
  865    H    GLU 106           HN       GLU 106   4.979  -6.686  -6.686
  866    HA   GLU 106           HA       GLU 106   2.961  -8.723  -8.723
  867   1HB   GLU 106           HBR      GLU 106   5.639  -8.456  -8.456
  868   2HB   GLU 106           HBS      GLU 106   5.125  -9.989  -9.989
  869   1HG   GLU 106           HGS      GLU 106   3.226  -9.912  -9.912
  870   2HG   GLU 106           HGR      GLU 106   3.638  -8.274  -8.274
  871    H    GLU 107           HN       GLU 107   5.696  -7.530  -7.530
  872    HA   GLU 107           HA       GLU 107   5.907  -9.971  -9.971
  873   1HB   GLU 107           HBR      GLU 107   7.886  -8.735  -8.735
  874   2HB   GLU 107           HBS      GLU 107   7.284  -7.331  -7.331
  875   1HG   GLU 107           HGS      GLU 107   7.501  -9.053  -9.053
  876   2HG   GLU 107           HGR      GLU 107   9.024  -9.182  -9.182
  877    H    GLU 108           HN       GLU 108   3.503  -8.133  -8.133
  878    HA   GLU 108           HA       GLU 108   1.720  -7.994  -7.994
  879   1HB   GLU 108           HBR      GLU 108   3.110 -10.057 -10.057
  880   2HB   GLU 108           HBS      GLU 108   3.589  -8.979  -8.979
  881   1HG   GLU 108           HGS      GLU 108   0.985  -8.684  -8.684
  882   2HG   GLU 108           HGR      GLU 108   1.100 -10.418 -10.418
  883    H    GLN 109           HN       GLN 109   4.028  -6.018  -6.018
  884    HA   GLN 109           HA       GLN 109   3.514  -4.155  -4.155
  885   1HB   GLN 109           HBR      GLN 109   4.619  -3.962  -3.962
  886   2HB   GLN 109           HBS      GLN 109   3.809  -2.517  -2.517
  887   1HG   GLN 109           HGS      GLN 109   6.269  -2.561  -2.561
  888   2HG   GLN 109           HGR      GLN 109   5.314  -2.429  -2.429
  889   1HE2  GLN 109           HE2      GLN 109   6.571  -5.275  -5.275
  890   2HE2  GLN 109           HE2      GLN 109   5.502  -3.914  -3.914
  891    H    ASN 110           HN       ASN 110   1.944  -5.290  -5.290
  892    HA   ASN 110           HA       ASN 110  -0.556  -4.108  -4.108
  893   1HB   ASN 110           HBS      ASN 110  -0.338  -3.446  -3.446
  894   2HB   ASN 110           HBR      ASN 110   0.081  -5.101  -5.101
  895   1HD2  ASN 110           HD2      ASN 110  -3.733  -5.168  -5.168
  896   2HD2  ASN 110           HD2      ASN 110  -2.452  -4.555  -4.555
  897    H    LYS 111           HN       LYS 111  -0.529  -6.911  -6.911
  898    HA   LYS 111           HA       LYS 111  -1.346  -9.030  -9.030
  899   1HB   LYS 111           HBR      LYS 111   0.469  -9.285  -9.285
  900   2HB   LYS 111           HBS      LYS 111  -0.612  -8.625  -8.625
  901   1HG   LYS 111           HGR      LYS 111  -1.874 -10.835 -10.835
  902   2HG   LYS 111           HGS      LYS 111  -0.294 -11.319 -11.319
  903   1HD   LYS 111           HDS      LYS 111  -1.972  -9.748  -9.748
  904   2HD   LYS 111           HDR      LYS 111  -2.691 -11.251 -11.251
  905   1HE   LYS 111           HES      LYS 111  -0.171 -12.092 -12.092
  906   2HE   LYS 111           HER      LYS 111  -0.393 -10.770 -10.770
  907   1HZ   LYS 111           HZB      LYS 111  -2.698 -12.094 -12.094
  908   2HZ   LYS 111           HZC      LYS 111  -1.660 -13.324 -13.324
  909   3HZ   LYS 111           HZA      LYS 111  -1.428 -12.331 -12.331
  910    H    SER 112           HN       SER 112  -3.348  -9.789  -9.789
  911    HA   SER 112           HA       SER 112  -4.909  -9.227  -9.227
  912   1HB   SER 112           HBS      SER 112  -6.888  -8.720  -8.720
  913   2HB   SER 112           HBR      SER 112  -6.106  -7.525  -7.525
  914    HG   SER 112           HG       SER 112  -5.348  -8.358  -8.358
  915    H    LYS 113           HN       LYS 113  -3.610 -11.392 -11.392
  916    HA   LYS 113           HA       LYS 113  -3.985 -13.525 -13.525
  917   1HB   LYS 113           HBR      LYS 113  -6.204 -13.048 -13.048
  918   2HB   LYS 113           HBS      LYS 113  -6.699 -14.064 -14.064
  919   1HG   LYS 113           HGR      LYS 113  -4.462 -14.598 -14.598
  920   2HG   LYS 113           HGS      LYS 113  -5.979 -15.519 -15.519
  921   1HD   LYS 113           HDS      LYS 113  -5.230 -16.665 -16.665
  922   2HD   LYS 113           HDR      LYS 113  -4.382 -15.296 -15.296
  923   1HE   LYS 113           HES      LYS 113  -2.563 -15.599 -15.599
  924   2HE   LYS 113           HER      LYS 113  -3.420 -17.029 -17.029
  925   1HZ   LYS 113           HZC      LYS 113  -2.821 -16.882 -16.882
  926   2HZ   LYS 113           HZA      LYS 113  -1.625 -17.285 -17.285
  927   3HZ   LYS 113           HZB      LYS 113  -2.980 -18.193 -18.193
  928    H    LYS 114           HN       LYS 114  -5.578 -14.790 -14.790
  929    HA   LYS 114           HA       LYS 114  -6.670 -12.905 -12.905
  930   1HB   LYS 114           HBR      LYS 114  -6.190 -14.533 -14.533
  931   2HB   LYS 114           HBS      LYS 114  -4.689 -14.050 -14.050
  932   1HG   LYS 114           HGR      LYS 114  -4.606 -16.135 -16.135
  933   2HG   LYS 114           HGS      LYS 114  -6.228 -16.599 -16.599
  934   1HD   LYS 114           HDS      LYS 114  -4.729 -16.088 -16.088
  935   2HD   LYS 114           HDR      LYS 114  -3.628 -16.909 -16.909
  936   1HE   LYS 114           HES      LYS 114  -5.231 -18.734 -18.734
  937   2HE   LYS 114           HER      LYS 114  -6.352 -17.900 -17.900
  938   1HZ   LYS 114           HZB      LYS 114  -3.807 -18.176 -18.176
  939   2HZ   LYS 114           HZC      LYS 114  -4.353 -19.637 -19.637
  940   3HZ   LYS 114           HZA      LYS 114  -5.246 -18.728 -18.728
  941    H    LYS 115           HN       LYS 115  -8.764 -13.075 -13.075
  942    HA   LYS 115           HA       LYS 115 -10.203 -15.507 -15.507
  943   1HB   LYS 115           HBR      LYS 115  -9.741 -14.873 -14.873
  944   2HB   LYS 115           HBS      LYS 115 -11.238 -13.943 -13.943
  945   1HG   LYS 115           HGR      LYS 115 -12.513 -15.795 -15.795
  946   2HG   LYS 115           HGS      LYS 115 -11.373 -16.684 -16.684
  947   1HD   LYS 115           HDS      LYS 115 -10.963 -17.957 -17.957
  948   2HD   LYS 115           HDR      LYS 115  -9.972 -16.629 -16.629
  949   1HE   LYS 115           HES      LYS 115 -11.419 -17.427 -17.427
  950   2HE   LYS 115           HER      LYS 115 -11.762 -15.731 -15.731
  951   1HZ   LYS 115           HZB      LYS 115 -13.286 -17.861 -17.861
  952   2HZ   LYS 115           HZC      LYS 115 -13.664 -17.427 -17.427
  953   3HZ   LYS 115           HZA      LYS 115 -13.726 -16.323 -16.323
  954    H    ALA 116           HN       ALA 116 -12.642 -15.027 -15.027
  955    HA   ALA 116           HA       ALA 116 -13.067 -12.489 -12.489
  956   1HB   ALA 116           HMB      ALA 116 -13.314 -15.271 -15.271
  957   2HB   ALA 116           HMB      ALA 116 -14.866 -14.413 -14.413
  958   3HB   ALA 116           HMB      ALA 116 -13.410 -13.795 -13.795
  959    H    GLN 117           HN       GLN 117 -15.090 -15.176 -15.176
  960    HA   GLN 117           HA       GLN 117 -17.102 -15.193 -15.193
  961   1HB   GLN 117           HBR      GLN 117 -17.172 -14.059 -14.059
  962   2HB   GLN 117           HBS      GLN 117 -15.484 -14.564 -14.564
  963   1HG   GLN 117           HGS      GLN 117 -14.735 -12.408 -12.408
  964   2HG   GLN 117           HGR      GLN 117 -16.331 -11.799 -11.799
  965   1HE2  GLN 117           HE2      GLN 117 -17.524 -11.040 -11.040
  966   2HE2  GLN 117           HE2      GLN 117 -17.877 -11.247 -11.247
  967    H    GLN 118           HN       GLN 118 -16.961 -13.544 -13.544
  968    HA   GLN 118           HA       GLN 118 -18.369 -12.228 -12.228
  969   1HB   GLN 118           HBR      GLN 118 -20.155 -12.647 -12.647
  970   2HB   GLN 118           HBS      GLN 118 -20.576 -11.492 -11.492
  971   1HG   GLN 118           HGS      GLN 118 -19.766 -14.218 -14.218
  972   2HG   GLN 118           HGR      GLN 118 -21.322 -14.082 -14.082
  973   1HE2  GLN 118           HE2      GLN 118 -21.035 -13.183 -13.183
  974   2HE2  GLN 118           HE2      GLN 118 -19.850 -14.049 -14.049
  975    H    ALA 119           HN       ALA 119 -19.213 -10.926 -10.926
  976    HA   ALA 119           HA       ALA 119 -18.734  -8.945  -8.945
  977   1HB   ALA 119           HMB      ALA 119 -16.214  -9.615  -9.615
  978   2HB   ALA 119           HMB      ALA 119 -16.346  -8.100  -8.100
  979   3HB   ALA 119           HMB      ALA 119 -16.556  -9.670  -9.670
  980    H    ALA 120           HN       ALA 120 -19.939  -8.999  -8.999
  981    HA   ALA 120           HA       ALA 120 -19.530  -6.140  -6.140
  982   1HB   ALA 120           HMB      ALA 120 -18.260  -8.272  -8.272
  983   2HB   ALA 120           HMB      ALA 120 -19.601  -7.754  -7.754
  984   3HB   ALA 120           HMB      ALA 120 -18.384  -6.570  -6.570
  985    H    ALA 121           HN       ALA 121 -21.326  -5.160  -5.160
  986    HA   ALA 121           HA       ALA 121 -23.657  -6.817  -6.817
  987   1HB   ALA 121           HMB      ALA 121 -23.650  -5.165  -5.165
  988   2HB   ALA 121           HMB      ALA 121 -24.077  -4.004  -4.004
  989   3HB   ALA 121           HMB      ALA 121 -25.078  -5.455  -5.455
  990    H    ASP 122           HN       ASP 122 -21.223  -5.659  -5.659
  991    HA   ASP 122           HA       ASP 122 -22.854  -4.741  -4.741
  992   1HB   ASP 122           HBS      ASP 122 -21.825  -2.727  -2.727
  993   2HB   ASP 122           HBR      ASP 122 -20.232  -3.379  -3.379
  994    H    THR 123           HN       THR 123 -22.729  -6.905  -6.905
  995    HA   THR 123           HA       THR 123 -20.592  -7.254  -7.254
  996    HB   THR 123           HB       THR 123 -19.337  -8.296  -8.296
  997    HG1  THR 123           HG1      THR 123 -19.113  -9.186  -9.186
  998   1HG2  THR 123           HMG      THR 123 -21.909  -9.679  -9.679
  999   2HG2  THR 123           HMG      THR 123 -20.345 -10.442 -10.442
 1000   3HG2  THR 123           HMG      THR 123 -20.742  -8.841  -8.841
 1001    H    GLY 124           HN       GLY 124 -23.412  -8.559  -8.559
 1002   1HA   GLY 124           HAR      GLY 124 -24.003 -10.464 -10.464
 1003   2HA   GLY 124           HAS      GLY 124 -24.920 -10.213 -10.213
 1004    H    ASN 125           HN       ASN 125 -24.121  -8.543  -8.543
 1005    HA   ASN 125           HA       ASN 125 -26.874  -8.423  -8.423
 1006   1HB   ASN 125           HBS      ASN 125 -26.821  -5.847  -5.847
 1007   2HB   ASN 125           HBR      ASN 125 -27.307  -6.583  -6.583
 1008   1HD2  ASN 125           HD2      ASN 125 -24.552  -5.375  -5.375
 1009   2HD2  ASN 125           HD2      ASN 125 -25.813  -6.561  -6.561
 1010    H    ASN 126           HN       ASN 126 -24.767  -5.850  -5.850
 1011    HA   ASN 126           HA       ASN 126 -23.160  -7.252  -7.252
 1012   1HB   ASN 126           HBS      ASN 126 -25.685  -7.347  -7.347
 1013   2HB   ASN 126           HBR      ASN 126 -24.994  -5.928  -5.928
 1014   1HD2  ASN 126           HD2      ASN 126 -22.827  -9.420  -9.420
 1015   2HD2  ASN 126           HD2      ASN 126 -23.346  -8.893  -8.893
 1016    H    SER 127           HN       SER 127 -25.068  -4.272  -4.272
 1017    HA   SER 127           HA       SER 127 -22.477  -2.846  -2.846
 1018   1HB   SER 127           HBS      SER 127 -24.983  -1.667  -1.667
 1019   2HB   SER 127           HBR      SER 127 -23.318  -1.658  -1.658
 1020    HG   SER 127           HG       SER 127 -25.476  -3.539  -3.539
 1021    H    GLN 128           HN       GLN 128 -23.310  -0.268  -0.268
 1022    HA   GLN 128           HA       GLN 128 -24.300   0.034   0.034
 1023   1HB   GLN 128           HBR      GLN 128 -22.994   2.031   2.031
 1024   2HB   GLN 128           HBS      GLN 128 -21.959   0.675   0.675
 1025   1HG   GLN 128           HGS      GLN 128 -22.272   1.538   1.538
 1026   2HG   GLN 128           HGR      GLN 128 -23.001   2.998   2.998
 1027   1HE2  GLN 128           HE2      GLN 128 -19.109   2.856   2.856
 1028   2HE2  GLN 128           HE2      GLN 128 -20.307   1.911   1.911
 1029    H    VAL 129           HN       VAL 129 -24.634   2.784   2.784
 1030    HA   VAL 129           HA       VAL 129 -27.358   2.804   2.804
 1031    HB   VAL 129           HB       VAL 129 -25.579   5.207   5.207
 1032   1HG1  VAL 129           HMG      VAL 129 -28.539   4.804   4.804
 1033   2HG1  VAL 129           HMG      VAL 129 -27.584   6.224   6.224
 1034   3HG1  VAL 129           HMG      VAL 129 -27.802   5.851   5.851
 1035   1HG2  VAL 129           HMG      VAL 129 -25.175   3.533   3.533
 1036   2HG2  VAL 129           HMG      VAL 129 -26.059   4.926   4.926
 1037   3HG2  VAL 129           HMG      VAL 129 -26.922   3.409   3.409
 1038    H    SER 130           HN       SER 130 -28.502   3.148   3.148
 1039    HA   SER 130           HA       SER 130 -27.587   5.002   5.002
 1040   1HB   SER 130           HBS      SER 130 -28.445   2.322   2.322
 1041   2HB   SER 130           HBR      SER 130 -27.312   3.504   3.504
 1042    HG   SER 130           HG       SER 130 -25.741   2.448   2.448
 1043    H    GLN 131           HN       GLN 131 -30.016   2.521   2.521
 1044    HA   GLN 131           HA       GLN 131 -31.995   3.872   3.872
 1045   1HB   GLN 131           HBR      GLN 131 -31.992   1.294   1.294
 1046   2HB   GLN 131           HBS      GLN 131 -33.487   1.981   1.981
 1047   1HG   GLN 131           HGS      GLN 131 -31.863   2.106   2.106
 1048   2HG   GLN 131           HGR      GLN 131 -31.160   0.693   0.693
 1049   1HE2  GLN 131           HE2      GLN 131 -33.998  -1.391  -1.391
 1050   2HE2  GLN 131           HE2      GLN 131 -32.702  -0.995  -0.995
 1051    H    ASN 132           HN       ASN 132 -32.048   2.711   2.711
 1052    HA   ASN 132           HA       ASN 132 -33.144   3.456   3.456
 1053   1HB   ASN 132           HBS      ASN 132 -33.193   6.066   6.066
 1054   2HB   ASN 132           HBR      ASN 132 -33.909   5.836   5.836
 1055   1HD2  ASN 132           HD2      ASN 132 -29.874   6.231   6.231
 1056   2HD2  ASN 132           HD2      ASN 132 -30.972   6.162   6.162
 1057    H    TYR 133           HN       TYR 133 -34.425   1.759   1.759
 1058    HA   TYR 133           HA       TYR 133 -36.808   2.418   2.418
 1059   1HB   TYR 133           HBS      TYR 133 -37.531   0.169   0.169
 1060   2HB   TYR 133           HBR      TYR 133 -35.768   0.153   0.153
 1061    HD1  TYR 133           HD2      TYR 133 -34.680   0.805   0.805
 1062    HD2  TYR 133           HD1      TYR 133 -38.020  -1.655  -1.655
 1063    HE1  TYR 133           HE2      TYR 133 -34.304  -0.476  -0.476
 1064    HE2  TYR 133           HE1      TYR 133 -37.675  -2.924  -2.924
 1065    HH   TYR 133           HH       TYR 133 -36.649  -2.644  -2.644

  Start of MODEL    5
    1   1H    HIS   1           HNC      HIS   1   4.705  22.785  22.785
    2   2H    HIS   1           HNB      HIS   1   6.122  23.540  23.540
    3   3H    HIS   1           HN       HIS   1   4.884  24.362  24.362
    4    HA   HIS   1           HA       HIS   1   5.173  23.574  23.574
    5   1HB   HIS   1           HBS      HIS   1   7.910  23.217  23.217
    6   2HB   HIS   1           HBR      HIS   1   7.618  23.093  23.093
    7    HD1  HIS   1           HD1      HIS   1   5.369  25.670  25.670
    8    HD2  HIS   1           HD2      HIS   1   9.523  25.465  25.465
    9    HE1  HIS   1           HE1      HIS   1   6.193  28.038  28.038
   10    HE2  HIS   1           HE2      HIS   1   8.707  27.919  27.919
   11    H    MET   2           HN       MET   2   5.681  21.816  21.816
   12    HA   MET   2           HA       MET   2   4.888  19.798  19.798
   13   1HB   MET   2           HBR      MET   2   6.148  17.921  17.921
   14   2HB   MET   2           HBS      MET   2   7.224  19.318  19.318
   15   1HG   MET   2           HGR      MET   2   6.153  18.793  18.793
   16   2HG   MET   2           HGS      MET   2   7.221  17.526  17.526
   17   1HE   MET   2           HME      MET   2   8.041  18.730  18.730
   18   2HE   MET   2           HME      MET   2   9.338  17.857  17.857
   19   3HE   MET   2           HME      MET   2   9.658  19.463  19.463
   20    H    GLY   3           HN       GLY   3   3.416  21.093  21.093
   21   1HA   GLY   3           HAS      GLY   3   1.878  18.670  18.670
   22   2HA   GLY   3           HAR      GLY   3   2.254  19.874  19.874
   23    H    ALA   4           HN       ALA   4   1.162  21.783  21.783
   24    HA   ALA   4           HA       ALA   4  -0.654  23.160  23.160
   25   1HB   ALA   4           HMB      ALA   4   0.323  22.983  22.983
   26   2HB   ALA   4           HMB      ALA   4  -1.371  22.463  22.463
   27   3HB   ALA   4           HMB      ALA   4  -1.001  24.043  24.043
   28    H    ARG   5           HN       ARG   5  -1.626  21.661  21.661
   29    HA   ARG   5           HA       ARG   5  -3.235  20.210  20.210
   30   1HB   ARG   5           HBR      ARG   5  -4.316  20.915  20.915
   31   2HB   ARG   5           HBS      ARG   5  -4.931  19.433  19.433
   32   1HG   ARG   5           HGS      ARG   5  -5.038  21.340  21.340
   33   2HG   ARG   5           HGR      ARG   5  -5.513  22.246  22.246
   34   1HD   ARG   5           HDS      ARG   5  -7.180  20.544  20.544
   35   2HD   ARG   5           HDR      ARG   5  -6.708  19.644  19.644
   36    HE   ARG   5           HE       ARG   5  -7.910  21.152  21.152
   37   1HH1  ARG   5           HH1      ARG   5  -7.757  22.283  22.283
   38   2HH1  ARG   5           HH1      ARG   5  -8.753  23.666  23.666
   39   1HH2  ARG   5           HH2      ARG   5  -9.102  23.040  23.040
   40   2HH2  ARG   5           HH2      ARG   5  -9.515  24.094  24.094
   41    H    ALA   6           HN       ALA   6  -3.178  19.103  19.103
   42    HA   ALA   6           HA       ALA   6  -0.984  17.395  17.395
   43   1HB   ALA   6           HMB      ALA   6  -2.845  16.288  16.288
   44   2HB   ALA   6           HMB      ALA   6  -3.373  15.618  15.618
   45   3HB   ALA   6           HMB      ALA   6  -1.712  15.328  15.328
   46    H    SER   7           HN       SER   7  -0.553  16.331  16.331
   47    HA   SER   7           HA       SER   7  -2.533  16.741  16.741
   48   1HB   SER   7           HBS      SER   7  -0.417  17.941  17.941
   49   2HB   SER   7           HBR      SER   7   0.465  16.391  16.391
   50    HG   SER   7           HG       SER   7  -0.380  17.518  17.518
   51    H    VAL   8           HN       VAL   8  -1.335  14.940  14.940
   52    HA   VAL   8           HA       VAL   8  -2.288  12.377  12.377
   53    HB   VAL   8           HB       VAL   8  -0.609  13.186  13.186
   54   1HG1  VAL   8           HMG      VAL   8  -0.704  10.659  10.659
   55   2HG1  VAL   8           HMG      VAL   8  -2.168  10.667  10.667
   56   3HG1  VAL   8           HMG      VAL   8  -0.590  11.078  11.078
   57   1HG2  VAL   8           HMG      VAL   8  -3.553  12.974  12.974
   58   2HG2  VAL   8           HMG      VAL   8  -2.617  14.198  14.198
   59   3HG2  VAL   8           HMG      VAL   8  -2.900  12.596  12.596
   60    H    LEU   9           HN       LEU   9   0.989  13.568  13.568
   61    HA   LEU   9           HA       LEU   9   2.087  11.223  11.223
   62   1HB   LEU   9           HBR      LEU   9   2.928  13.045  13.045
   63   2HB   LEU   9           HBS      LEU   9   4.173  12.150  12.150
   64    HG   LEU   9           HG       LEU   9   1.854  10.892  10.892
   65   1HD1  LEU   9           HMD      LEU   9   4.672  11.566  11.566
   66   2HD1  LEU   9           HMD      LEU   9   3.978  10.032  10.032
   67   3HD1  LEU   9           HMD      LEU   9   3.190  11.576  11.576
   68   1HD2  LEU   9           HMD      LEU   9   4.039   9.948   9.948
   69   2HD2  LEU   9           HMD      LEU   9   2.389   9.318   9.318
   70   3HD2  LEU   9           HMD      LEU   9   3.662   8.947   8.947
   71    H    SER  10           HN       SER  10   4.664  12.112  12.112
   72    HA   SER  10           HA       SER  10   4.353  14.357  14.357
   73   1HB   SER  10           HBS      SER  10   5.740  13.391  13.391
   74   2HB   SER  10           HBR      SER  10   4.611  12.085  12.085
   75    HG   SER  10           HG       SER  10   6.969  11.633  11.633
   76    H    GLY  11           HN       GLY  11   6.637  15.204  15.204
   77   1HA   GLY  11           HAR      GLY  11   7.702  16.355  16.355
   78   2HA   GLY  11           HAS      GLY  11   8.563  16.265  16.265
   79    H    GLY  12           HN       GLY  12   9.268  13.771  13.771
   80   1HA   GLY  12           HAR      GLY  12  11.301  13.162  13.162
   81   2HA   GLY  12           HAS      GLY  12  10.720  12.078  12.078
   82    H    GLU  13           HN       GLU  13   8.061  11.750  11.750
   83    HA   GLU  13           HA       GLU  13   8.457   9.508   9.508
   84   1HB   GLU  13           HBR      GLU  13   6.050  10.978  10.978
   85   2HB   GLU  13           HBS      GLU  13   5.895   9.667   9.667
   86   1HG   GLU  13           HGS      GLU  13   6.971   8.200   8.200
   87   2HG   GLU  13           HGR      GLU  13   7.059   9.489   9.489
   88    H    LEU  14           HN       LEU  14   7.284  12.772  12.772
   89    HA   LEU  14           HA       LEU  14   6.437  12.387  12.387
   90   1HB   LEU  14           HBR      LEU  14   6.254  14.350  14.350
   91   2HB   LEU  14           HBS      LEU  14   7.674  14.928  14.928
   92    HG   LEU  14           HG       LEU  14   5.813  16.046  16.046
   93   1HD1  LEU  14           HMD      LEU  14   7.406  14.798  14.798
   94   2HD1  LEU  14           HMD      LEU  14   6.021  13.713  13.713
   95   3HD1  LEU  14           HMD      LEU  14   5.875  15.453  15.453
   96   1HD2  LEU  14           HMD      LEU  14   4.478  13.321  13.321
   97   2HD2  LEU  14           HMD      LEU  14   4.092  14.660  14.660
   98   3HD2  LEU  14           HMD      LEU  14   3.787  14.836  14.836
   99    H    ASP  15           HN       ASP  15   9.432  13.752  13.752
  100    HA   ASP  15           HA       ASP  15  10.673  13.993  13.993
  101   1HB   ASP  15           HBS      ASP  15  11.220  15.465  15.465
  102   2HB   ASP  15           HBR      ASP  15  11.902  14.104  14.104
  103    H    LYS  16           HN       LYS  16  10.299  11.338  11.338
  104    HA   LYS  16           HA       LYS  16  12.363   9.723   9.723
  105   1HB   LYS  16           HBR      LYS  16  11.261   9.528   9.528
  106   2HB   LYS  16           HBS      LYS  16  10.298   8.341   8.341
  107   1HG   LYS  16           HGS      LYS  16  13.322   8.406   8.406
  108   2HG   LYS  16           HGR      LYS  16  12.184   7.210   7.210
  109   1HD   LYS  16           HDR      LYS  16  12.636   5.983   5.983
  110   2HD   LYS  16           HDS      LYS  16  11.627   7.073   7.073
  111   1HE   LYS  16           HER      LYS  16  13.901   6.550   6.550
  112   2HE   LYS  16           HES      LYS  16  13.494   8.284   8.284
  113   1HZ   LYS  16           HZA      LYS  16  14.866   7.051   7.051
  114   2HZ   LYS  16           HZB      LYS  16  15.739   7.318   7.318
  115   3HZ   LYS  16           HZC      LYS  16  14.999   8.564   8.564
  116    H    TRP  17           HN       TRP  17   8.878  10.320  10.320
  117    HA   TRP  17           HA       TRP  17   8.101   8.320   8.320
  118   1HB   TRP  17           HBS      TRP  17   6.498   9.469   9.469
  119   2HB   TRP  17           HBR      TRP  17   6.851  11.021  11.021
  120    HD1  TRP  17           HD1      TRP  17   6.030  11.192  11.192
  121    HE1  TRP  17           HE1      TRP  17   4.262   9.912   9.912
  122    HE3  TRP  17           HE3      TRP  17   5.358   7.267   7.267
  123    HZ2  TRP  17           HZ2      TRP  17   2.706   7.600   7.600
  124    HZ3  TRP  17           HZ3      TRP  17   3.570   5.660   5.660
  125    HH2  TRP  17           HH2      TRP  17   2.348   5.749   5.749
  126    H    GLU  18           HN       GLU  18   9.910  11.175  11.175
  127    HA   GLU  18           HA       GLU  18   9.020  11.573  11.573
  128   1HB   GLU  18           HBR      GLU  18  11.051  12.759  12.759
  129   2HB   GLU  18           HBS      GLU  18  11.069  13.161  13.161
  130   1HG   GLU  18           HGR      GLU  18   8.464  13.716  13.716
  131   2HG   GLU  18           HGS      GLU  18   9.491  14.186  14.186
  132    H    LYS  19           HN       LYS  19  10.331   9.002   9.002
  133    HA   LYS  19           HA       LYS  19  11.291   8.826   8.826
  134   1HB   LYS  19           HBS      LYS  19  13.324  10.013  10.013
  135   2HB   LYS  19           HBR      LYS  19  13.640   8.788   8.788
  136   1HG   LYS  19           HGR      LYS  19  13.447   7.194   7.194
  137   2HG   LYS  19           HGS      LYS  19  14.089   8.689   8.689
  138   1HD   LYS  19           HDS      LYS  19  15.314   7.230   7.230
  139   2HD   LYS  19           HDR      LYS  19  15.807   7.065   7.065
  140   1HE   LYS  19           HES      LYS  19  17.339   8.583   8.583
  141   2HE   LYS  19           HER      LYS  19  16.085   9.634   9.634
  142   1HZ   LYS  19           HZA      LYS  19  16.214   8.946   8.946
  143   2HZ   LYS  19           HZB      LYS  19  16.828  10.319  10.319
  144   3HZ   LYS  19           HZC      LYS  19  15.221  10.035  10.035
  145    H    ILE  20           HN       ILE  20   9.640   7.247   7.247
  146    HA   ILE  20           HA       ILE  20  10.947   4.766   4.766
  147    HB   ILE  20           HB       ILE  20   8.121   5.689   5.689
  148   1HG1  ILE  20           HG1      ILE  20   8.796   3.436   3.436
  149   2HG1  ILE  20           HG1      ILE  20  10.163   4.589   4.589
  150   1HG2  ILE  20           HMG      ILE  20   8.614   2.776   2.776
  151   2HG2  ILE  20           HMG      ILE  20   7.101   3.495   3.495
  152   3HG2  ILE  20           HMG      ILE  20   7.713   3.939   3.939
  153   1HD1  ILE  20           HMD      ILE  20   7.373   5.609   5.609
  154   2HD1  ILE  20           HMD      ILE  20   8.206   4.786   4.786
  155   3HD1  ILE  20           HMD      ILE  20   8.921   6.247   6.247
  156    H    ARG  21           HN       ARG  21  12.062   3.955   3.955
  157    HA   ARG  21           HA       ARG  21  11.773   4.382   4.382
  158   1HB   ARG  21           HBR      ARG  21  13.616   3.134   3.134
  159   2HB   ARG  21           HBS      ARG  21  12.736   1.680   1.680
  160   1HG   ARG  21           HGS      ARG  21  14.157   1.791   1.791
  161   2HG   ARG  21           HGR      ARG  21  13.011   3.023   3.023
  162   1HD   ARG  21           HDS      ARG  21  15.390   3.700   3.700
  163   2HD   ARG  21           HDR      ARG  21  14.351   4.789   4.789
  164    HE   ARG  21           HE       ARG  21  15.479   4.130   4.130
  165   1HH1  ARG  21           HH1      ARG  21  16.743   2.484   2.484
  166   2HH1  ARG  21           HH1      ARG  21  18.053   1.756   1.756
  167   1HH2  ARG  21           HH2      ARG  21  17.129   3.057   3.057
  168   2HH2  ARG  21           HH2      ARG  21  18.274   2.082   2.082
  169    H    LEU  22           HN       LEU  22  10.867   3.379   3.379
  170    HA   LEU  22           HA       LEU  22   8.877   1.239   1.239
  171   1HB   LEU  22           HBS      LEU  22   7.845   2.272   2.272
  172   2HB   LEU  22           HBR      LEU  22   7.449   2.869   2.869
  173    HG   LEU  22           HG       LEU  22   9.685   4.353   4.353
  174   1HD1  LEU  22           HMD      LEU  22   7.583   3.703   3.703
  175   2HD1  LEU  22           HMD      LEU  22   8.018   5.424   5.424
  176   3HD1  LEU  22           HMD      LEU  22   9.273   4.221   4.221
  177   1HD2  LEU  22           HMD      LEU  22   6.861   4.760   4.760
  178   2HD2  LEU  22           HMD      LEU  22   8.379   5.442   5.442
  179   3HD2  LEU  22           HMD      LEU  22   7.667   6.098   6.098
  180    H    ARG  23           HN       ARG  23  11.706   2.173   2.173
  181    HA   ARG  23           HA       ARG  23  12.184  -0.561  -0.561
  182   1HB   ARG  23           HBR      ARG  23  12.698  -0.154  -0.154
  183   2HB   ARG  23           HBS      ARG  23  11.006  -0.469  -0.469
  184   1HG   ARG  23           HGS      ARG  23  10.363   1.756   1.756
  185   2HG   ARG  23           HGR      ARG  23  12.050   2.346   2.346
  186   1HD   ARG  23           HDS      ARG  23  12.512   1.414   1.414
  187   2HD   ARG  23           HDR      ARG  23  11.016   0.438   0.438
  188    HE   ARG  23           HE       ARG  23  11.265   3.061   3.061
  189   1HH1  ARG  23           HH1      ARG  23   9.053   1.013   1.013
  190   2HH1  ARG  23           HH1      ARG  23   7.687   2.035   2.035
  191   1HH2  ARG  23           HH2      ARG  23   9.484   4.440   4.440
  192   2HH2  ARG  23           HH2      ARG  23   7.930   3.975   3.975
  193    HA   PRO  24           HA       PRO  24  16.196   1.072   1.072
  194   1HB   PRO  24           HBS      PRO  24  17.413  -1.221  -1.221
  195   2HB   PRO  24           HBR      PRO  24  17.175  -0.765  -0.765
  196   1HG   PRO  24           HGS      PRO  24  15.983  -2.813  -2.813
  197   2HG   PRO  24           HGR      PRO  24  15.602  -2.265  -2.265
  198   1HD   PRO  24           HDS      PRO  24  14.208  -1.846  -1.846
  199   2HD   PRO  24           HDR      PRO  24  13.671  -1.639  -1.639
  200    H    GLY  25           HN       GLY  25  15.612  -0.649  -0.649
  201   1HA   GLY  25           HAR      GLY  25  17.815   0.525   0.525
  202   2HA   GLY  25           HAS      GLY  25  16.409  -0.335  -0.335
  203    H    GLY  26           HN       GLY  26  14.721   1.590   1.590
  204   1HA   GLY  26           HAS      GLY  26  14.157   3.314   3.314
  205   2HA   GLY  26           HAR      GLY  26  13.162   3.110   3.110
  206    H    LYS  27           HN       LYS  27  14.990   3.700   3.700
  207    HA   LYS  27           HA       LYS  27  15.699   5.498   5.498
  208   1HB   LYS  27           HBS      LYS  27  16.267   6.827   6.827
  209   2HB   LYS  27           HBR      LYS  27  16.773   7.408   7.408
  210   1HG   LYS  27           HGR      LYS  27  18.436   5.826   5.826
  211   2HG   LYS  27           HGS      LYS  27  17.600   4.651   4.651
  212   1HD   LYS  27           HDS      LYS  27  19.257   5.230   5.230
  213   2HD   LYS  27           HDR      LYS  27  18.047   6.397   6.397
  214   1HE   LYS  27           HES      LYS  27  19.232   8.154   8.154
  215   2HE   LYS  27           HER      LYS  27  19.793   7.296   7.296
  216   1HZ   LYS  27           HZC      LYS  27  20.854   6.888   6.888
  217   2HZ   LYS  27           HZA      LYS  27  21.578   7.765   7.765
  218   3HZ   LYS  27           HZB      LYS  27  21.386   6.154   6.154
  219    H    LYS  28           HN       LYS  28  12.990   5.120   5.120
  220    HA   LYS  28           HA       LYS  28  11.924   7.839   7.839
  221   1HB   LYS  28           HBR      LYS  28  10.715   5.454   5.454
  222   2HB   LYS  28           HBS      LYS  28   9.738   6.810   6.810
  223   1HG   LYS  28           HGS      LYS  28  10.267   6.990   6.990
  224   2HG   LYS  28           HGR      LYS  28  10.843   8.375   8.375
  225   1HD   LYS  28           HDS      LYS  28  13.099   7.365   7.365
  226   2HD   LYS  28           HDR      LYS  28  12.496   6.015   6.015
  227   1HE   LYS  28           HER      LYS  28  12.376   7.142   7.142
  228   2HE   LYS  28           HES      LYS  28  12.054   8.713   8.713
  229   1HZ   LYS  28           HZB      LYS  28  14.545   7.999   7.999
  230   2HZ   LYS  28           HZC      LYS  28  14.519   7.577   7.577
  231   3HZ   LYS  28           HZA      LYS  28  14.178   9.112   9.112
  232    H    GLN  29           HN       GLN  29  10.797   8.154   8.154
  233    HA   GLN  29           HA       GLN  29  10.313   5.831   5.831
  234   1HB   GLN  29           HBR      GLN  29  11.220   7.488   7.488
  235   2HB   GLN  29           HBS      GLN  29  12.307   6.415   6.415
  236   1HG   GLN  29           HGR      GLN  29  11.973   8.886   8.886
  237   2HG   GLN  29           HGS      GLN  29  12.415   9.233   9.233
  238   1HE2  GLN  29           HE2      GLN  29  15.435   8.828   8.828
  239   2HE2  GLN  29           HE2      GLN  29  13.972   9.744   9.744
  240    H    TYR  30           HN       TYR  30   8.949   6.280   6.280
  241    HA   TYR  30           HA       TYR  30   6.711   8.009   8.009
  242   1HB   TYR  30           HBS      TYR  30   7.804   6.822   6.822
  243   2HB   TYR  30           HBR      TYR  30   6.252   7.686   7.686
  244    HD1  TYR  30           HD2      TYR  30   7.291   5.390   5.390
  245    HD2  TYR  30           HD1      TYR  30   5.165   5.682   5.682
  246    HE1  TYR  30           HE2      TYR  30   6.505   3.081   3.081
  247    HE2  TYR  30           HE1      TYR  30   4.394   3.362   3.362
  248    HH   TYR  30           HH       TYR  30   5.449   1.360   1.360
  249    H    LYS  31           HN       LYS  31   6.412  10.060  10.060
  250    HA   LYS  31           HA       LYS  31   7.798  11.267  11.267
  251   1HB   LYS  31           HBR      LYS  31   6.840  12.624  12.624
  252   2HB   LYS  31           HBS      LYS  31   7.250  13.485  13.485
  253   1HG   LYS  31           HGR      LYS  31   9.529  13.006  13.006
  254   2HG   LYS  31           HGS      LYS  31   9.248  11.621  11.621
  255   1HD   LYS  31           HDS      LYS  31   8.241  13.639  13.639
  256   2HD   LYS  31           HDR      LYS  31   9.446  14.507  14.507
  257   1HE   LYS  31           HES      LYS  31   9.850  12.221  12.221
  258   2HE   LYS  31           HER      LYS  31  10.560  13.861  13.861
  259   1HZ   LYS  31           HZC      LYS  31  11.489  13.024  13.024
  260   2HZ   LYS  31           HZA      LYS  31  11.306  11.553  11.553
  261   3HZ   LYS  31           HZB      LYS  31  12.251  12.676  12.676
  262    H    LEU  32           HN       LEU  32   6.386  13.206  13.206
  263    HA   LEU  32           HA       LEU  32   3.884  12.173  12.173
  264   1HB   LEU  32           HBS      LEU  32   5.657  14.049  14.049
  265   2HB   LEU  32           HBR      LEU  32   4.464  15.098  15.098
  266    HG   LEU  32           HG       LEU  32   4.220  14.931  14.931
  267   1HD1  LEU  32           HMD      LEU  32   2.216  14.525  14.525
  268   2HD1  LEU  32           HMD      LEU  32   1.659  14.017  14.017
  269   3HD1  LEU  32           HMD      LEU  32   2.254  15.677  15.677
  270   1HD2  LEU  32           HMD      LEU  32   4.062  12.065  12.065
  271   2HD2  LEU  32           HMD      LEU  32   4.422  12.887  12.887
  272   3HD2  LEU  32           HMD      LEU  32   2.732  12.654  12.654
  273    H    LYS  33           HN       LYS  33   4.865  13.610  13.610
  274    HA   LYS  33           HA       LYS  33   2.280  14.401  14.401
  275   1HB   LYS  33           HBR      LYS  33   4.374  15.051  15.051
  276   2HB   LYS  33           HBS      LYS  33   4.647  13.348  13.348
  277   1HG   LYS  33           HGS      LYS  33   2.935  13.363  13.363
  278   2HG   LYS  33           HGR      LYS  33   2.088  14.729  14.729
  279   1HD   LYS  33           HDS      LYS  33   4.053  16.161  16.161
  280   2HD   LYS  33           HDR      LYS  33   4.648  14.786  14.786
  281   1HE   LYS  33           HES      LYS  33   1.927  15.997  15.997
  282   2HE   LYS  33           HER      LYS  33   3.409  16.437  16.437
  283   1HZ   LYS  33           HZB      LYS  33   3.568  14.016  14.016
  284   2HZ   LYS  33           HZC      LYS  33   2.045  13.843  13.843
  285   3HZ   LYS  33           HZA      LYS  33   2.334  14.803  14.803
  286    H    HIS  34           HN       DHI  34   3.948  11.316  11.316
  287    HA   HIS  34           HA       DHI  34   1.995   9.823   9.823
  288   1HB   HIS  34           HBS      DHI  34   4.258   9.016   9.016
  289   2HB   HIS  34           HBR      DHI  34   2.983   7.842   7.842
  290    HD2  HIS  34           HD2      DHI  34   3.237   6.716   6.716
  291    HE1  HIS  34           HE1      DHI  34   6.956   8.481   8.481
  292    HE2  HIS  34           HE2      DHI  34   5.290   6.721   6.721
  293    H    ILE  35           HN       ILE  35   2.627  10.483  10.483
  294    HA   ILE  35           HA       ILE  35   0.523   8.894   8.894
  295    HB   ILE  35           HB       ILE  35   2.514  10.142  10.142
  296   1HG1  ILE  35           HG1      ILE  35  -0.048   9.923   9.923
  297   2HG1  ILE  35           HG1      ILE  35   0.625   8.491   8.491
  298   1HG2  ILE  35           HMG      ILE  35   0.391  12.241  12.241
  299   2HG2  ILE  35           HMG      ILE  35   1.285  11.924  11.924
  300   3HG2  ILE  35           HMG      ILE  35   2.170  12.384  12.384
  301   1HD1  ILE  35           HMD      ILE  35   2.775   9.698   9.698
  302   2HD1  ILE  35           HMD      ILE  35   1.399   9.681   9.681
  303   3HD1  ILE  35           HMD      ILE  35   1.952   8.161   8.161
  304    H    VAL  36           HN       VAL  36   0.540  12.158  12.158
  305    HA   VAL  36           HA       VAL  36  -1.989  12.919  12.919
  306    HB   VAL  36           HB       VAL  36  -0.226  14.244  14.244
  307   1HG1  VAL  36           HMG      VAL  36  -2.828  15.209  15.209
  308   2HG1  VAL  36           HMG      VAL  36  -1.623  16.300  16.300
  309   3HG1  VAL  36           HMG      VAL  36  -2.387  15.032  15.032
  310   1HG2  VAL  36           HMG      VAL  36   0.238  14.039  14.039
  311   2HG2  VAL  36           HMG      VAL  36   0.781  15.391  15.391
  312   3HG2  VAL  36           HMG      VAL  36  -0.705  15.549  15.549
  313    H    TRP  37           HN       TRP  37  -0.677  11.757  11.757
  314    HA   TRP  37           HA       TRP  37  -3.078  11.332  11.332
  315   1HB   TRP  37           HBR      TRP  37  -0.871  11.036  11.036
  316   2HB   TRP  37           HBS      TRP  37  -0.552   9.679   9.679
  317    HD1  TRP  37           HD1      TRP  37  -2.634  10.533  10.533
  318    HE1  TRP  37           HE1      TRP  37  -3.700   8.391   8.391
  319    HE3  TRP  37           HE3      TRP  37  -1.222   7.323   7.323
  320    HZ2  TRP  37           HZ2      TRP  37  -3.981   5.718   5.718
  321    HZ3  TRP  37           HZ3      TRP  37  -1.811   4.954   4.954
  322    HH2  TRP  37           HH2      TRP  37  -3.156   4.154   4.154
  323    H    ALA  38           HN       ALA  38  -1.402   9.356   9.356
  324    HA   ALA  38           HA       ALA  38  -3.016   6.982   6.982
  325   1HB   ALA  38           HMB      ALA  38  -0.926   7.887   7.887
  326   2HB   ALA  38           HMB      ALA  38  -1.917   6.450   6.450
  327   3HB   ALA  38           HMB      ALA  38  -0.914   6.493   6.493
  328    H    SER  39           HN       SER  39  -2.555   9.007   9.007
  329    HA   SER  39           HA       SER  39  -4.782   7.996   7.996
  330   1HB   SER  39           HBS      SER  39  -3.078   9.060   9.060
  331   2HB   SER  39           HBR      SER  39  -3.260  10.589  10.589
  332    HG   SER  39           HG       SER  39  -4.159  10.748  10.748
  333    H    ARG  40           HN       ARG  40  -4.601  10.353  10.353
  334    HA   ARG  40           HA       ARG  40  -7.307  11.383  11.383
  335   1HB   ARG  40           HBS      ARG  40  -5.680  12.529  12.529
  336   2HB   ARG  40           HBR      ARG  40  -5.519  11.073  11.073
  337   1HG   ARG  40           HGS      ARG  40  -8.092  11.362  11.362
  338   2HG   ARG  40           HGR      ARG  40  -7.793  13.035  13.035
  339   1HD   ARG  40           HDR      ARG  40  -5.850  12.927  12.927
  340   2HD   ARG  40           HDS      ARG  40  -6.840  11.616  11.616
  341    HE   ARG  40           HE       ARG  40  -8.509  13.849  13.849
  342   1HH1  ARG  40           HH1      ARG  40  -5.669  13.150  13.150
  343   2HH1  ARG  40           HH1      ARG  40  -6.225  14.106  14.106
  344   1HH2  ARG  40           HH2      ARG  40  -9.261  14.984  14.984
  345   2HH2  ARG  40           HH2      ARG  40  -8.256  15.145  15.145
  346    H    GLU  41           HN       GLU  41  -5.838   9.001   9.001
  347    HA   GLU  41           HA       GLU  41  -8.301   8.275   8.275
  348   1HB   GLU  41           HBR      GLU  41  -5.641   7.868   7.868
  349   2HB   GLU  41           HBS      GLU  41  -6.054   6.385   6.385
  350   1HG   GLU  41           HGS      GLU  41  -6.450   5.601   5.601
  351   2HG   GLU  41           HGR      GLU  41  -7.900   6.629   6.629
  352    H    LEU  42           HN       LEU  42  -6.733   7.226   7.226
  353    HA   LEU  42           HA       LEU  42  -8.246   4.803   4.803
  354   1HB   LEU  42           HBR      LEU  42  -6.201   5.207   5.207
  355   2HB   LEU  42           HBS      LEU  42  -6.774   6.815   6.815
  356    HG   LEU  42           HG       LEU  42  -8.665   4.986   4.986
  357   1HD1  LEU  42           HMD      LEU  42  -5.928   3.844   3.844
  358   2HD1  LEU  42           HMD      LEU  42  -6.744   3.771   3.771
  359   3HD1  LEU  42           HMD      LEU  42  -7.508   3.036   3.036
  360   1HD2  LEU  42           HMD      LEU  42  -6.560   6.779   6.779
  361   2HD2  LEU  42           HMD      LEU  42  -8.317   6.741   6.741
  362   3HD2  LEU  42           HMD      LEU  42  -7.253   5.573   5.573
  363    H    GLU  43           HN       GLU  43  -8.407   8.061   8.061
  364    HA   GLU  43           HA       GLU  43 -10.726   7.631   7.631
  365   1HB   GLU  43           HBR      GLU  43 -10.552   9.815   9.815
  366   2HB   GLU  43           HBS      GLU  43  -8.999   9.319   9.319
  367   1HG   GLU  43           HGS      GLU  43  -9.303  11.502  11.502
  368   2HG   GLU  43           HGR      GLU  43  -8.902  10.525  10.525
  369    H    ARG  44           HN       ARG  44 -10.278   8.542   8.542
  370    HA   ARG  44           HA       ARG  44 -13.136   9.061   9.061
  371   1HB   ARG  44           HBR      ARG  44 -12.579   9.757   9.757
  372   2HB   ARG  44           HBS      ARG  44 -11.400  10.469  10.469
  373   1HG   ARG  44           HGS      ARG  44  -9.643   9.228   9.228
  374   2HG   ARG  44           HGR      ARG  44 -10.702   7.912   7.912
  375   1HD   ARG  44           HDS      ARG  44 -10.219  10.625  10.625
  376   2HD   ARG  44           HDR      ARG  44  -9.900   9.014   9.014
  377    HE   ARG  44           HE       ARG  44 -12.581  10.249  10.249
  378   1HH1  ARG  44           HH1      ARG  44 -10.601   7.612   7.612
  379   2HH1  ARG  44           HH1      ARG  44 -11.765   7.162   7.162
  380   1HH2  ARG  44           HH2      ARG  44 -14.027   9.705   9.705
  381   2HH2  ARG  44           HH2      ARG  44 -13.708   8.341   8.341
  382    H    PHE  45           HN       PHE  45 -11.084   6.362   6.362
  383    HA   PHE  45           HA       PHE  45 -12.627   4.697   4.697
  384   1HB   PHE  45           HBS      PHE  45 -10.459   4.270   4.270
  385   2HB   PHE  45           HBR      PHE  45 -11.734   3.023   3.023
  386    HD1  PHE  45           HD1      PHE  45 -12.389   1.811   1.811
  387    HD2  PHE  45           HD2      PHE  45  -8.871   4.216   4.216
  388    HE1  PHE  45           HE1      PHE  45 -11.574   0.606   0.606
  389    HE2  PHE  45           HE2      PHE  45  -8.050   3.050   3.050
  390    HZ   PHE  45           HZ       PHE  45  -9.379   1.186   1.186
  391    H    ALA  46           HN       ALA  46 -12.412   4.793   4.793
  392    HA   ALA  46           HA       ALA  46 -15.308   4.517   4.517
  393   1HB   ALA  46           HMB      ALA  46 -13.330   2.249   2.249
  394   2HB   ALA  46           HMB      ALA  46 -14.784   2.167   2.167
  395   3HB   ALA  46           HMB      ALA  46 -14.948   2.365   2.365
  396    H    VAL  47           HN       VAL  47 -12.755   5.990   5.990
  397    HA   VAL  47           HA       VAL  47 -12.631   5.029   5.029
  398    HB   VAL  47           HB       VAL  47 -10.310   5.917   5.917
  399   1HG1  VAL  47           HMG      VAL  47 -10.460   4.441   4.441
  400   2HG1  VAL  47           HMG      VAL  47  -8.983   4.594   4.594
  401   3HG1  VAL  47           HMG      VAL  47  -9.765   6.046   6.046
  402   1HG2  VAL  47           HMG      VAL  47 -11.400   3.130   3.130
  403   2HG2  VAL  47           HMG      VAL  47 -11.220   4.031   4.031
  404   3HG2  VAL  47           HMG      VAL  47  -9.776   3.494   3.494
  405    H    ASN  48           HN       ASN  48 -11.307   6.604   6.604
  406    HA   ASN  48           HA       ASN  48 -11.695   9.403   9.403
  407   1HB   ASN  48           HBS      ASN  48 -13.384   9.139   9.139
  408   2HB   ASN  48           HBR      ASN  48 -12.314   8.256   8.256
  409   1HD2  ASN  48           HD2      ASN  48 -12.829  12.174  12.174
  410   2HD2  ASN  48           HD2      ASN  48 -13.844  11.128  11.128
  411    HA   PRO  49           HA       PRO  49  -7.517   9.789   9.789
  412   1HB   PRO  49           HBR      PRO  49  -7.281  12.368  12.368
  413   2HB   PRO  49           HBS      PRO  49  -7.458  11.837  11.837
  414   1HG   PRO  49           HGS      PRO  49  -9.352  13.070  13.070
  415   2HG   PRO  49           HGR      PRO  49  -9.349  12.921  12.921
  416   1HD   PRO  49           HDS      PRO  49 -10.906  11.510  11.510
  417   2HD   PRO  49           HDR      PRO  49 -10.610  11.125  11.125
  418    H    GLY  50           HN       GLY  50  -8.607  11.485  11.485
  419   1HA   GLY  50           HAS      GLY  50  -6.423  10.687  10.687
  420   2HA   GLY  50           HAR      GLY  50  -7.887  11.402  11.402
  421    H    LEU  51           HN       LEU  51  -9.369   9.022   9.022
  422    HA   LEU  51           HA       LEU  51  -9.285   6.978   6.978
  423   1HB   LEU  51           HBR      LEU  51 -10.986   7.739   7.739
  424   2HB   LEU  51           HBS      LEU  51 -10.091   6.542   6.542
  425    HG   LEU  51           HG       LEU  51 -11.605   6.021   6.021
  426   1HD1  LEU  51           HMD      LEU  51 -12.172   5.378   5.378
  427   2HD1  LEU  51           HMD      LEU  51 -13.015   4.618   4.618
  428   3HD1  LEU  51           HMD      LEU  51 -13.144   6.375   6.375
  429   1HD2  LEU  51           HMD      LEU  51  -9.496   4.596   4.596
  430   2HD2  LEU  51           HMD      LEU  51 -10.353   4.190   4.190
  431   3HD2  LEU  51           HMD      LEU  51 -11.004   3.650   3.650
  432    H    LEU  52           HN       LEU  52  -7.452   7.721   7.721
  433    HA   LEU  52           HA       LEU  52  -5.789   5.382   5.382
  434   1HB   LEU  52           HBS      LEU  52  -6.121   5.209   5.209
  435   2HB   LEU  52           HBR      LEU  52  -6.765   6.864   6.864
  436    HG   LEU  52           HG       LEU  52  -4.965   6.352   6.352
  437   1HD1  LEU  52           HMD      LEU  52  -5.450   8.653   8.653
  438   2HD1  LEU  52           HMD      LEU  52  -4.171   8.461   8.461
  439   3HD1  LEU  52           HMD      LEU  52  -3.760   8.411   8.411
  440   1HD2  LEU  52           HMD      LEU  52  -3.762   5.026   5.026
  441   2HD2  LEU  52           HMD      LEU  52  -2.889   5.679   5.679
  442   3HD2  LEU  52           HMD      LEU  52  -2.904   6.584   6.584
  443    H    GLU  53           HN       GLU  53  -5.718   8.692   8.692
  444    HA   GLU  53           HA       GLU  53  -2.885   9.138   9.138
  445   1HB   GLU  53           HBR      GLU  53  -4.658  10.841  10.841
  446   2HB   GLU  53           HBS      GLU  53  -5.312  10.016  10.016
  447   1HG   GLU  53           HGS      GLU  53  -3.969  10.713  10.713
  448   2HG   GLU  53           HGR      GLU  53  -2.607  11.066  11.066
  449    H    THR  54           HN       THR  54  -5.312   7.358   7.358
  450    HA   THR  54           HA       THR  54  -3.356   6.622   6.622
  451    HB   THR  54           HB       THR  54  -5.199   5.638   5.638
  452    HG1  THR  54           HG1      THR  54  -6.481   5.980   5.980
  453   1HG2  THR  54           HMG      THR  54  -6.260   8.041   8.041
  454   2HG2  THR  54           HMG      THR  54  -6.970   7.356   7.356
  455   3HG2  THR  54           HMG      THR  54  -5.326   8.047   8.047
  456    H    SER  55           HN       SER  55  -2.428   4.690   4.690
  457    HA   SER  55           HA       SER  55  -2.164   2.594   2.594
  458   1HB   SER  55           HBS      SER  55  -1.871   1.275   1.275
  459   2HB   SER  55           HBR      SER  55  -0.610   2.308   2.308
  460    HG   SER  55           HG       SER  55  -1.033   2.542   2.542
  461    H    GLU  56           HN       GLU  56  -4.698   3.297   3.297
  462    HA   GLU  56           HA       GLU  56  -5.817   0.626   0.626
  463   1HB   GLU  56           HBR      GLU  56  -6.108   3.101   3.101
  464   2HB   GLU  56           HBS      GLU  56  -7.488   3.000   3.000
  465   1HG   GLU  56           HGR      GLU  56  -8.039   0.807   0.807
  466   2HG   GLU  56           HGS      GLU  56  -6.759   1.324   1.324
  467    H    GLY  57           HN       GLY  57  -6.917   3.661   3.661
  468   1HA   GLY  57           HAR      GLY  57  -8.933   2.204   2.204
  469   2HA   GLY  57           HAS      GLY  57  -8.612   3.957   3.957
  470    H    CYS  58           HN       CYS  58  -5.714   3.385   3.385
  471    HA   CYS  58           HA       CYS  58  -5.599   2.783   2.783
  472   1HB   CYS  58           HBR      CYS  58  -3.811   3.828   3.828
  473   2HB   CYS  58           HBS      CYS  58  -3.425   2.156   2.156
  474    H    ARG  59           HN       ARG  59  -5.137   0.750   0.750
  475    HA   ARG  59           HA       ARG  59  -4.944  -1.691  -1.691
  476   1HB   ARG  59           HBR      ARG  59  -4.732  -0.928  -0.928
  477   2HB   ARG  59           HBS      ARG  59  -6.354  -1.663  -1.663
  478   1HG   ARG  59           HGS      ARG  59  -5.071  -3.632  -3.632
  479   2HG   ARG  59           HGR      ARG  59  -3.678  -2.932  -2.932
  480   1HD   ARG  59           HDS      ARG  59  -4.494  -3.485  -3.485
  481   2HD   ARG  59           HDR      ARG  59  -6.197  -3.386  -3.386
  482    HE   ARG  59           HE       ARG  59  -5.422  -5.547  -5.547
  483   1HH1  ARG  59           HH1      ARG  59  -4.379  -4.656  -4.656
  484   2HH1  ARG  59           HH1      ARG  59  -4.371  -6.294  -6.294
  485   1HH2  ARG  59           HH2      ARG  59  -5.523  -7.661  -7.661
  486   2HH2  ARG  59           HH2      ARG  59  -5.018  -7.995  -7.995
  487    H    GLN  60           HN       GLN  60  -7.711   0.291   0.291
  488    HA   GLN  60           HA       GLN  60  -9.754  -1.764  -1.764
  489   1HB   GLN  60           HBR      GLN  60  -9.950   0.681   0.681
  490   2HB   GLN  60           HBS      GLN  60 -10.282   1.091   1.091
  491   1HG   GLN  60           HGR      GLN  60 -12.401   0.694   0.694
  492   2HG   GLN  60           HGS      GLN  60 -11.951  -0.941  -0.941
  493   1HE2  GLN  60           HE2      GLN  60 -11.670  -2.355  -2.355
  494   2HE2  GLN  60           HE2      GLN  60 -11.047  -2.418  -2.418
  495    H    ILE  61           HN       ILE  61  -7.701   0.332   0.332
  496    HA   ILE  61           HA       ILE  61  -9.043  -0.426  -0.426
  497    HB   ILE  61           HB       ILE  61  -6.500   1.221   1.221
  498   1HG1  ILE  61           HG1      ILE  61  -8.196   2.486   2.486
  499   2HG1  ILE  61           HG1      ILE  61  -8.079   3.073   3.073
  500   1HG2  ILE  61           HMG      ILE  61  -6.857  -0.033  -0.033
  501   2HG2  ILE  61           HMG      ILE  61  -7.907   1.377   1.377
  502   3HG2  ILE  61           HMG      ILE  61  -6.192   1.618   1.618
  503   1HD1  ILE  61           HMD      ILE  61 -10.098   0.964   0.964
  504   2HD1  ILE  61           HMD      ILE  61 -10.411   2.690   2.690
  505   3HD1  ILE  61           HMD      ILE  61 -10.123   2.122   2.122
  506    H    LEU  62           HN       LEU  62  -5.670  -0.904  -0.904
  507    HA   LEU  62           HA       LEU  62  -4.902  -2.516  -2.516
  508   1HB   LEU  62           HBR      LEU  62  -3.662  -1.314  -1.314
  509   2HB   LEU  62           HBS      LEU  62  -3.744  -2.949  -2.949
  510    HG   LEU  62           HG       LEU  62  -2.437  -3.857  -3.857
  511   1HD1  LEU  62           HMD      LEU  62  -3.353  -1.860  -1.860
  512   2HD1  LEU  62           HMD      LEU  62  -1.773  -1.178  -1.178
  513   3HD1  LEU  62           HMD      LEU  62  -1.859  -2.766  -2.766
  514   1HD2  LEU  62           HMD      LEU  62  -1.481  -1.448  -1.448
  515   2HD2  LEU  62           HMD      LEU  62  -1.073  -3.169  -3.169
  516   3HD2  LEU  62           HMD      LEU  62  -0.388  -2.255  -2.255
  517    H    GLY  63           HN       GLY  63  -6.849  -3.267  -3.267
  518   1HA   GLY  63           HAR      GLY  63  -6.781  -6.152  -6.152
  519   2HA   GLY  63           HAS      GLY  63  -7.983  -5.197  -5.197
  520    H    GLN  64           HN       GLN  64  -9.320  -3.704  -3.704
  521    HA   GLN  64           HA       GLN  64 -10.943  -5.414  -5.414
  522   1HB   GLN  64           HBR      GLN  64 -11.220  -2.896  -2.896
  523   2HB   GLN  64           HBS      GLN  64 -11.034  -2.572  -2.572
  524   1HG   GLN  64           HGR      GLN  64 -13.194  -3.035  -3.035
  525   2HG   GLN  64           HGS      GLN  64 -12.808  -4.733  -4.733
  526   1HE2  GLN  64           HE2      GLN  64 -13.638  -4.249  -4.249
  527   2HE2  GLN  64           HE2      GLN  64 -12.272  -4.762  -4.762
  528    H    LEU  65           HN       LEU  65  -7.954  -3.977  -3.977
  529    HA   LEU  65           HA       LEU  65  -8.688  -3.415  -3.415
  530   1HB   LEU  65           HBR      LEU  65  -7.689  -1.833  -1.833
  531   2HB   LEU  65           HBS      LEU  65  -6.164  -2.750  -2.750
  532    HG   LEU  65           HG       LEU  65  -6.274  -2.143  -2.143
  533   1HD1  LEU  65           HMD      LEU  65  -8.528  -0.538  -0.538
  534   2HD1  LEU  65           HMD      LEU  65  -7.485   0.221   0.221
  535   3HD1  LEU  65           HMD      LEU  65  -8.351  -1.289  -1.289
  536   1HD2  LEU  65           HMD      LEU  65  -5.524  -0.650  -0.650
  537   2HD2  LEU  65           HMD      LEU  65  -4.619  -0.919  -0.919
  538   3HD2  LEU  65           HMD      LEU  65  -5.795   0.415   0.415
  539    H    GLN  66           HN       GLN  66  -6.316  -5.348  -5.348
  540    HA   GLN  66           HA       GLN  66  -4.812  -6.294  -6.294
  541   1HB   GLN  66           HBR      GLN  66  -5.253  -7.100  -7.100
  542   2HB   GLN  66           HBS      GLN  66  -5.212  -8.544  -8.544
  543   1HG   GLN  66           HGS      GLN  66  -3.092  -6.889  -6.889
  544   2HG   GLN  66           HGR      GLN  66  -3.052  -6.883  -6.883
  545   1HE2  GLN  66           HE2      GLN  66  -3.005 -10.651 -10.651
  546   2HE2  GLN  66           HE2      GLN  66  -4.192  -9.488  -9.488
  547    HA   PRO  67           HA       PRO  67  -8.348  -9.579  -9.579
  548   1HB   PRO  67           HBS      PRO  67 -10.642  -8.646  -8.646
  549   2HB   PRO  67           HBR      PRO  67  -9.866 -10.019 -10.019
  550   1HG   PRO  67           HGR      PRO  67  -9.981  -7.558  -7.558
  551   2HG   PRO  67           HGS      PRO  67  -9.565  -9.056  -9.056
  552   1HD   PRO  67           HDS      PRO  67  -7.836  -7.074  -7.074
  553   2HD   PRO  67           HDR      PRO  67  -7.423  -8.656  -8.656
  554    H    SER  68           HN       SER  68  -9.047  -6.213  -6.213
  555    HA   SER  68           HA       SER  68 -10.901  -6.217  -6.217
  556   1HB   SER  68           HBS      SER  68 -11.305  -4.819  -4.819
  557   2HB   SER  68           HBR      SER  68  -9.801  -3.905  -3.905
  558    HG   SER  68           HG       SER  68 -10.950  -2.630  -2.630
  559    H    LEU  69           HN       LEU  69  -7.560  -6.154  -6.154
  560    HA   LEU  69           HA       LEU  69  -7.012  -4.464  -4.464
  561   1HB   LEU  69           HBR      LEU  69  -5.518  -6.707  -6.707
  562   2HB   LEU  69           HBS      LEU  69  -4.828  -5.728  -5.728
  563    HG   LEU  69           HG       LEU  69  -5.790  -4.609  -4.609
  564   1HD1  LEU  69           HMD      LEU  69  -3.417  -6.070  -6.070
  565   2HD1  LEU  69           HMD      LEU  69  -2.971  -4.353  -4.353
  566   3HD1  LEU  69           HMD      LEU  69  -3.837  -5.182  -5.182
  567   1HD2  LEU  69           HMD      LEU  69  -5.145  -3.487  -3.487
  568   2HD2  LEU  69           HMD      LEU  69  -5.600  -2.657  -2.657
  569   3HD2  LEU  69           HMD      LEU  69  -3.886  -3.008  -3.008
  570    H    GLN  70           HN       GLN  70  -7.697  -7.927  -7.927
  571    HA   GLN  70           HA       GLN  70  -7.441  -8.609  -8.609
  572   1HB   GLN  70           HBR      GLN  70  -8.669 -10.568 -10.568
  573   2HB   GLN  70           HBS      GLN  70  -7.624 -10.257 -10.257
  574   1HG   GLN  70           HGS      GLN  70  -9.370 -10.290 -10.290
  575   2HG   GLN  70           HGR      GLN  70 -10.199  -9.033  -9.033
  576   1HE2  GLN  70           HE2      GLN  70 -11.878 -11.469 -11.469
  577   2HE2  GLN  70           HE2      GLN  70 -10.930 -10.028 -10.028
  578    H    THR  71           HN       THR  71  -9.640  -6.593  -6.593
  579    HA   THR  71           HA       THR  71 -11.662  -6.930  -6.930
  580    HB   THR  71           HB       THR  71 -13.344  -6.288  -6.288
  581    HG1  THR  71           HG1      THR  71 -11.207  -5.794  -5.794
  582   1HG2  THR  71           HMG      THR  71 -11.943  -8.551  -8.551
  583   2HG2  THR  71           HMG      THR  71 -11.762  -7.776  -7.776
  584   3HG2  THR  71           HMG      THR  71 -13.389  -8.082  -8.082
  585    H    GLY  72           HN       GLY  72  -9.314  -4.763  -4.763
  586   1HA   GLY  72           HAR      GLY  72 -10.935  -2.340  -2.340
  587   2HA   GLY  72           HAS      GLY  72  -9.357  -2.453  -2.453
  588    H    SER  73           HN       SER  73  -7.485  -3.049  -3.049
  589    HA   SER  73           HA       SER  73  -7.410  -2.913  -2.913
  590   1HB   SER  73           HBS      SER  73  -6.590  -0.629  -0.629
  591   2HB   SER  73           HBR      SER  73  -8.321  -0.700  -0.700
  592    HG   SER  73           HG       SER  73  -7.902  -0.016  -0.016
  593    H    GLU  74           HN       GLU  74  -5.227  -2.486  -2.486
  594    HA   GLU  74           HA       GLU  74  -2.949  -3.075  -3.075
  595   1HB   GLU  74           HBR      GLU  74  -2.906  -3.566  -3.566
  596   2HB   GLU  74           HBS      GLU  74  -3.577  -2.087  -2.087
  597   1HG   GLU  74           HGR      GLU  74  -0.799  -2.098  -2.098
  598   2HG   GLU  74           HGS      GLU  74  -1.257  -2.582  -2.582
  599    H    GLU  75           HN       GLU  75  -4.903  -0.309  -0.309
  600    HA   GLU  75           HA       GLU  75  -3.046   1.647   1.647
  601   1HB   GLU  75           HBR      GLU  75  -4.525   2.268   2.268
  602   2HB   GLU  75           HBS      GLU  75  -5.791   1.412   1.412
  603   1HG   GLU  75           HGS      GLU  75  -6.680   3.000   3.000
  604   2HG   GLU  75           HGR      GLU  75  -5.166   3.655   3.655
  605    H    LEU  76           HN       LEU  76  -5.310  -0.539  -0.539
  606    HA   LEU  76           HA       LEU  76  -5.285   0.814   0.814
  607   1HB   LEU  76           HBR      LEU  76  -6.942  -1.034  -1.034
  608   2HB   LEU  76           HBS      LEU  76  -5.989  -2.029  -2.029
  609    HG   LEU  76           HG       LEU  76  -7.866   0.258   0.258
  610   1HD1  LEU  76           HMD      LEU  76  -7.958  -2.661  -2.661
  611   2HD1  LEU  76           HMD      LEU  76  -8.354  -1.930  -1.930
  612   3HD1  LEU  76           HMD      LEU  76  -9.274  -1.465  -1.465
  613   1HD2  LEU  76           HMD      LEU  76  -5.514  -0.050  -0.050
  614   2HD2  LEU  76           HMD      LEU  76  -7.018   0.458   0.458
  615   3HD2  LEU  76           HMD      LEU  76  -6.499  -1.244  -1.244
  616    H    ARG  77           HN       ARG  77  -3.454  -1.373  -1.373
  617    HA   ARG  77           HA       ARG  77  -1.985  -2.729  -2.729
  618   1HB   ARG  77           HBR      ARG  77  -2.145  -2.948  -2.948
  619   2HB   ARG  77           HBS      ARG  77  -0.533  -2.216  -2.216
  620   1HG   ARG  77           HGS      ARG  77  -0.152  -4.098  -4.098
  621   2HG   ARG  77           HGR      ARG  77  -1.579  -4.878  -4.878
  622   1HD   ARG  77           HDS      ARG  77  -0.399  -5.557  -5.557
  623   2HD   ARG  77           HDR      ARG  77   0.250  -3.917  -3.917
  624    HE   ARG  77           HE       ARG  77   2.213  -4.598  -4.598
  625   1HH1  ARG  77           HH1      ARG  77  -0.298  -6.935  -6.935
  626   2HH1  ARG  77           HH1      ARG  77   0.766  -7.906  -7.906
  627   1HH2  ARG  77           HH2      ARG  77   3.542  -5.823  -5.823
  628   2HH2  ARG  77           HH2      ARG  77   2.939  -7.279  -7.279
  629    H    SER  78           HN       SER  78  -1.524   0.260   0.260
  630    HA   SER  78           HA       SER  78   0.772   1.194   1.194
  631   1HB   SER  78           HBR      SER  78  -1.432   2.745   2.745
  632   2HB   SER  78           HBS      SER  78   0.106   3.416   3.416
  633    HG   SER  78           HG       SER  78  -0.520   2.258   2.258
  634    H    LEU  79           HN       LEU  79  -2.742   1.765   1.765
  635    HA   LEU  79           HA       LEU  79  -2.551   3.402   3.402
  636   1HB   LEU  79           HBR      LEU  79  -4.482   2.530   2.530
  637   2HB   LEU  79           HBS      LEU  79  -4.910   1.621   1.621
  638    HG   LEU  79           HG       LEU  79  -5.343   3.593   3.593
  639   1HD1  LEU  79           HMD      LEU  79  -4.144   5.099   5.099
  640   2HD1  LEU  79           HMD      LEU  79  -4.991   5.848   5.848
  641   3HD1  LEU  79           HMD      LEU  79  -3.466   4.964   4.964
  642   1HD2  LEU  79           HMD      LEU  79  -6.372   3.462   3.462
  643   2HD2  LEU  79           HMD      LEU  79  -7.217   3.177   3.177
  644   3HD2  LEU  79           HMD      LEU  79  -6.836   4.841   4.841
  645    H    TYR  80           HN       TYR  80  -2.148  -0.011  -0.011
  646    HA   TYR  80           HA       TYR  80  -2.571  -0.553  -0.553
  647   1HB   TYR  80           HBS      TYR  80  -3.125  -2.214  -2.214
  648   2HB   TYR  80           HBR      TYR  80  -1.428  -2.258  -2.258
  649    HD1  TYR  80           HD1      TYR  80  -3.657  -3.095  -3.095
  650    HD2  TYR  80           HD2      TYR  80   0.179  -3.602  -3.602
  651    HE1  TYR  80           HE1      TYR  80  -3.141  -4.856  -4.856
  652    HE2  TYR  80           HE2      TYR  80   0.732  -5.311  -5.311
  653    HH   TYR  80           HH       TYR  80  -1.027  -7.052  -7.052
  654    H    ASN  81           HN       ASN  81   0.225  -0.127  -0.127
  655    HA   ASN  81           HA       ASN  81   2.138  -0.716  -0.716
  656   1HB   ASN  81           HBS      ASN  81   3.791   0.214   0.214
  657   2HB   ASN  81           HBR      ASN  81   2.633  -0.822  -0.822
  658   1HD2  ASN  81           HD2      ASN  81   2.844   1.764   1.764
  659   2HD2  ASN  81           HD2      ASN  81   3.361   0.170   0.170
  660    H    THR  82           HN       THR  82   0.583   2.322   2.322
  661    HA   THR  82           HA       THR  82   2.276   3.910   3.910
  662    HB   THR  82           HB       THR  82  -0.174   5.330   5.330
  663    HG1  THR  82           HG1      THR  82   0.863   3.931   3.931
  664   1HG2  THR  82           HMG      THR  82   2.591   5.646   5.646
  665   2HG2  THR  82           HMG      THR  82   1.673   6.033   6.033
  666   3HG2  THR  82           HMG      THR  82   1.296   6.869   6.869
  667    H    ILE  83           HN       ILE  83  -0.920   2.415   2.415
  668    HA   ILE  83           HA       ILE  83  -1.447   3.388   3.388
  669    HB   ILE  83           HB       ILE  83  -2.485   1.170   1.170
  670   1HG1  ILE  83           HG1      ILE  83  -3.300   3.403   3.403
  671   2HG1  ILE  83           HG1      ILE  83  -4.599   2.383   2.383
  672   1HG2  ILE  83           HMG      ILE  83  -2.291   0.404   0.404
  673   2HG2  ILE  83           HMG      ILE  83  -3.790   1.366   1.366
  674   3HG2  ILE  83           HMG      ILE  83  -3.676  -0.002  -0.002
  675   1HD1  ILE  83           HMD      ILE  83  -3.099   3.563   3.563
  676   2HD1  ILE  83           HMD      ILE  83  -3.572   4.850   4.850
  677   3HD1  ILE  83           HMD      ILE  83  -4.817   3.800   3.800
  678    H    ALA  84           HN       ALA  84   0.087   0.370   0.370
  679    HA   ALA  84           HA       ALA  84   0.491  -0.676  -0.676
  680   1HB   ALA  84           HMB      ALA  84   1.370  -1.361  -1.361
  681   2HB   ALA  84           HMB      ALA  84   2.396  -1.963  -1.963
  682   3HB   ALA  84           HMB      ALA  84   0.662  -2.369  -2.369
  683    H    VAL  85           HN       VAL  85   2.531   1.344   1.344
  684    HA   VAL  85           HA       VAL  85   4.766   1.497   1.497
  685    HB   VAL  85           HB       VAL  85   3.741   3.324   3.324
  686   1HG1  VAL  85           HMG      VAL  85   5.012   4.523   4.523
  687   2HG1  VAL  85           HMG      VAL  85   6.446   3.680   3.680
  688   3HG1  VAL  85           HMG      VAL  85   5.527   4.786   4.786
  689   1HG2  VAL  85           HMG      VAL  85   5.034   0.945   0.945
  690   2HG2  VAL  85           HMG      VAL  85   5.101   2.254   2.254
  691   3HG2  VAL  85           HMG      VAL  85   6.400   2.087   2.087
  692    H    LEU  86           HN       LEU  86   1.935   3.635   3.635
  693    HA   LEU  86           HA       LEU  86   2.640   5.448   5.448
  694   1HB   LEU  86           HBR      LEU  86   0.946   5.560   5.560
  695   2HB   LEU  86           HBS      LEU  86  -0.208   4.884   4.884
  696    HG   LEU  86           HG       LEU  86  -0.183   6.802   6.802
  697   1HD1  LEU  86           HMD      LEU  86   2.332   7.537   7.537
  698   2HD1  LEU  86           HMD      LEU  86   1.353   8.762   8.762
  699   3HD1  LEU  86           HMD      LEU  86   2.066   7.407   7.407
  700   1HD2  LEU  86           HMD      LEU  86  -1.409   6.999   6.999
  701   2HD2  LEU  86           HMD      LEU  86  -0.735   8.576   8.576
  702   3HD2  LEU  86           HMD      LEU  86   0.047   7.636   7.636
  703    H    TYR  87           HN       TYR  87   0.801   2.441   2.441
  704    HA   TYR  87           HA       TYR  87   0.344   2.419   2.419
  705   1HB   TYR  87           HBS      TYR  87  -0.506   0.737   0.737
  706   2HB   TYR  87           HBR      TYR  87   1.090  -0.059  -0.059
  707    HD1  TYR  87           HD1      TYR  87   1.806  -0.224  -0.224
  708    HD2  TYR  87           HD2      TYR  87  -2.196   0.138   0.138
  709    HE1  TYR  87           HE1      TYR  87   0.996  -1.160  -1.160
  710    HE2  TYR  87           HE2      TYR  87  -3.020  -0.585  -0.585
  711    HH   TYR  87           HH       TYR  87  -2.012  -0.571  -0.571
  712    H    CYS  88           HN       CYS  88   3.155   1.416   1.416
  713    HA   CYS  88           HA       CYS  88   4.777   0.460   0.460
  714   1HB   CYS  88           HBS      CYS  88   4.961   0.876   0.876
  715   2HB   CYS  88           HBR      CYS  88   6.264   1.870   1.870
  716    H    VAL  89           HN       VAL  89   4.183   3.714   3.714
  717    HA   VAL  89           HA       VAL  89   6.298   4.858   4.858
  718    HB   VAL  89           HB       VAL  89   4.111   6.323   6.323
  719   1HG1  VAL  89           HMG      VAL  89   6.809   7.056   7.056
  720   2HG1  VAL  89           HMG      VAL  89   6.243   7.823   7.823
  721   3HG1  VAL  89           HMG      VAL  89   5.285   7.977   7.977
  722   1HG2  VAL  89           HMG      VAL  89   6.106   4.545   4.545
  723   2HG2  VAL  89           HMG      VAL  89   4.749   5.387   5.387
  724   3HG2  VAL  89           HMG      VAL  89   6.316   6.210   6.210
  725    H    HIS  90           HN       HIS  90   2.763   4.668   4.668
  726    HA   HIS  90           HA       HIS  90   2.408   6.534   6.534
  727   1HB   HIS  90           HBS      HIS  90   0.661   4.163   4.163
  728   2HB   HIS  90           HBR      HIS  90   0.222   5.369   5.369
  729    HD1  HIS  90           HD1      HIS  90   1.065   7.985   7.985
  730    HD2  HIS  90           HD2      HIS  90  -1.151   4.870   4.870
  731    HE1  HIS  90           HE1      HIS  90  -0.237   8.974   8.974
  732    HE2  HIS  90           HE2      HIS  90  -1.518   7.078   7.078
  733    H    GLN  91           HN       GLN  91   3.332   3.158   3.158
  734    HA   GLN  91           HA       GLN  91   3.198   2.716   2.716
  735   1HB   GLN  91           HBR      GLN  91   4.666   1.431   1.431
  736   2HB   GLN  91           HBS      GLN  91   5.221   1.149   1.149
  737   1HG   GLN  91           HGS      GLN  91   2.855   0.111   0.111
  738   2HG   GLN  91           HGR      GLN  91   3.908  -0.654  -0.654
  739   1HE2  GLN  91           HE2      GLN  91   0.517   1.377   1.377
  740   2HE2  GLN  91           HE2      GLN  91   1.238   1.655   1.655
  741    H    ARG  92           HN       ARG  92   5.922   3.524   3.524
  742    HA   ARG  92           HA       ARG  92   7.705   4.788   4.788
  743   1HB   ARG  92           HBR      ARG  92   7.286   3.102   3.102
  744   2HB   ARG  92           HBS      ARG  92   7.687   1.805   1.805
  745   1HG   ARG  92           HGS      ARG  92   9.615   2.005   2.005
  746   2HG   ARG  92           HGR      ARG  92   9.987   2.982   2.982
  747   1HD   ARG  92           HDR      ARG  92  10.349   4.744   4.744
  748   2HD   ARG  92           HDS      ARG  92   8.681   4.645   4.645
  749    HE   ARG  92           HE       ARG  92   9.635   4.009   4.009
  750   1HH1  ARG  92           HH1      ARG  92  11.847   3.073   3.073
  751   2HH1  ARG  92           HH1      ARG  92  12.899   2.206   2.206
  752   1HH2  ARG  92           HH2      ARG  92  10.964   2.758   2.758
  753   2HH2  ARG  92           HH2      ARG  92  12.401   2.028   2.028
  754    H    ILE  93           HN       ILE  93   7.109   1.999   1.999
  755    HA   ILE  93           HA       ILE  93   9.889   1.539   1.539
  756    HB   ILE  93           HB       ILE  93   7.392   0.593   0.593
  757   1HG1  ILE  93           HG1      ILE  93   8.064  -1.517  -1.517
  758   2HG1  ILE  93           HG1      ILE  93   8.387  -0.116  -0.116
  759   1HG2  ILE  93           HMG      ILE  93  10.253  -0.298  -0.298
  760   2HG2  ILE  93           HMG      ILE  93   8.954  -1.465  -1.465
  761   3HG2  ILE  93           HMG      ILE  93   9.162  -0.020  -0.020
  762   1HD1  ILE  93           HMD      ILE  93   5.948   0.525   0.525
  763   2HD1  ILE  93           HMD      ILE  93   5.844  -1.249  -1.249
  764   3HD1  ILE  93           HMD      ILE  93   6.209  -0.252  -0.252
  765    H    ASP  94           HN       ASP  94  10.962   2.220   2.220
  766    HA   ASP  94           HA       ASP  94   9.476   3.744   3.744
  767   1HB   ASP  94           HBS      ASP  94  10.991   5.482   5.482
  768   2HB   ASP  94           HBR      ASP  94  10.617   5.455   5.455
  769    H    VAL  95           HN       VAL  95  10.303   3.538   3.538
  770    HA   VAL  95           HA       VAL  95  11.982   1.097   1.097
  771    HB   VAL  95           HB       VAL  95  10.418   0.080   0.080
  772   1HG1  VAL  95           HMG      VAL  95   9.037   1.603   1.603
  773   2HG1  VAL  95           HMG      VAL  95   8.188   0.395   0.395
  774   3HG1  VAL  95           HMG      VAL  95   9.603  -0.084  -0.084
  775   1HG2  VAL  95           HMG      VAL  95   9.391   2.809   2.809
  776   2HG2  VAL  95           HMG      VAL  95   9.677   1.415   1.415
  777   3HG2  VAL  95           HMG      VAL  95   8.235   1.456   1.456
  778    H    LYS  96           HN       LYS  96  12.085   0.708   0.708
  779    HA   LYS  96           HA       LYS  96  13.715   3.060   3.060
  780   1HB   LYS  96           HBS      LYS  96  14.393   0.157   0.157
  781   2HB   LYS  96           HBR      LYS  96  14.922   1.083   1.083
  782   1HG   LYS  96           HGR      LYS  96  15.584   1.686   1.686
  783   2HG   LYS  96           HGS      LYS  96  16.698   1.046   1.046
  784   1HD   LYS  96           HDR      LYS  96  15.396   3.755   3.755
  785   2HD   LYS  96           HDS      LYS  96  17.070   3.410   3.410
  786   1HE   LYS  96           HES      LYS  96  17.489   3.784   3.784
  787   2HE   LYS  96           HER      LYS  96  16.590   2.280   2.280
  788   1HZ   LYS  96           HZC      LYS  96  14.669   4.125   4.125
  789   2HZ   LYS  96           HZA      LYS  96  15.819   4.978   4.978
  790   3HZ   LYS  96           HZB      LYS  96  15.225   3.608   3.608
  791    H    ASP  97           HN       ASP  97  11.144   0.932   0.932
  792    HA   ASP  97           HA       ASP  97  10.863   1.624   1.624
  793   1HB   ASP  97           HBS      ASP  97  12.673   0.139   0.139
  794   2HB   ASP  97           HBR      ASP  97  11.975  -0.955  -0.955
  795    H    THR  98           HN       THR  98   9.092   0.171   0.171
  796    HA   THR  98           HA       THR  98   6.770  -0.102  -0.102
  797    HB   THR  98           HB       THR  98   7.302  -1.789  -1.789
  798    HG1  THR  98           HG1      THR  98   6.671  -0.213  -0.213
  799   1HG2  THR  98           HMG      THR  98   4.978  -1.174  -1.174
  800   2HG2  THR  98           HMG      THR  98   4.763  -0.569  -0.569
  801   3HG2  THR  98           HMG      THR  98   5.151  -2.285  -2.285
  802    H    LYS  99           HN       LYS  99   8.422  -2.848  -2.848
  803    HA   LYS  99           HA       LYS  99   7.057  -4.648  -4.648
  804   1HB   LYS  99           HBR      LYS  99   8.390  -6.402  -6.402
  805   2HB   LYS  99           HBS      LYS  99   7.966  -5.232  -5.232
  806   1HG   LYS  99           HGR      LYS  99  10.456  -4.363  -4.363
  807   2HG   LYS  99           HGS      LYS  99  10.580  -6.142  -6.142
  808   1HD   LYS  99           HDR      LYS  99  11.330  -5.448  -5.448
  809   2HD   LYS  99           HDS      LYS  99   9.722  -6.054  -6.054
  810   1HE   LYS  99           HES      LYS  99   9.373  -4.146  -4.146
  811   2HE   LYS  99           HER      LYS  99   9.297  -3.375  -3.375
  812   1HZ   LYS  99           HZB      LYS  99  11.708  -3.066  -3.066
  813   2HZ   LYS  99           HZC      LYS  99  11.662  -3.619  -3.619
  814   3HZ   LYS  99           HZA      LYS  99  10.872  -2.246  -2.246
  815    H    GLU 100           HN       GLU 100   9.904  -2.832  -2.832
  816    HA   GLU 100           HA       GLU 100  10.938  -4.423  -4.423
  817   1HB   GLU 100           HBS      GLU 100  11.758  -2.478  -2.478
  818   2HB   GLU 100           HBR      GLU 100  11.117  -1.439  -1.439
  819   1HG   GLU 100           HGS      GLU 100  13.188  -3.498  -3.498
  820   2HG   GLU 100           HGR      GLU 100  13.577  -1.817  -1.817
  821    H    ALA 101           HN       ALA 101   8.877  -1.495  -1.495
  822    HA   ALA 101           HA       ALA 101   7.979  -1.520  -1.520
  823   1HB   ALA 101           HMB      ALA 101   7.468  -0.033  -0.033
  824   2HB   ALA 101           HMB      ALA 101   5.921  -0.818  -0.818
  825   3HB   ALA 101           HMB      ALA 101   6.750   0.191   0.191
  826    H    LEU 102           HN       LEU 102   6.618  -2.949  -2.949
  827    HA   LEU 102           HA       LEU 102   4.401  -4.123  -4.123
  828   1HB   LEU 102           HBS      LEU 102   5.528  -3.870  -3.870
  829   2HB   LEU 102           HBR      LEU 102   5.230  -5.614  -5.614
  830    HG   LEU 102           HG       LEU 102   2.868  -5.072  -5.072
  831   1HD1  LEU 102           HMD      LEU 102   3.256  -2.706  -2.706
  832   2HD1  LEU 102           HMD      LEU 102   3.601  -2.324  -2.324
  833   3HD1  LEU 102           HMD      LEU 102   1.980  -2.892  -2.892
  834   1HD2  LEU 102           HMD      LEU 102   4.071  -4.298  -4.298
  835   2HD2  LEU 102           HMD      LEU 102   3.369  -5.861  -5.861
  836   3HD2  LEU 102           HMD      LEU 102   2.314  -4.442  -4.442
  837    H    ASP 103           HN       ASP 103   7.701  -5.054  -5.054
  838    HA   ASP 103           HA       ASP 103   7.172  -7.832  -7.832
  839   1HB   ASP 103           HBS      ASP 103   9.204  -7.151  -7.151
  840   2HB   ASP 103           HBR      ASP 103   9.759  -6.298  -6.298
  841    H    LYS 104           HN       LYS 104   8.196  -4.942  -4.942
  842    HA   LYS 104           HA       LYS 104   7.763  -5.886  -5.886
  843   1HB   LYS 104           HBR      LYS 104   8.496  -3.514  -3.514
  844   2HB   LYS 104           HBS      LYS 104   6.740  -3.190  -3.190
  845   1HG   LYS 104           HGR      LYS 104   7.438  -2.449  -2.449
  846   2HG   LYS 104           HGS      LYS 104   6.748  -4.069  -4.069
  847   1HD   LYS 104           HDR      LYS 104   9.665  -3.769  -3.769
  848   2HD   LYS 104           HDS      LYS 104   9.053  -3.316  -3.316
  849   1HE   LYS 104           HES      LYS 104   9.145  -5.454  -5.454
  850   2HE   LYS 104           HER      LYS 104   7.900  -5.813  -5.813
  851   1HZ   LYS 104           HZB      LYS 104  10.151  -5.623  -5.623
  852   2HZ   LYS 104           HZC      LYS 104  10.702  -6.318  -6.318
  853   3HZ   LYS 104           HZA      LYS 104   9.495  -7.023  -7.023
  854    H    ILE 105           HN       ILE 105   5.434  -4.744  -4.744
  855    HA   ILE 105           HA       ILE 105   3.268  -4.841  -4.841
  856    HB   ILE 105           HB       ILE 105   3.079  -4.238  -4.238
  857   1HG1  ILE 105           HG1      ILE 105   4.942  -3.009  -3.009
  858   2HG1  ILE 105           HG1      ILE 105   3.750  -2.009  -2.009
  859   1HG2  ILE 105           HMG      ILE 105   1.316  -3.744  -3.744
  860   2HG2  ILE 105           HMG      ILE 105   1.385  -2.509  -2.509
  861   3HG2  ILE 105           HMG      ILE 105   0.907  -4.182  -4.182
  862   1HD1  ILE 105           HMD      ILE 105   2.608  -1.854  -1.854
  863   2HD1  ILE 105           HMD      ILE 105   4.226  -2.322  -2.322
  864   3HD1  ILE 105           HMD      ILE 105   4.027  -0.843  -0.843
  865    H    GLU 106           HN       GLU 106   4.649  -6.969  -6.969
  866    HA   GLU 106           HA       GLU 106   2.349  -8.728  -8.728
  867   1HB   GLU 106           HBS      GLU 106   3.950  -8.521  -8.521
  868   2HB   GLU 106           HBR      GLU 106   5.267  -8.773  -8.773
  869   1HG   GLU 106           HGR      GLU 106   4.913 -10.583 -10.583
  870   2HG   GLU 106           HGS      GLU 106   4.739 -11.090 -11.090
  871    H    GLU 107           HN       GLU 107   5.103  -8.336  -8.336
  872    HA   GLU 107           HA       GLU 107   4.749 -10.650 -10.650
  873   1HB   GLU 107           HBR      GLU 107   6.556  -8.889  -8.889
  874   2HB   GLU 107           HBS      GLU 107   5.490  -7.836  -7.836
  875   1HG   GLU 107           HGS      GLU 107   5.378  -9.207  -9.207
  876   2HG   GLU 107           HGR      GLU 107   6.730 -10.185 -10.185
  877    H    GLU 108           HN       GLU 108   2.610  -8.087  -8.087
  878    HA   GLU 108           HA       GLU 108   0.753  -7.191  -7.191
  879   1HB   GLU 108           HBR      GLU 108   1.090  -9.042  -9.042
  880   2HB   GLU 108           HBS      GLU 108  -0.228  -8.110  -8.110
  881   1HG   GLU 108           HGS      GLU 108   0.320  -9.998  -9.998
  882   2HG   GLU 108           HGR      GLU 108   0.006 -10.768 -10.768
  883    H    GLN 109           HN       GLN 109   3.782  -6.952  -6.952
  884    HA   GLN 109           HA       GLN 109   5.137  -5.475  -5.475
  885   1HB   GLN 109           HBR      GLN 109   3.695  -4.145  -4.145
  886   2HB   GLN 109           HBS      GLN 109   2.492  -4.001  -4.001
  887   1HG   GLN 109           HGS      GLN 109   5.338  -3.036  -3.036
  888   2HG   GLN 109           HGR      GLN 109   4.073  -2.025  -2.025
  889   1HE2  GLN 109           HE2      GLN 109   4.458  -2.353  -2.353
  890   2HE2  GLN 109           HE2      GLN 109   5.643  -2.808  -2.808
  891    H    ASN 110           HN       ASN 110   5.858  -6.284  -6.284
  892    HA   ASN 110           HA       ASN 110   6.077  -6.714  -6.714
  893   1HB   ASN 110           HBS      ASN 110   4.165  -4.415  -4.415
  894   2HB   ASN 110           HBR      ASN 110   4.615  -5.392  -5.392
  895   1HD2  ASN 110           HD2      ASN 110   6.891  -2.461  -2.461
  896   2HD2  ASN 110           HD2      ASN 110   5.178  -2.692  -2.692
  897    H    LYS 111           HN       LYS 111   5.310  -8.239  -8.239
  898    HA   LYS 111           HA       LYS 111   4.138 -10.144 -10.144
  899   1HB   LYS 111           HBR      LYS 111   1.774  -8.664  -8.664
  900   2HB   LYS 111           HBS      LYS 111   1.702 -10.253 -10.253
  901   1HG   LYS 111           HGR      LYS 111   2.938  -7.992  -7.992
  902   2HG   LYS 111           HGS      LYS 111   1.170  -7.942  -7.942
  903   1HD   LYS 111           HDS      LYS 111   2.763 -10.119 -10.119
  904   2HD   LYS 111           HDR      LYS 111   1.698  -8.961  -8.961
  905   1HE   LYS 111           HES      LYS 111  -0.185  -9.904  -9.904
  906   2HE   LYS 111           HER      LYS 111   0.947 -11.209 -11.209
  907   1HZ   LYS 111           HZC      LYS 111   1.181 -11.170 -11.170
  908   2HZ   LYS 111           HZA      LYS 111  -0.389 -10.742 -10.742
  909   3HZ   LYS 111           HZB      LYS 111   0.141 -12.140 -12.140
  910    H    SER 112           HN       SER 112   4.947 -11.706 -11.706
  911    HA   SER 112           HA       SER 112   4.592 -11.596 -11.596
  912   1HB   SER 112           HBS      SER 112   6.473 -13.298 -13.298
  913   2HB   SER 112           HBR      SER 112   6.494 -13.073 -13.073
  914    HG   SER 112           HG       SER 112   8.099 -11.878 -11.878
  915    H    LYS 113           HN       LYS 113   3.565 -13.051 -13.051
  916    HA   LYS 113           HA       LYS 113   2.478 -14.953 -14.953
  917   1HB   LYS 113           HBR      LYS 113   4.312 -15.933 -15.933
  918   2HB   LYS 113           HBS      LYS 113   3.044 -17.027 -17.027
  919   1HG   LYS 113           HGR      LYS 113   4.659 -15.630 -15.630
  920   2HG   LYS 113           HGS      LYS 113   5.545 -16.812 -16.812
  921   1HD   LYS 113           HDS      LYS 113   4.731 -18.482 -18.482
  922   2HD   LYS 113           HDR      LYS 113   3.117 -18.026 -18.026
  923   1HE   LYS 113           HES      LYS 113   3.426 -18.225 -18.225
  924   2HE   LYS 113           HER      LYS 113   2.821 -16.639 -16.639
  925   1HZ   LYS 113           HZA      LYS 113   5.524 -16.414 -16.414
  926   2HZ   LYS 113           HZB      LYS 113   5.204 -17.249 -17.249
  927   3HZ   LYS 113           HZC      LYS 113   4.497 -15.799 -15.799
  928    H    LYS 114           HN       LYS 114   0.377 -15.054 -15.054
  929    HA   LYS 114           HA       LYS 114  -0.932 -15.255 -15.255
  930   1HB   LYS 114           HBR      LYS 114  -1.910 -13.858 -13.858
  931   2HB   LYS 114           HBS      LYS 114  -2.194 -15.373 -15.373
  932   1HG   LYS 114           HGR      LYS 114  -4.211 -15.377 -15.377
  933   2HG   LYS 114           HGS      LYS 114  -3.335 -15.928 -15.928
  934   1HD   LYS 114           HDS      LYS 114  -3.390 -13.887 -13.887
  935   2HD   LYS 114           HDR      LYS 114  -3.466 -13.016 -13.016
  936   1HE   LYS 114           HES      LYS 114  -5.815 -13.943 -13.943
  937   2HE   LYS 114           HER      LYS 114  -5.687 -14.439 -14.439
  938   1HZ   LYS 114           HZC      LYS 114  -5.095 -11.692 -11.692
  939   2HZ   LYS 114           HZA      LYS 114  -6.648 -12.161 -12.161
  940   3HZ   LYS 114           HZB      LYS 114  -5.602 -12.273 -12.273
  941    H    LYS 115           HN       LYS 115  -0.683 -17.067 -17.067
  942    HA   LYS 115           HA       LYS 115  -1.665 -19.571 -19.571
  943   1HB   LYS 115           HBR      LYS 115  -1.234 -18.705 -18.705
  944   2HB   LYS 115           HBS      LYS 115   0.322 -19.537 -19.537
  945   1HG   LYS 115           HGR      LYS 115  -1.188 -21.518 -21.518
  946   2HG   LYS 115           HGS      LYS 115  -2.470 -20.677 -20.677
  947   1HD   LYS 115           HDS      LYS 115  -1.573 -21.137 -21.137
  948   2HD   LYS 115           HDR      LYS 115   0.065 -20.986 -20.986
  949   1HE   LYS 115           HES      LYS 115   0.308 -23.169 -23.169
  950   2HE   LYS 115           HER      LYS 115  -1.191 -23.279 -23.279
  951   1HZ   LYS 115           HZC      LYS 115  -2.412 -23.288 -23.288
  952   2HZ   LYS 115           HZA      LYS 115  -1.024 -23.250 -23.250
  953   3HZ   LYS 115           HZB      LYS 115  -1.372 -24.545 -24.545
  954    H    ALA 116           HN       ALA 116  -0.667 -20.966 -20.966
  955    HA   ALA 116           HA       ALA 116   2.254 -20.609 -20.609
  956   1HB   ALA 116           HMB      ALA 116  -0.026 -20.230 -20.230
  957   2HB   ALA 116           HMB      ALA 116   1.026 -21.528 -21.528
  958   3HB   ALA 116           HMB      ALA 116   1.703 -19.912 -19.912
  959    H    GLN 117           HN       GLN 117   2.415 -22.606 -22.606
  960    HA   GLN 117           HA       GLN 117   2.921 -24.824 -24.824
  961   1HB   GLN 117           HBR      GLN 117   0.582 -25.336 -25.336
  962   2HB   GLN 117           HBS      GLN 117   0.999 -25.301 -25.301
  963   1HG   GLN 117           HGS      GLN 117   0.879 -27.588 -27.588
  964   2HG   GLN 117           HGR      GLN 117   2.522 -27.172 -27.172
  965   1HE2  GLN 117           HE2      GLN 117   3.985 -27.134 -27.134
  966   2HE2  GLN 117           HE2      GLN 117   4.040 -26.385 -26.385
  967    H    GLN 118           HN       GLN 118   2.301 -24.945 -24.945
  968    HA   GLN 118           HA       GLN 118   5.100 -24.674 -24.674
  969   1HB   GLN 118           HBR      GLN 118   3.881 -27.369 -27.369
  970   2HB   GLN 118           HBS      GLN 118   5.015 -27.132 -27.132
  971   1HG   GLN 118           HGS      GLN 118   6.586 -26.089 -26.089
  972   2HG   GLN 118           HGR      GLN 118   5.507 -26.829 -26.829
  973   1HE2  GLN 118           HE2      GLN 118   6.608 -30.099 -30.099
  974   2HE2  GLN 118           HE2      GLN 118   5.446 -29.025 -29.025
  975    H    ALA 119           HN       ALA 119   2.754 -26.939 -26.939
  976    HA   ALA 119           HA       ALA 119   1.332 -25.142 -25.142
  977   1HB   ALA 119           HMB      ALA 119   3.897 -26.040 -26.040
  978   2HB   ALA 119           HMB      ALA 119   2.459 -26.141 -26.141
  979   3HB   ALA 119           HMB      ALA 119   2.919 -24.584 -24.584
  980    H    ALA 120           HN       ALA 120  -0.315 -26.448 -26.448
  981    HA   ALA 120           HA       ALA 120  -1.904 -28.074 -28.074
  982   1HB   ALA 120           HMB      ALA 120  -1.192 -27.262 -27.262
  983   2HB   ALA 120           HMB      ALA 120  -0.614 -28.942 -28.942
  984   3HB   ALA 120           HMB      ALA 120  -2.325 -28.616 -28.616
  985    H    ALA 121           HN       ALA 121  -1.817 -30.547 -30.547
  986    HA   ALA 121           HA       ALA 121  -0.683 -32.027 -32.027
  987   1HB   ALA 121           HMB      ALA 121  -2.970 -32.315 -32.315
  988   2HB   ALA 121           HMB      ALA 121  -2.059 -33.244 -33.244
  989   3HB   ALA 121           HMB      ALA 121  -2.057 -33.768 -33.768
  990    H    ASP 122           HN       ASP 122   1.504 -32.069 -32.069
  991    HA   ASP 122           HA       ASP 122   2.452 -33.985 -33.985
  992   1HB   ASP 122           HBS      ASP 122   4.498 -32.907 -32.907
  993   2HB   ASP 122           HBR      ASP 122   3.194 -31.713 -31.713
  994    H    THR 123           HN       THR 123   1.442 -34.157 -34.157
  995    HA   THR 123           HA       THR 123   3.539 -35.999 -35.999
  996    HB   THR 123           HB       THR 123   3.146 -35.197 -35.197
  997    HG1  THR 123           HG1      THR 123   2.909 -33.207 -33.207
  998   1HG2  THR 123           HMG      THR 123   5.177 -34.608 -34.608
  999   2HG2  THR 123           HMG      THR 123   4.902 -33.142 -33.142
 1000   3HG2  THR 123           HMG      THR 123   5.300 -34.684 -34.684
 1001    H    GLY 124           HN       GLY 124   1.836 -37.319 -37.319
 1002   1HA   GLY 124           HAR      GLY 124  -0.368 -37.884 -37.884
 1003   2HA   GLY 124           HAS      GLY 124  -0.736 -37.512 -37.512
 1004    H    ASN 125           HN       ASN 125  -1.519 -39.455 -39.455
 1005    HA   ASN 125           HA       ASN 125   0.330 -41.753 -41.753
 1006   1HB   ASN 125           HBS      ASN 125  -2.484 -42.143 -42.143
 1007   2HB   ASN 125           HBR      ASN 125  -1.058 -43.209 -43.209
 1008   1HD2  ASN 125           HD2      ASN 125   0.304 -41.559 -41.559
 1009   2HD2  ASN 125           HD2      ASN 125   0.699 -42.492 -42.492
 1010    H    ASN 126           HN       ASN 126  -3.016 -40.812 -40.812
 1011    HA   ASN 126           HA       ASN 126  -4.141 -40.890 -40.890
 1012   1HB   ASN 126           HBS      ASN 126  -1.610 -41.350 -41.350
 1013   2HB   ASN 126           HBR      ASN 126  -3.127 -40.544 -40.544
 1014   1HD2  ASN 126           HD2      ASN 126  -1.895 -37.387 -37.387
 1015   2HD2  ASN 126           HD2      ASN 126  -2.906 -38.422 -38.422
 1016    H    SER 127           HN       SER 127  -3.235 -43.213 -43.213
 1017    HA   SER 127           HA       SER 127  -4.930 -45.029 -45.029
 1018   1HB   SER 127           HBS      SER 127  -3.319 -46.898 -46.898
 1019   2HB   SER 127           HBR      SER 127  -3.351 -45.553 -45.553
 1020    HG   SER 127           HG       SER 127  -1.475 -46.226 -46.226
 1021    H    GLN 128           HN       GLN 128  -4.688 -47.300 -47.300
 1022    HA   GLN 128           HA       GLN 128  -3.491 -47.065 -47.065
 1023   1HB   GLN 128           HBR      GLN 128  -5.245 -48.507 -48.507
 1024   2HB   GLN 128           HBS      GLN 128  -5.855 -46.920 -46.920
 1025   1HG   GLN 128           HGS      GLN 128  -7.492 -48.251 -48.251
 1026   2HG   GLN 128           HGR      GLN 128  -6.348 -48.298 -48.298
 1027   1HE2  GLN 128           HE2      GLN 128  -5.973 -51.710 -51.710
 1028   2HE2  GLN 128           HE2      GLN 128  -5.761 -50.184 -50.184
 1029    H    VAL 129           HN       VAL 129  -2.764 -48.160 -48.160
 1030    HA   VAL 129           HA       VAL 129  -1.918 -50.817 -50.817
 1031    HB   VAL 129           HB       VAL 129  -1.449 -51.265 -51.265
 1032   1HG1  VAL 129           HMG      VAL 129  -4.002 -51.477 -51.477
 1033   2HG1  VAL 129           HMG      VAL 129  -4.066 -51.793 -51.793
 1034   3HG1  VAL 129           HMG      VAL 129  -2.972 -52.741 -52.741
 1035   1HG2  VAL 129           HMG      VAL 129  -3.515 -49.069 -49.069
 1036   2HG2  VAL 129           HMG      VAL 129  -1.872 -49.094 -49.094
 1037   3HG2  VAL 129           HMG      VAL 129  -3.107 -50.219 -50.219
 1038    H    SER 130           HN       SER 130  -0.813 -48.271 -48.271
 1039    HA   SER 130           HA       SER 130   1.937 -48.874 -48.874
 1040   1HB   SER 130           HBS      SER 130   0.931 -46.083 -46.083
 1041   2HB   SER 130           HBR      SER 130   2.579 -46.559 -46.559
 1042    HG   SER 130           HG       SER 130   1.932 -47.174 -47.174
 1043    H    GLN 131           HN       GLN 131  -0.230 -47.582 -47.582
 1044    HA   GLN 131           HA       GLN 131   0.946 -49.203 -49.203
 1045   1HB   GLN 131           HBR      GLN 131   1.603 -47.200 -47.200
 1046   2HB   GLN 131           HBS      GLN 131   2.775 -47.924 -47.924
 1047   1HG   GLN 131           HGS      GLN 131   2.264 -46.115 -46.115
 1048   2HG   GLN 131           HGR      GLN 131   1.189 -45.371 -45.371
 1049   1HE2  GLN 131           HE2      GLN 131   3.814 -43.391 -43.391
 1050   2HE2  GLN 131           HE2      GLN 131   2.189 -43.532 -43.532
 1051    H    ASN 132           HN       ASN 132   0.222 -48.144 -48.144
 1052    HA   ASN 132           HA       ASN 132  -2.122 -46.516 -46.516
 1053   1HB   ASN 132           HBS      ASN 132  -2.492 -49.434 -49.434
 1054   2HB   ASN 132           HBR      ASN 132  -3.435 -48.379 -48.379
 1055   1HD2  ASN 132           HD2      ASN 132  -5.373 -49.045 -49.045
 1056   2HD2  ASN 132           HD2      ASN 132  -4.633 -50.040 -50.040
 1057    H    TYR 133           HN       TYR 133  -1.712 -48.935 -48.935
 1058    HA   TYR 133           HA       TYR 133  -1.309 -48.721 -48.721
 1059   1HB   TYR 133           HBS      TYR 133   0.874 -47.625 -47.625
 1060   2HB   TYR 133           HBR      TYR 133   0.620 -46.594 -46.594
 1061    HD1  TYR 133           HD1      TYR 133   0.922 -50.234 -50.234
 1062    HD2  TYR 133           HD2      TYR 133   1.646 -47.212 -47.212
 1063    HE1  TYR 133           HE1      TYR 133   2.075 -51.878 -51.878
 1064    HE2  TYR 133           HE2      TYR 133   2.774 -48.851 -48.851
 1065    HH   TYR 133           HH       TYR 133   3.884 -50.799 -50.799

  Start of MODEL    6
    1   1H    HIS   1           HNB      HIS   1  10.389  27.592  27.592
    2   2H    HIS   1           HNC      HIS   1  10.691  29.120  29.120
    3   3H    HIS   1           HN       HIS   1   9.165  28.665  28.665
    4    HA   HIS   1           HA       HIS   1   8.943  28.489  28.489
    5   1HB   HIS   1           HBS      HIS   1  11.846  28.664  28.664
    6   2HB   HIS   1           HBR      HIS   1  11.329  27.402  27.402
    7    HD1  HIS   1           HD1      HIS   1  12.146  29.026  29.026
    8    HD2  HIS   1           HD2      HIS   1   9.038  30.499  30.499
    9    HE1  HIS   1           HE1      HIS   1  11.271  31.057  31.057
   10    HE2  HIS   1           HE2      HIS   1   9.405  31.966  31.966
   11    H    MET   2           HN       MET   2   7.585  26.801  26.801
   12    HA   MET   2           HA       MET   2   8.269  24.152  24.152
   13   1HB   MET   2           HBR      MET   2   9.029  24.850  24.850
   14   2HB   MET   2           HBS      MET   2   7.703  23.655  23.655
   15   1HG   MET   2           HGS      MET   2   8.949  22.125  22.125
   16   2HG   MET   2           HGR      MET   2  10.197  23.359  23.359
   17   1HE   MET   2           HME      MET   2   8.527  20.914  20.914
   18   2HE   MET   2           HME      MET   2   9.461  20.883  20.883
   19   3HE   MET   2           HME      MET   2   8.312  22.208  22.208
   20    H    GLY   3           HN       GLY   3   6.504  22.942  22.942
   21   1HA   GLY   3           HAS      GLY   3   4.360  22.188  22.188
   22   2HA   GLY   3           HAR      GLY   3   3.916  23.912  23.912
   23    H    ALA   4           HN       ALA   4   2.240  24.088  24.088
   24    HA   ALA   4           HA       ALA   4   1.174  24.504  24.504
   25   1HB   ALA   4           HMB      ALA   4   3.342  25.496  25.496
   26   2HB   ALA   4           HMB      ALA   4   3.816  23.900  23.900
   27   3HB   ALA   4           HMB      ALA   4   2.405  24.748  24.748
   28    H    ARG   5           HN       ARG   5   3.585  21.948  21.948
   29    HA   ARG   5           HA       ARG   5   1.443  20.537  20.537
   30   1HB   ARG   5           HBS      ARG   5   3.598  19.157  19.157
   31   2HB   ARG   5           HBR      ARG   5   3.145  20.697  20.697
   32   1HG   ARG   5           HGS      ARG   5   5.049  20.670  20.670
   33   2HG   ARG   5           HGR      ARG   5   5.621  20.280  20.280
   34   1HD   ARG   5           HDS      ARG   5   3.924  22.649  22.649
   35   2HD   ARG   5           HDR      ARG   5   5.404  22.785  22.785
   36    HE   ARG   5           HE       ARG   5   5.985  21.746  21.746
   37   1HH1  ARG   5           HH1      ARG   5   5.535  24.686  24.686
   38   2HH1  ARG   5           HH1      ARG   5   6.262  25.700  25.700
   39   1HH2  ARG   5           HH2      ARG   5   6.810  23.122  23.122
   40   2HH2  ARG   5           HH2      ARG   5   6.985  24.817  24.817
   41    H    ALA   6           HN       ALA   6   1.075  18.340  18.340
   42    HA   ALA   6           HA       ALA   6   2.226  16.614  16.614
   43   1HB   ALA   6           HMB      ALA   6  -0.075  18.220  18.220
   44   2HB   ALA   6           HMB      ALA   6   0.443  16.641  16.641
   45   3HB   ALA   6           HMB      ALA   6   1.569  18.022  18.022
   46    H    SER   7           HN       SER   7  -0.720  17.769  17.769
   47    HA   SER   7           HA       SER   7  -2.578  16.671  16.671
   48   1HB   SER   7           HBS      SER   7  -1.107  17.126  17.126
   49   2HB   SER   7           HBR      SER   7   0.149  16.030  16.030
   50    HG   SER   7           HG       SER   7  -2.426  15.286  15.286
   51    H    VAL   8           HN       VAL   8  -0.809  13.822  13.822
   52    HA   VAL   8           HA       VAL   8  -2.198  12.163  12.163
   53    HB   VAL   8           HB       VAL   8  -0.394  11.848  11.848
   54   1HG1  VAL   8           HMG      VAL   8  -0.973   9.776   9.776
   55   2HG1  VAL   8           HMG      VAL   8  -1.169   9.269   9.269
   56   3HG1  VAL   8           HMG      VAL   8   0.383   9.936   9.936
   57   1HG2  VAL   8           HMG      VAL   8  -3.301  11.235  11.235
   58   2HG2  VAL   8           HMG      VAL   8  -2.563  12.330  12.330
   59   3HG2  VAL   8           HMG      VAL   8  -2.415  10.568  10.568
   60    H    LEU   9           HN       LEU   9   1.080  13.127  13.127
   61    HA   LEU   9           HA       LEU   9   2.247  11.103  11.103
   62   1HB   LEU   9           HBR      LEU   9   3.178  12.860  12.860
   63   2HB   LEU   9           HBS      LEU   9   4.370  12.189  12.189
   64    HG   LEU   9           HG       LEU   9   2.425  10.481  10.481
   65   1HD1  LEU   9           HMD      LEU   9   5.179  11.507  11.507
   66   2HD1  LEU   9           HMD      LEU   9   4.572   9.957   9.957
   67   3HD1  LEU   9           HMD      LEU   9   3.708  11.471  11.471
   68   1HD2  LEU   9           HMD      LEU   9   4.396  10.096  10.096
   69   2HD2  LEU   9           HMD      LEU   9   3.238   8.936   8.936
   70   3HD2  LEU   9           HMD      LEU   9   4.832   9.171   9.171
   71    H    SER  10           HN       SER  10   4.605  12.327  12.327
   72    HA   SER  10           HA       SER  10   3.764  14.531  14.531
   73   1HB   SER  10           HBS      SER  10   4.754  13.671  13.671
   74   2HB   SER  10           HBR      SER  10   3.774  12.323  12.323
   75    HG   SER  10           HG       SER  10   6.048  11.995  11.995
   76    H    GLY  11           HN       GLY  11   5.963  15.267  15.267
   77   1HA   GLY  11           HAR      GLY  11   7.600  16.403  16.403
   78   2HA   GLY  11           HAS      GLY  11   8.086  16.163  16.163
   79    H    GLY  12           HN       GLY  12   8.592  13.686  13.686
   80   1HA   GLY  12           HAR      GLY  12  10.876  12.975  12.975
   81   2HA   GLY  12           HAS      GLY  12  10.030  11.919  11.919
   82    H    GLU  13           HN       GLU  13   7.509  11.856  11.856
   83    HA   GLU  13           HA       GLU  13   8.166   9.516   9.516
   84   1HB   GLU  13           HBR      GLU  13   5.553  10.905  10.905
   85   2HB   GLU  13           HBS      GLU  13   5.698   9.426   9.426
   86   1HG   GLU  13           HGS      GLU  13   6.422   8.282   8.282
   87   2HG   GLU  13           HGR      GLU  13   6.663   9.743   9.743
   88    H    LEU  14           HN       LEU  14   7.468  12.794  12.794
   89    HA   LEU  14           HA       LEU  14   6.907  12.256  12.256
   90   1HB   LEU  14           HBR      LEU  14   6.399  14.337  14.337
   91   2HB   LEU  14           HBS      LEU  14   7.916  14.887  14.887
   92    HG   LEU  14           HG       LEU  14   6.164  15.862  15.862
   93   1HD1  LEU  14           HMD      LEU  14   7.977  14.209  14.209
   94   2HD1  LEU  14           HMD      LEU  14   6.441  13.566  13.566
   95   3HD1  LEU  14           HMD      LEU  14   6.848  15.284  15.284
   96   1HD2  LEU  14           HMD      LEU  14   4.594  13.966  13.966
   97   2HD2  LEU  14           HMD      LEU  14   4.152  14.877  14.877
   98   3HD2  LEU  14           HMD      LEU  14   4.855  13.245  13.245
   99    H    ASP  15           HN       ASP  15   9.583  13.541  13.541
  100    HA   ASP  15           HA       ASP  15  11.464  13.617  13.617
  101   1HB   ASP  15           HBR      ASP  15  11.735  13.732  13.732
  102   2HB   ASP  15           HBS      ASP  15  13.155  13.689  13.689
  103    H    LYS  16           HN       LYS  16  10.124  11.047  11.047
  104    HA   LYS  16           HA       LYS  16  12.185   9.146   9.146
  105   1HB   LYS  16           HBS      LYS  16   9.926   9.126   9.126
  106   2HB   LYS  16           HBR      LYS  16   9.925   7.711   7.711
  107   1HG   LYS  16           HGS      LYS  16  11.123   7.199   7.199
  108   2HG   LYS  16           HGR      LYS  16  12.249   7.199   7.199
  109   1HD   LYS  16           HDS      LYS  16  12.590   9.714   9.714
  110   2HD   LYS  16           HDR      LYS  16  11.929   9.144   9.144
  111   1HE   LYS  16           HES      LYS  16  13.807   8.134   8.134
  112   2HE   LYS  16           HER      LYS  16  13.981   7.363   7.363
  113   1HZ   LYS  16           HZA      LYS  16  14.507  10.180  10.180
  114   2HZ   LYS  16           HZB      LYS  16  15.574   9.264   9.264
  115   3HZ   LYS  16           HZC      LYS  16  15.320   8.983   8.983
  116    H    TRP  17           HN       TRP  17   8.961  10.300  10.300
  117    HA   TRP  17           HA       TRP  17   8.645   8.419   8.419
  118   1HB   TRP  17           HBS      TRP  17   6.824   9.489   9.489
  119   2HB   TRP  17           HBR      TRP  17   7.151  11.007  11.007
  120    HD1  TRP  17           HD1      TRP  17   6.789  10.792  10.792
  121    HE1  TRP  17           HE1      TRP  17   5.183   9.333   9.333
  122    HE3  TRP  17           HE3      TRP  17   5.499   7.470   7.470
  123    HZ2  TRP  17           HZ2      TRP  17   3.454   7.176   7.176
  124    HZ3  TRP  17           HZ3      TRP  17   3.833   5.750   5.750
  125    HH2  TRP  17           HH2      TRP  17   2.908   5.528   5.528
  126    H    GLU  18           HN       GLU  18  10.435  11.292  11.292
  127    HA   GLU  18           HA       GLU  18   9.777  12.723  12.723
  128   1HB   GLU  18           HBR      GLU  18  11.532  12.895  12.895
  129   2HB   GLU  18           HBS      GLU  18  12.602  12.289  12.289
  130   1HG   GLU  18           HGR      GLU  18  13.134  14.458  14.458
  131   2HG   GLU  18           HGS      GLU  18  12.074  14.186  14.186
  132    H    LYS  19           HN       LYS  19  11.366   9.674   9.674
  133    HA   LYS  19           HA       LYS  19  11.711   9.772   9.772
  134   1HB   LYS  19           HBS      LYS  19  13.905  10.924  10.924
  135   2HB   LYS  19           HBR      LYS  19  14.403   9.211   9.211
  136   1HG   LYS  19           HGS      LYS  19  14.165   9.167   9.167
  137   2HG   LYS  19           HGR      LYS  19  13.297  10.729  10.729
  138   1HD   LYS  19           HDS      LYS  19  15.442  11.232  11.232
  139   2HD   LYS  19           HDR      LYS  19  15.403  11.754  11.754
  140   1HE   LYS  19           HER      LYS  19  16.384   9.010   9.010
  141   2HE   LYS  19           HES      LYS  19  17.441  10.399  10.399
  142   1HZ   LYS  19           HZB      LYS  19  16.442  10.877  10.877
  143   2HZ   LYS  19           HZC      LYS  19  16.797   9.283   9.283
  144   3HZ   LYS  19           HZA      LYS  19  17.953  10.373  10.373
  145    H    ILE  20           HN       ILE  20  10.216   8.111   8.111
  146    HA   ILE  20           HA       ILE  20  11.662   5.602   5.602
  147    HB   ILE  20           HB       ILE  20   8.742   6.414   6.414
  148   1HG1  ILE  20           HG1      ILE  20  10.450   4.748   4.748
  149   2HG1  ILE  20           HG1      ILE  20  10.325   6.532   6.532
  150   1HG2  ILE  20           HMG      ILE  20   8.869   4.299   4.299
  151   2HG2  ILE  20           HMG      ILE  20   9.506   3.499   3.499
  152   3HG2  ILE  20           HMG      ILE  20   7.886   4.244   4.244
  153   1HD1  ILE  20           HMD      ILE  20   7.680   5.531   5.531
  154   2HD1  ILE  20           HMD      ILE  20   8.591   4.538   4.538
  155   3HD1  ILE  20           HMD      ILE  20   8.546   6.313   6.313
  156    H    ARG  21           HN       ARG  21  10.835   3.749   3.749
  157    HA   ARG  21           HA       ARG  21  11.226   4.748   4.748
  158   1HB   ARG  21           HBR      ARG  21  12.510   2.490   2.490
  159   2HB   ARG  21           HBS      ARG  21  12.487   2.526   2.526
  160   1HG   ARG  21           HGR      ARG  21  13.422   5.037   5.037
  161   2HG   ARG  21           HGS      ARG  21  14.424   3.628   3.628
  162   1HD   ARG  21           HDS      ARG  21  15.045   3.206   3.206
  163   2HD   ARG  21           HDR      ARG  21  13.589   3.978   3.978
  164    HE   ARG  21           HE       ARG  21  14.876   5.858   5.858
  165   1HH1  ARG  21           HH1      ARG  21  16.226   3.971   3.971
  166   2HH1  ARG  21           HH1      ARG  21  17.362   5.201   5.201
  167   1HH2  ARG  21           HH2      ARG  21  16.283   7.496   7.496
  168   2HH2  ARG  21           HH2      ARG  21  17.397   7.194   7.194
  169    H    LEU  22           HN       LEU  22   9.778   4.174   4.174
  170    HA   LEU  22           HA       LEU  22   8.592   1.452   1.452
  171   1HB   LEU  22           HBR      LEU  22   6.947   2.532   2.532
  172   2HB   LEU  22           HBS      LEU  22   6.690   2.687   2.687
  173    HG   LEU  22           HG       LEU  22   8.126   4.940   4.940
  174   1HD1  LEU  22           HMD      LEU  22   7.963   4.375   4.375
  175   2HD1  LEU  22           HMD      LEU  22   6.203   4.611   4.611
  176   3HD1  LEU  22           HMD      LEU  22   7.313   5.966   5.966
  177   1HD2  LEU  22           HMD      LEU  22   5.646   4.174   4.174
  178   2HD2  LEU  22           HMD      LEU  22   6.262   5.844   5.844
  179   3HD2  LEU  22           HMD      LEU  22   5.238   5.225   5.225
  180    H    ARG  23           HN       ARG  23   7.811   1.224   1.224
  181    HA   ARG  23           HA       ARG  23   9.362   2.452   2.452
  182   1HB   ARG  23           HBR      ARG  23  10.851   0.720   0.720
  183   2HB   ARG  23           HBS      ARG  23  11.303   1.197   1.197
  184   1HG   ARG  23           HGS      ARG  23   9.772  -0.908  -0.908
  185   2HG   ARG  23           HGR      ARG  23  10.262  -1.398  -1.398
  186   1HD   ARG  23           HDS      ARG  23  12.637  -0.803  -0.803
  187   2HD   ARG  23           HDR      ARG  23  11.965  -0.850  -0.850
  188    HE   ARG  23           HE       ARG  23  11.690  -3.183  -3.183
  189   1HH1  ARG  23           HH1      ARG  23  13.106  -1.744  -1.744
  190   2HH1  ARG  23           HH1      ARG  23  13.407  -3.275  -3.275
  191   1HH2  ARG  23           HH2      ARG  23  11.985  -5.163  -5.163
  192   2HH2  ARG  23           HH2      ARG  23  12.770  -5.212  -5.212
  193    HA   PRO  24           HA       PRO  24   5.468   0.169   0.169
  194   1HB   PRO  24           HBR      PRO  24   4.721   2.549   2.549
  195   2HB   PRO  24           HBS      PRO  24   3.922   1.732   1.732
  196   1HG   PRO  24           HGS      PRO  24   5.156   4.051   4.051
  197   2HG   PRO  24           HGR      PRO  24   4.699   3.029   3.029
  198   1HD   PRO  24           HDS      PRO  24   7.275   3.498   3.498
  199   2HD   PRO  24           HDR      PRO  24   6.850   2.839   2.839
  200    H    GLY  25           HN       GLY  25   7.903   1.755   1.755
  201   1HA   GLY  25           HAR      GLY  25   7.930  -0.459  -0.459
  202   2HA   GLY  25           HAS      GLY  25   7.577   1.105   1.105
  203    H    GLY  26           HN       GLY  26   9.558   0.806   0.806
  204   1HA   GLY  26           HAS      GLY  26  11.876   0.190   0.190
  205   2HA   GLY  26           HAR      GLY  26  12.043   0.870   0.870
  206    H    LYS  27           HN       LYS  27  12.591   1.386   1.386
  207    HA   LYS  27           HA       LYS  27  13.542   3.112   3.112
  208   1HB   LYS  27           HBS      LYS  27  14.464   3.192   3.192
  209   2HB   LYS  27           HBR      LYS  27  14.479   4.818   4.818
  210   1HG   LYS  27           HGS      LYS  27  16.631   3.539   3.539
  211   2HG   LYS  27           HGR      LYS  27  15.911   4.074   4.074
  212   1HD   LYS  27           HDR      LYS  27  16.060   2.007   2.007
  213   2HD   LYS  27           HDS      LYS  27  14.835   1.545   1.545
  214   1HE   LYS  27           HES      LYS  27  16.307   0.311   0.311
  215   2HE   LYS  27           HER      LYS  27  17.380   1.727   1.727
  216   1HZ   LYS  27           HZB      LYS  27  17.278   0.047   0.047
  217   2HZ   LYS  27           HZC      LYS  27  18.371  -0.141  -0.141
  218   3HZ   LYS  27           HZA      LYS  27  18.349   1.238   1.238
  219    H    LYS  28           HN       LYS  28  11.439   3.843   3.843
  220    HA   LYS  28           HA       LYS  28  11.284   6.721   6.721
  221   1HB   LYS  28           HBR      LYS  28   9.018   4.790   4.790
  222   2HB   LYS  28           HBS      LYS  28   8.698   6.358   6.358
  223   1HG   LYS  28           HGS      LYS  28   8.864   7.528   7.528
  224   2HG   LYS  28           HGR      LYS  28  10.176   6.496   6.496
  225   1HD   LYS  28           HDR      LYS  28   7.725   5.015   5.015
  226   2HD   LYS  28           HDS      LYS  28   7.393   6.516   6.516
  227   1HE   LYS  28           HES      LYS  28   8.330   5.751   5.751
  228   2HE   LYS  28           HER      LYS  28   9.839   5.375   5.375
  229   1HZ   LYS  28           HZA      LYS  28   7.525   3.607   3.607
  230   2HZ   LYS  28           HZB      LYS  28   8.544   3.492   3.492
  231   3HZ   LYS  28           HZC      LYS  28   9.103   3.266   3.266
  232    H    GLN  29           HN       GLN  29  10.536   7.986   7.986
  233    HA   GLN  29           HA       GLN  29  11.088   6.632   6.632
  234   1HB   GLN  29           HBS      GLN  29  11.855   9.440   9.440
  235   2HB   GLN  29           HBR      GLN  29  12.250   8.624   8.624
  236   1HG   GLN  29           HGS      GLN  29  14.126   7.880   7.880
  237   2HG   GLN  29           HGR      GLN  29  13.155   6.928   6.928
  238   1HE2  GLN  29           HE2      GLN  29  14.097  10.730  10.730
  239   2HE2  GLN  29           HE2      GLN  29  13.451  10.454  10.454
  240    H    TYR  30           HN       TYR  30   9.605   6.696   6.696
  241    HA   TYR  30           HA       TYR  30   7.226   8.145   8.145
  242   1HB   TYR  30           HBS      TYR  30   8.857   7.026   7.026
  243   2HB   TYR  30           HBR      TYR  30   7.302   7.862   7.862
  244    HD1  TYR  30           HD2      TYR  30   8.417   5.323   5.323
  245    HD2  TYR  30           HD1      TYR  30   5.797   6.215   6.215
  246    HE1  TYR  30           HE2      TYR  30   7.557   3.026   3.026
  247    HE2  TYR  30           HE1      TYR  30   4.960   3.904   3.904
  248    HH   TYR  30           HH       TYR  30   5.726   1.776   1.776
  249    H    LYS  31           HN       LYS  31   6.715  10.156  10.156
  250    HA   LYS  31           HA       LYS  31   7.989  11.691  11.691
  251   1HB   LYS  31           HBR      LYS  31   7.215  13.732  13.732
  252   2HB   LYS  31           HBS      LYS  31   8.686  12.875  12.875
  253   1HG   LYS  31           HGR      LYS  31   6.425  11.734  11.734
  254   2HG   LYS  31           HGS      LYS  31   6.330  13.512  13.512
  255   1HD   LYS  31           HDR      LYS  31   9.018  12.717  12.717
  256   2HD   LYS  31           HDS      LYS  31   8.017  11.670  11.670
  257   1HE   LYS  31           HER      LYS  31   7.286  14.521  14.521
  258   2HE   LYS  31           HES      LYS  31   8.898  14.133  14.133
  259   1HZ   LYS  31           HZA      LYS  31   7.676  12.365  12.365
  260   2HZ   LYS  31           HZB      LYS  31   6.290  13.131  13.131
  261   3HZ   LYS  31           HZC      LYS  31   7.427  13.908  13.908
  262    H    LEU  32           HN       LEU  32   6.493  13.571  13.571
  263    HA   LEU  32           HA       LEU  32   4.099  12.500  12.500
  264   1HB   LEU  32           HBS      LEU  32   5.620  14.455  14.455
  265   2HB   LEU  32           HBR      LEU  32   4.582  15.453  15.453
  266    HG   LEU  32           HG       LEU  32   2.650  14.969  14.969
  267   1HD1  LEU  32           HMD      LEU  32   3.160  12.628  12.628
  268   2HD1  LEU  32           HMD      LEU  32   4.450  13.160  13.160
  269   3HD1  LEU  32           HMD      LEU  32   2.750  13.557  13.557
  270   1HD2  LEU  32           HMD      LEU  32   5.110  15.652  15.652
  271   2HD2  LEU  32           HMD      LEU  32   4.013  16.774  16.774
  272   3HD2  LEU  32           HMD      LEU  32   3.439  15.865  15.865
  273    H    LYS  33           HN       LYS  33   4.802  13.628  13.628
  274    HA   LYS  33           HA       LYS  33   2.188  14.409  14.409
  275   1HB   LYS  33           HBS      LYS  33   4.241  14.810  14.810
  276   2HB   LYS  33           HBR      LYS  33   4.351  13.055  13.055
  277   1HG   LYS  33           HGR      LYS  33   2.858  13.175  13.175
  278   2HG   LYS  33           HGS      LYS  33   1.720  14.138  14.138
  279   1HD   LYS  33           HDR      LYS  33   3.932  15.776  15.776
  280   2HD   LYS  33           HDS      LYS  33   3.409  14.979  14.979
  281   1HE   LYS  33           HER      LYS  33   1.961  16.672  16.672
  282   2HE   LYS  33           HES      LYS  33   1.014  15.745  15.745
  283   1HZ   LYS  33           HZC      LYS  33   2.495  17.013  17.013
  284   2HZ   LYS  33           HZA      LYS  33   2.725  18.064  18.064
  285   3HZ   LYS  33           HZB      LYS  33   1.217  17.777  17.777
  286    H    HIS  34           HN       DHI  34   3.893  11.266  11.266
  287    HA   HIS  34           HA       DHI  34   1.521   9.918   9.918
  288   1HB   HIS  34           HBR      DHI  34   3.729   8.238   8.238
  289   2HB   HIS  34           HBS      DHI  34   2.794   8.094   8.094
  290    HD2  HIS  34           HD2      DHI  34   3.696  11.015  11.015
  291    HE1  HIS  34           HE1      DHI  34   7.660   9.748   9.748
  292    HE2  HIS  34           HE2      DHI  34   6.192  11.404  11.404
  293    H    ILE  35           HN       ILE  35   2.749  10.861  10.861
  294    HA   ILE  35           HA       ILE  35   0.926   9.275   9.275
  295    HB   ILE  35           HB       ILE  35   2.448  11.861  11.861
  296   1HG1  ILE  35           HG1      ILE  35   2.995   9.330   9.330
  297   2HG1  ILE  35           HG1      ILE  35   3.737  10.740  10.740
  298   1HG2  ILE  35           HMG      ILE  35  -0.037  11.400  11.400
  299   2HG2  ILE  35           HMG      ILE  35   1.391  12.081  12.081
  300   3HG2  ILE  35           HMG      ILE  35   0.711  12.901  12.901
  301   1HD1  ILE  35           HMD      ILE  35   1.921  10.473  10.473
  302   2HD1  ILE  35           HMD      ILE  35   1.596   8.884   8.884
  303   3HD1  ILE  35           HMD      ILE  35   3.208   9.239   9.239
  304    H    VAL  36           HN       VAL  36   0.704  12.607  12.607
  305    HA   VAL  36           HA       VAL  36  -1.981  12.893  12.893
  306    HB   VAL  36           HB       VAL  36  -0.373  14.421  14.421
  307   1HG1  VAL  36           HMG      VAL  36  -2.973  15.208  15.208
  308   2HG1  VAL  36           HMG      VAL  36  -1.957  16.272  16.272
  309   3HG1  VAL  36           HMG      VAL  36  -2.731  14.841  14.841
  310   1HG2  VAL  36           HMG      VAL  36   0.179  14.227  14.227
  311   2HG2  VAL  36           HMG      VAL  36   0.503  15.675  15.675
  312   3HG2  VAL  36           HMG      VAL  36  -0.963  15.593  15.593
  313    H    TRP  37           HN       TRP  37  -0.551  11.802  11.802
  314    HA   TRP  37           HA       TRP  37  -2.940  11.283  11.283
  315   1HB   TRP  37           HBR      TRP  37  -0.839  11.144  11.144
  316   2HB   TRP  37           HBS      TRP  37  -0.270   9.871   9.871
  317    HD1  TRP  37           HD1      TRP  37  -2.442  10.377  10.377
  318    HE1  TRP  37           HE1      TRP  37  -3.247   8.105   8.105
  319    HE3  TRP  37           HE3      TRP  37  -0.764   7.446   7.446
  320    HZ2  TRP  37           HZ2      TRP  37  -3.236   5.438   5.438
  321    HZ3  TRP  37           HZ3      TRP  37  -1.114   5.024   5.024
  322    HH2  TRP  37           HH2      TRP  37  -2.283   4.024   4.024
  323    H    ALA  38           HN       ALA  38  -1.222   9.415   9.415
  324    HA   ALA  38           HA       ALA  38  -2.694   6.941   6.941
  325   1HB   ALA  38           HMB      ALA  38  -0.885   7.965   7.965
  326   2HB   ALA  38           HMB      ALA  38  -1.633   6.347   6.347
  327   3HB   ALA  38           HMB      ALA  38  -0.487   6.796   6.796
  328    H    SER  39           HN       SER  39  -2.446   9.066   9.066
  329    HA   SER  39           HA       SER  39  -4.670   7.973   7.973
  330   1HB   SER  39           HBS      SER  39  -3.057   9.145   9.145
  331   2HB   SER  39           HBR      SER  39  -3.286  10.645  10.645
  332    HG   SER  39           HG       SER  39  -5.090  11.145  11.145
  333    H    ARG  40           HN       ARG  40  -4.514  10.280  10.280
  334    HA   ARG  40           HA       ARG  40  -7.254  11.194  11.194
  335   1HB   ARG  40           HBR      ARG  40  -5.166  11.155  11.155
  336   2HB   ARG  40           HBS      ARG  40  -6.880  11.436  11.436
  337   1HG   ARG  40           HGR      ARG  40  -6.972  13.451  13.451
  338   2HG   ARG  40           HGS      ARG  40  -5.518  13.070  13.070
  339   1HD   ARG  40           HDS      ARG  40  -4.605  14.526  14.526
  340   2HD   ARG  40           HDR      ARG  40  -4.405  13.020  13.020
  341    HE   ARG  40           HE       ARG  40  -6.472  15.100  15.100
  342   1HH1  ARG  40           HH1      ARG  40  -4.940  12.079  12.079
  343   2HH1  ARG  40           HH1      ARG  40  -5.443  12.230  12.230
  344   1HH2  ARG  40           HH2      ARG  40  -7.002  15.328  15.328
  345   2HH2  ARG  40           HH2      ARG  40  -6.611  14.068  14.068
  346    H    GLU  41           HN       GLU  41  -5.648   8.800   8.800
  347    HA   GLU  41           HA       GLU  41  -8.004   7.969   7.969
  348   1HB   GLU  41           HBS      GLU  41  -5.367   7.649   7.649
  349   2HB   GLU  41           HBR      GLU  41  -5.687   6.146   6.146
  350   1HG   GLU  41           HGS      GLU  41  -6.539   7.316   7.316
  351   2HG   GLU  41           HGR      GLU  41  -5.395   5.962   5.962
  352    H    LEU  42           HN       LEU  42  -6.614   7.085   7.085
  353    HA   LEU  42           HA       LEU  42  -8.146   4.665   4.665
  354   1HB   LEU  42           HBR      LEU  42  -6.107   5.175   5.175
  355   2HB   LEU  42           HBS      LEU  42  -6.811   6.725   6.725
  356    HG   LEU  42           HG       LEU  42  -8.653   4.835   4.835
  357   1HD1  LEU  42           HMD      LEU  42  -6.446   3.331   3.331
  358   2HD1  LEU  42           HMD      LEU  42  -6.126   3.795   3.795
  359   3HD1  LEU  42           HMD      LEU  42  -7.634   2.947   2.947
  360   1HD2  LEU  42           HMD      LEU  42  -6.662   6.643   6.643
  361   2HD2  LEU  42           HMD      LEU  42  -8.386   6.399   6.399
  362   3HD2  LEU  42           HMD      LEU  42  -7.162   5.298   5.298
  363    H    GLU  43           HN       GLU  43  -8.308   7.923   7.923
  364    HA   GLU  43           HA       GLU  43 -10.658   7.499   7.499
  365   1HB   GLU  43           HBS      GLU  43  -9.088   9.126   9.126
  366   2HB   GLU  43           HBR      GLU  43  -9.150   9.864   9.864
  367   1HG   GLU  43           HGR      GLU  43 -11.297   9.978   9.978
  368   2HG   GLU  43           HGS      GLU  43  -9.956  11.133  11.133
  369    H    ARG  44           HN       ARG  44 -10.144   8.406   8.406
  370    HA   ARG  44           HA       ARG  44 -13.012   8.972   8.972
  371   1HB   ARG  44           HBR      ARG  44 -10.637  10.004  10.004
  372   2HB   ARG  44           HBS      ARG  44 -11.420   9.082   9.082
  373   1HG   ARG  44           HGS      ARG  44 -12.847  11.176  11.176
  374   2HG   ARG  44           HGR      ARG  44 -12.018  11.532  11.532
  375   1HD   ARG  44           HDR      ARG  44 -13.826  10.921  10.921
  376   2HD   ARG  44           HDS      ARG  44 -13.642   9.269   9.269
  377    HE   ARG  44           HE       ARG  44 -15.350   9.704   9.704
  378   1HH1  ARG  44           HH1      ARG  44 -14.163  12.788  12.788
  379   2HH1  ARG  44           HH1      ARG  44 -15.554  13.664  13.664
  380   1HH2  ARG  44           HH2      ARG  44 -17.214  10.860  10.860
  381   2HH2  ARG  44           HH2      ARG  44 -17.281  12.574  12.574
  382    H    PHE  45           HN       PHE  45 -10.913   6.329   6.329
  383    HA   PHE  45           HA       PHE  45 -12.387   4.716   4.716
  384   1HB   PHE  45           HBS      PHE  45 -10.320   4.251   4.251
  385   2HB   PHE  45           HBR      PHE  45 -11.586   2.992   2.992
  386    HD1  PHE  45           HD1      PHE  45 -12.271   2.186   2.186
  387    HD2  PHE  45           HD2      PHE  45  -8.499   3.990   3.990
  388    HE1  PHE  45           HE1      PHE  45 -11.318   1.022   1.022
  389    HE2  PHE  45           HE2      PHE  45  -7.515   2.831   2.831
  390    HZ   PHE  45           HZ       PHE  45  -8.926   1.294   1.294
  391    H    ALA  46           HN       ALA  46 -12.350   4.767   4.767
  392    HA   ALA  46           HA       ALA  46 -15.284   4.701   4.701
  393   1HB   ALA  46           HMB      ALA  46 -13.499   2.329   2.329
  394   2HB   ALA  46           HMB      ALA  46 -14.750   2.333   2.333
  395   3HB   ALA  46           HMB      ALA  46 -15.216   2.509   2.509
  396    H    VAL  47           HN       VAL  47 -12.633   5.961   5.961
  397    HA   VAL  47           HA       VAL  47 -12.725   4.897   4.897
  398    HB   VAL  47           HB       VAL  47 -10.286   5.763   5.763
  399   1HG1  VAL  47           HMG      VAL  47 -10.659   4.333   4.333
  400   2HG1  VAL  47           HMG      VAL  47  -9.138   4.272   4.272
  401   3HG1  VAL  47           HMG      VAL  47  -9.763   5.833   5.833
  402   1HG2  VAL  47           HMG      VAL  47 -11.315   3.905   3.905
  403   2HG2  VAL  47           HMG      VAL  47  -9.819   3.383   3.383
  404   3HG2  VAL  47           HMG      VAL  47 -11.401   2.974   2.974
  405    H    ASN  48           HN       ASN  48 -11.518   6.261   6.261
  406    HA   ASN  48           HA       ASN  48 -11.963   9.149   9.149
  407   1HB   ASN  48           HBR      ASN  48 -13.562   8.474   8.474
  408   2HB   ASN  48           HBS      ASN  48 -12.288   7.677   7.677
  409   1HD2  ASN  48           HD2      ASN  48 -13.240  11.446  11.446
  410   2HD2  ASN  48           HD2      ASN  48 -14.236  10.282  10.282
  411    HA   PRO  49           HA       PRO  49  -7.818   9.568   9.568
  412   1HB   PRO  49           HBR      PRO  49  -7.596  12.187  12.187
  413   2HB   PRO  49           HBS      PRO  49  -8.002  11.533  11.533
  414   1HG   PRO  49           HGS      PRO  49  -9.626  12.914  12.914
  415   2HG   PRO  49           HGR      PRO  49  -9.909  12.573  12.573
  416   1HD   PRO  49           HDR      PRO  49 -11.019  11.315  11.315
  417   2HD   PRO  49           HDS      PRO  49 -11.213  10.906  10.906
  418    H    GLY  50           HN       GLY  50  -8.753  11.621  11.621
  419   1HA   GLY  50           HAS      GLY  50  -6.600  11.188  11.188
  420   2HA   GLY  50           HAR      GLY  50  -8.231  11.548  11.548
  421    H    LEU  51           HN       LEU  51  -9.230   9.077   9.077
  422    HA   LEU  51           HA       LEU  51  -9.134   7.219   7.219
  423   1HB   LEU  51           HBR      LEU  51 -10.836   7.780   7.780
  424   2HB   LEU  51           HBS      LEU  51  -9.903   6.523   6.523
  425    HG   LEU  51           HG       LEU  51 -11.448   6.204   6.204
  426   1HD1  LEU  51           HMD      LEU  51 -12.108   5.855   5.855
  427   2HD1  LEU  51           HMD      LEU  51 -12.437   4.420   4.420
  428   3HD1  LEU  51           HMD      LEU  51 -13.169   5.989   5.989
  429   1HD2  LEU  51           HMD      LEU  51  -9.691   4.353   4.353
  430   2HD2  LEU  51           HMD      LEU  51  -9.598   4.748   4.748
  431   3HD2  LEU  51           HMD      LEU  51 -10.938   3.748   3.748
  432    H    LEU  52           HN       LEU  52  -7.705   7.329   7.329
  433    HA   LEU  52           HA       LEU  52  -5.957   5.174   5.174
  434   1HB   LEU  52           HBR      LEU  52  -6.090   4.958   4.958
  435   2HB   LEU  52           HBS      LEU  52  -7.009   6.475   6.475
  436    HG   LEU  52           HG       LEU  52  -5.247   6.358   6.358
  437   1HD1  LEU  52           HMD      LEU  52  -5.882   8.549   8.549
  438   2HD1  LEU  52           HMD      LEU  52  -4.497   8.396   8.396
  439   3HD1  LEU  52           HMD      LEU  52  -4.225   8.486   8.486
  440   1HD2  LEU  52           HMD      LEU  52  -3.800   4.974   4.974
  441   2HD2  LEU  52           HMD      LEU  52  -3.049   5.950   5.950
  442   3HD2  LEU  52           HMD      LEU  52  -3.129   6.581   6.581
  443    H    GLU  53           HN       GLU  53  -5.711   8.567   8.567
  444    HA   GLU  53           HA       GLU  53  -2.889   8.940   8.940
  445   1HB   GLU  53           HBS      GLU  53  -4.406  10.684  10.684
  446   2HB   GLU  53           HBR      GLU  53  -5.231  10.168  10.168
  447   1HG   GLU  53           HGR      GLU  53  -2.455  10.885  10.885
  448   2HG   GLU  53           HGS      GLU  53  -3.437  12.132  12.132
  449    H    THR  54           HN       THR  54  -5.107   7.738   7.738
  450    HA   THR  54           HA       THR  54  -2.939   7.022   7.022
  451    HB   THR  54           HB       THR  54  -4.592   5.914   5.914
  452    HG1  THR  54           HG1      THR  54  -6.162   6.314   6.314
  453   1HG2  THR  54           HMG      THR  54  -5.037   8.583   8.583
  454   2HG2  THR  54           HMG      THR  54  -6.621   7.805   7.805
  455   3HG2  THR  54           HMG      THR  54  -5.424   7.836   7.836
  456    H    SER  55           HN       SER  55  -2.392   4.845   4.845
  457    HA   SER  55           HA       SER  55  -1.941   2.928   2.928
  458   1HB   SER  55           HBS      SER  55  -2.089   1.424   1.424
  459   2HB   SER  55           HBR      SER  55  -0.645   2.325   2.325
  460    HG   SER  55           HG       SER  55  -0.802   3.773   3.773
  461    H    GLU  56           HN       GLU  56  -4.660   3.462   3.462
  462    HA   GLU  56           HA       GLU  56  -5.676   0.803   0.803
  463   1HB   GLU  56           HBS      GLU  56  -6.006   3.008   3.008
  464   2HB   GLU  56           HBR      GLU  56  -7.337   3.264   3.264
  465   1HG   GLU  56           HGR      GLU  56  -7.823   0.735   0.735
  466   2HG   GLU  56           HGS      GLU  56  -6.831   1.516   1.516
  467    H    GLY  57           HN       GLY  57  -6.581   3.787   3.787
  468   1HA   GLY  57           HAR      GLY  57  -8.609   2.515   2.515
  469   2HA   GLY  57           HAS      GLY  57  -7.906   4.134   4.134
  470    H    CYS  58           HN       CYS  58  -5.216   3.487   3.487
  471    HA   CYS  58           HA       CYS  58  -4.873   2.507   2.507
  472   1HB   CYS  58           HBR      CYS  58  -3.278   3.739   3.739
  473   2HB   CYS  58           HBS      CYS  58  -2.685   2.068   2.068
  474    H    ARG  59           HN       ARG  59  -5.211   0.823   0.823
  475    HA   ARG  59           HA       ARG  59  -4.517  -1.719  -1.719
  476   1HB   ARG  59           HBR      ARG  59  -4.662  -0.660  -0.660
  477   2HB   ARG  59           HBS      ARG  59  -6.100  -1.714  -1.714
  478   1HG   ARG  59           HGR      ARG  59  -4.437  -3.512  -3.512
  479   2HG   ARG  59           HGS      ARG  59  -3.183  -2.442  -2.442
  480   1HD   ARG  59           HDS      ARG  59  -4.211  -2.568  -2.568
  481   2HD   ARG  59           HDR      ARG  59  -5.554  -3.544  -3.544
  482    HE   ARG  59           HE       ARG  59  -3.104  -4.557  -4.557
  483   1HH1  ARG  59           HH1      ARG  59  -5.385  -4.970  -4.970
  484   2HH1  ARG  59           HH1      ARG  59  -4.777  -6.536  -6.536
  485   1HH2  ARG  59           HH2      ARG  59  -2.254  -6.550  -6.550
  486   2HH2  ARG  59           HH2      ARG  59  -3.008  -7.432  -7.432
  487    H    GLN  60           HN       GLN  60  -7.494   0.066   0.066
  488    HA   GLN  60           HA       GLN  60  -9.269  -2.270  -2.270
  489   1HB   GLN  60           HBS      GLN  60  -9.967  -0.254  -0.254
  490   2HB   GLN  60           HBR      GLN  60  -9.983   0.663   0.663
  491   1HG   GLN  60           HGS      GLN  60 -11.511  -1.883  -1.883
  492   2HG   GLN  60           HGR      GLN  60 -12.142  -0.549  -0.549
  493   1HE2  GLN  60           HE2      GLN  60 -12.606   1.659   1.659
  494   2HE2  GLN  60           HE2      GLN  60 -11.856   1.670   1.670
  495    H    ILE  61           HN       ILE  61  -7.586   0.206   0.206
  496    HA   ILE  61           HA       ILE  61  -8.746  -0.516  -0.516
  497    HB   ILE  61           HB       ILE  61  -6.197   1.035   1.035
  498   1HG1  ILE  61           HG1      ILE  61  -7.926   2.339   2.339
  499   2HG1  ILE  61           HG1      ILE  61  -7.632   2.968   2.968
  500   1HG2  ILE  61           HMG      ILE  61  -6.255  -0.145  -0.145
  501   2HG2  ILE  61           HMG      ILE  61  -7.485   1.072   1.072
  502   3HG2  ILE  61           HMG      ILE  61  -5.855   1.592   1.592
  503   1HD1  ILE  61           HMD      ILE  61  -9.792   0.925   0.925
  504   2HD1  ILE  61           HMD      ILE  61 -10.061   2.655   2.655
  505   3HD1  ILE  61           HMD      ILE  61  -9.642   2.124   2.124
  506    H    LEU  62           HN       LEU  62  -5.486  -1.072  -1.072
  507    HA   LEU  62           HA       LEU  62  -4.562  -2.397  -2.397
  508   1HB   LEU  62           HBR      LEU  62  -3.332  -1.299  -1.299
  509   2HB   LEU  62           HBS      LEU  62  -3.510  -2.872  -2.872
  510    HG   LEU  62           HG       LEU  62  -2.147  -3.954  -3.954
  511   1HD1  LEU  62           HMD      LEU  62  -2.925  -2.406  -2.406
  512   2HD1  LEU  62           HMD      LEU  62  -1.689  -1.263  -1.263
  513   3HD1  LEU  62           HMD      LEU  62  -1.207  -2.876  -2.876
  514   1HD2  LEU  62           HMD      LEU  62  -1.198  -1.445  -1.445
  515   2HD2  LEU  62           HMD      LEU  62  -0.813  -3.148  -3.148
  516   3HD2  LEU  62           HMD      LEU  62  -0.077  -2.345  -2.345
  517    H    GLY  63           HN       GLY  63  -6.487  -3.563  -3.563
  518   1HA   GLY  63           HAS      GLY  63  -6.215  -6.362  -6.362
  519   2HA   GLY  63           HAR      GLY  63  -7.406  -5.653  -5.653
  520    H    GLN  64           HN       GLN  64  -8.853  -3.942  -3.942
  521    HA   GLN  64           HA       GLN  64 -10.493  -5.555  -5.555
  522   1HB   GLN  64           HBS      GLN  64 -10.764  -3.107  -3.107
  523   2HB   GLN  64           HBR      GLN  64 -10.778  -2.694  -2.694
  524   1HG   GLN  64           HGR      GLN  64 -13.037  -3.076  -3.076
  525   2HG   GLN  64           HGS      GLN  64 -12.570  -4.321  -4.321
  526   1HE2  GLN  64           HE2      GLN  64 -13.566  -6.869  -6.869
  527   2HE2  GLN  64           HE2      GLN  64 -13.397  -6.192  -6.192
  528    H    LEU  65           HN       LEU  65  -7.541  -4.089  -4.089
  529    HA   LEU  65           HA       LEU  65  -8.289  -3.392  -3.392
  530   1HB   LEU  65           HBR      LEU  65  -7.315  -1.848  -1.848
  531   2HB   LEU  65           HBS      LEU  65  -5.778  -2.723  -2.723
  532    HG   LEU  65           HG       LEU  65  -5.958  -2.039  -2.039
  533   1HD1  LEU  65           HMD      LEU  65  -8.260  -0.590  -0.590
  534   2HD1  LEU  65           HMD      LEU  65  -7.215   0.345   0.345
  535   3HD1  LEU  65           HMD      LEU  65  -7.993  -1.153  -1.153
  536   1HD2  LEU  65           HMD      LEU  65  -5.133  -0.645  -0.645
  537   2HD2  LEU  65           HMD      LEU  65  -4.314  -0.785  -0.785
  538   3HD2  LEU  65           HMD      LEU  65  -5.519   0.500   0.500
  539    H    GLN  66           HN       GLN  66  -5.971  -5.348  -5.348
  540    HA   GLN  66           HA       GLN  66  -4.360  -6.208  -6.208
  541   1HB   GLN  66           HBR      GLN  66  -4.912  -7.088  -7.088
  542   2HB   GLN  66           HBS      GLN  66  -4.842  -8.514  -8.514
  543   1HG   GLN  66           HGS      GLN  66  -2.685  -6.724  -6.724
  544   2HG   GLN  66           HGR      GLN  66  -2.700  -7.044  -7.044
  545   1HE2  GLN  66           HE2      GLN  66  -2.621 -10.427 -10.427
  546   2HE2  GLN  66           HE2      GLN  66  -3.889  -9.255  -9.255
  547    HA   PRO  67           HA       PRO  67  -7.768  -9.527  -9.527
  548   1HB   PRO  67           HBR      PRO  67 -10.069  -8.525  -8.525
  549   2HB   PRO  67           HBS      PRO  67  -9.503 -10.066 -10.066
  550   1HG   PRO  67           HGR      PRO  67  -9.501  -8.434  -8.434
  551   2HG   PRO  67           HGS      PRO  67  -8.586  -9.821  -9.821
  552   1HD   PRO  67           HDS      PRO  67  -7.754  -7.139  -7.139
  553   2HD   PRO  67           HDR      PRO  67  -6.840  -8.476  -8.476
  554    H    SER  68           HN       SER  68  -8.556  -6.204  -6.204
  555    HA   SER  68           HA       SER  68 -10.389  -6.142  -6.142
  556   1HB   SER  68           HBS      SER  68 -10.803  -4.830  -4.830
  557   2HB   SER  68           HBR      SER  68  -9.344  -3.853  -3.853
  558    HG   SER  68           HG       SER  68 -11.692  -4.279  -4.279
  559    H    LEU  69           HN       LEU  69  -7.047  -6.021  -6.021
  560    HA   LEU  69           HA       LEU  69  -6.461  -4.260  -4.260
  561   1HB   LEU  69           HBR      LEU  69  -4.962  -6.572  -6.572
  562   2HB   LEU  69           HBS      LEU  69  -4.255  -5.440  -5.440
  563    HG   LEU  69           HG       LEU  69  -5.307  -4.721  -4.721
  564   1HD1  LEU  69           HMD      LEU  69  -2.862  -5.877  -5.877
  565   2HD1  LEU  69           HMD      LEU  69  -2.521  -4.137  -4.137
  566   3HD1  LEU  69           HMD      LEU  69  -3.244  -5.048  -5.048
  567   1HD2  LEU  69           HMD      LEU  69  -3.968  -3.111  -3.111
  568   2HD2  LEU  69           HMD      LEU  69  -5.650  -2.958  -2.958
  569   3HD2  LEU  69           HMD      LEU  69  -4.301  -2.519  -2.519
  570    H    GLN  70           HN       GLN  70  -7.134  -7.735  -7.735
  571    HA   GLN  70           HA       GLN  70  -6.724  -8.290  -8.290
  572   1HB   GLN  70           HBR      GLN  70  -7.935 -10.293 -10.293
  573   2HB   GLN  70           HBS      GLN  70  -6.925 -10.033 -10.033
  574   1HG   GLN  70           HGS      GLN  70  -8.706 -10.222 -10.222
  575   2HG   GLN  70           HGR      GLN  70  -9.489  -8.857  -8.857
  576   1HE2  GLN  70           HE2      GLN  70 -10.164 -12.506 -12.506
  577   2HE2  GLN  70           HE2      GLN  70  -8.559 -11.925 -11.925
  578    H    THR  71           HN       THR  71  -9.050  -6.440  -6.440
  579    HA   THR  71           HA       THR  71 -11.029  -6.778  -6.778
  580    HB   THR  71           HB       THR  71 -12.749  -6.216  -6.216
  581    HG1  THR  71           HG1      THR  71 -10.640  -5.721  -5.721
  582   1HG2  THR  71           HMG      THR  71 -11.612  -8.498  -8.498
  583   2HG2  THR  71           HMG      THR  71 -10.918  -7.816  -7.816
  584   3HG2  THR  71           HMG      THR  71 -12.687  -7.919  -7.919
  585    H    GLY  72           HN       GLY  72  -8.782  -4.559  -4.559
  586   1HA   GLY  72           HAR      GLY  72 -10.462  -2.176  -2.176
  587   2HA   GLY  72           HAS      GLY  72  -8.911  -2.256  -2.256
  588    H    SER  73           HN       SER  73  -6.974  -2.754  -2.754
  589    HA   SER  73           HA       SER  73  -6.873  -2.908  -2.908
  590   1HB   SER  73           HBS      SER  73  -5.963  -0.653  -0.653
  591   2HB   SER  73           HBR      SER  73  -7.727  -0.736  -0.736
  592    HG   SER  73           HG       SER  73  -7.378   0.974   0.974
  593    H    GLU  74           HN       GLU  74  -4.638  -2.400  -2.400
  594    HA   GLU  74           HA       GLU  74  -2.412  -2.972  -2.972
  595   1HB   GLU  74           HBS      GLU  74  -2.810  -1.746  -1.746
  596   2HB   GLU  74           HBR      GLU  74  -1.269  -1.809  -1.809
  597   1HG   GLU  74           HGR      GLU  74  -2.104  -4.462  -4.462
  598   2HG   GLU  74           HGS      GLU  74  -2.885  -3.694  -3.694
  599    H    GLU  75           HN       GLU  75  -4.407  -0.246  -0.246
  600    HA   GLU  75           HA       GLU  75  -2.572   1.753   1.753
  601   1HB   GLU  75           HBS      GLU  75  -5.471   2.114   2.114
  602   2HB   GLU  75           HBR      GLU  75  -4.314   3.211   3.211
  603   1HG   GLU  75           HGR      GLU  75  -4.370   1.194   1.194
  604   2HG   GLU  75           HGS      GLU  75  -6.033   1.464   1.464
  605    H    LEU  76           HN       LEU  76  -5.119  -0.197  -0.197
  606    HA   LEU  76           HA       LEU  76  -4.976   1.035   1.035
  607   1HB   LEU  76           HBS      LEU  76  -6.447  -0.984  -0.984
  608   2HB   LEU  76           HBR      LEU  76  -5.571  -1.794  -1.794
  609    HG   LEU  76           HG       LEU  76  -7.653   0.388   0.388
  610   1HD1  LEU  76           HMD      LEU  76  -7.549  -2.497  -2.497
  611   2HD1  LEU  76           HMD      LEU  76  -8.116  -1.669  -1.669
  612   3HD1  LEU  76           HMD      LEU  76  -8.951  -1.399  -1.399
  613   1HD2  LEU  76           HMD      LEU  76  -5.709   0.845   0.845
  614   2HD2  LEU  76           HMD      LEU  76  -7.230   0.505   0.505
  615   3HD2  LEU  76           HMD      LEU  76  -5.969  -0.750  -0.750
  616    H    ARG  77           HN       ARG  77  -3.111  -1.227  -1.227
  617    HA   ARG  77           HA       ARG  77  -1.767  -2.567  -2.567
  618   1HB   ARG  77           HBR      ARG  77  -1.931  -3.045  -3.045
  619   2HB   ARG  77           HBS      ARG  77  -0.390  -2.140  -2.140
  620   1HG   ARG  77           HGS      ARG  77   0.076  -3.881  -3.881
  621   2HG   ARG  77           HGR      ARG  77  -1.018  -4.859  -4.859
  622   1HD   ARG  77           HDR      ARG  77   0.514  -5.132  -5.132
  623   2HD   ARG  77           HDS      ARG  77   1.024  -3.422  -3.422
  624    HE   ARG  77           HE       ARG  77   2.045  -5.608  -5.608
  625   1HH1  ARG  77           HH1      ARG  77   2.210  -2.250  -2.250
  626   2HH1  ARG  77           HH1      ARG  77   3.858  -2.059  -2.059
  627   1HH2  ARG  77           HH2      ARG  77   4.234  -5.357  -5.357
  628   2HH2  ARG  77           HH2      ARG  77   5.002  -3.815  -3.815
  629    H    SER  78           HN       SER  78  -0.798   0.165   0.165
  630    HA   SER  78           HA       SER  78   1.523   0.927   0.927
  631   1HB   SER  78           HBR      SER  78   0.322   1.780   1.780
  632   2HB   SER  78           HBS      SER  78   0.012   3.127   3.127
  633    HG   SER  78           HG       SER  78   2.043   3.559   3.559
  634    H    LEU  79           HN       LEU  79  -1.936   1.672   1.672
  635    HA   LEU  79           HA       LEU  79  -1.853   3.425   3.425
  636   1HB   LEU  79           HBR      LEU  79  -3.733   2.366   2.366
  637   2HB   LEU  79           HBS      LEU  79  -4.005   1.375   1.375
  638    HG   LEU  79           HG       LEU  79  -4.646   3.240   3.240
  639   1HD1  LEU  79           HMD      LEU  79  -3.747   4.987   4.987
  640   2HD1  LEU  79           HMD      LEU  79  -4.546   5.546   5.546
  641   3HD1  LEU  79           HMD      LEU  79  -2.920   4.822   4.822
  642   1HD2  LEU  79           HMD      LEU  79  -5.707   3.173   3.173
  643   2HD2  LEU  79           HMD      LEU  79  -6.452   2.591   2.591
  644   3HD2  LEU  79           HMD      LEU  79  -6.349   4.339   4.339
  645    H    TYR  80           HN       TYR  80  -1.304  -0.014  -0.014
  646    HA   TYR  80           HA       TYR  80  -1.865  -0.435  -0.435
  647   1HB   TYR  80           HBS      TYR  80  -2.640  -2.083  -2.083
  648   2HB   TYR  80           HBR      TYR  80  -0.983  -2.324  -2.324
  649    HD1  TYR  80           HD1      TYR  80  -3.264  -2.986  -2.986
  650    HD2  TYR  80           HD2      TYR  80   0.617  -3.646  -3.646
  651    HE1  TYR  80           HE1      TYR  80  -2.818  -4.634  -4.634
  652    HE2  TYR  80           HE2      TYR  80   1.090  -5.265  -5.265
  653    HH   TYR  80           HH       TYR  80  -0.728  -6.867  -6.867
  654    H    ASN  81           HN       ASN  81   0.884   0.106   0.106
  655    HA   ASN  81           HA       ASN  81   2.793  -0.626  -0.626
  656   1HB   ASN  81           HBS      ASN  81   4.484   0.244   0.244
  657   2HB   ASN  81           HBR      ASN  81   3.327  -0.666  -0.666
  658   1HD2  ASN  81           HD2      ASN  81   3.816   2.047   2.047
  659   2HD2  ASN  81           HD2      ASN  81   4.351   0.451   0.451
  660    H    THR  82           HN       THR  82   1.137   2.335   2.335
  661    HA   THR  82           HA       THR  82   2.653   3.993   3.993
  662    HB   THR  82           HB       THR  82   0.103   5.235   5.235
  663    HG1  THR  82           HG1      THR  82   1.402   3.965   3.965
  664   1HG2  THR  82           HMG      THR  82   2.913   5.724   5.724
  665   2HG2  THR  82           HMG      THR  82   1.838   6.283   6.283
  666   3HG2  THR  82           HMG      THR  82   1.581   6.852   6.852
  667    H    ILE  83           HN       ILE  83  -0.426   2.282   2.282
  668    HA   ILE  83           HA       ILE  83  -1.057   3.344   3.344
  669    HB   ILE  83           HB       ILE  83  -2.104   1.128   1.128
  670   1HG1  ILE  83           HG1      ILE  83  -2.819   3.373   3.373
  671   2HG1  ILE  83           HG1      ILE  83  -4.186   2.438   2.438
  672   1HG2  ILE  83           HMG      ILE  83  -2.165   0.765   0.765
  673   2HG2  ILE  83           HMG      ILE  83  -3.790   1.290   1.290
  674   3HG2  ILE  83           HMG      ILE  83  -3.037  -0.141  -0.141
  675   1HD1  ILE  83           HMD      ILE  83  -2.695   3.655   3.655
  676   2HD1  ILE  83           HMD      ILE  83  -3.112   4.901   4.901
  677   3HD1  ILE  83           HMD      ILE  83  -4.399   3.914   3.914
  678    H    ALA  84           HN       ALA  84   0.402   0.229   0.229
  679    HA   ALA  84           HA       ALA  84   0.738  -0.751  -0.751
  680   1HB   ALA  84           HMB      ALA  84   2.304  -1.388  -1.388
  681   2HB   ALA  84           HMB      ALA  84   2.404  -2.296  -2.296
  682   3HB   ALA  84           HMB      ALA  84   0.867  -2.229  -2.229
  683    H    VAL  85           HN       VAL  85   2.807   1.299   1.299
  684    HA   VAL  85           HA       VAL  85   4.984   1.477   1.477
  685    HB   VAL  85           HB       VAL  85   4.044   3.256   3.256
  686   1HG1  VAL  85           HMG      VAL  85   5.475   4.282   4.282
  687   2HG1  VAL  85           HMG      VAL  85   6.781   3.683   3.683
  688   3HG1  VAL  85           HMG      VAL  85   5.587   4.838   4.838
  689   1HG2  VAL  85           HMG      VAL  85   5.070   0.948   0.948
  690   2HG2  VAL  85           HMG      VAL  85   5.756   2.340   2.340
  691   3HG2  VAL  85           HMG      VAL  85   6.599   1.680   1.680
  692    H    LEU  86           HN       LEU  86   2.194   3.632   3.632
  693    HA   LEU  86           HA       LEU  86   2.875   5.483   5.483
  694   1HB   LEU  86           HBR      LEU  86   1.260   5.574   5.574
  695   2HB   LEU  86           HBS      LEU  86   0.039   4.987   4.987
  696    HG   LEU  86           HG       LEU  86   0.100   6.964   6.964
  697   1HD1  LEU  86           HMD      LEU  86   2.594   7.224   7.224
  698   2HD1  LEU  86           HMD      LEU  86   2.468   7.912   7.912
  699   3HD1  LEU  86           HMD      LEU  86   1.697   8.739   8.739
  700   1HD2  LEU  86           HMD      LEU  86   0.363   7.510   7.510
  701   2HD2  LEU  86           HMD      LEU  86  -1.124   7.194   7.194
  702   3HD2  LEU  86           HMD      LEU  86  -0.220   8.710   8.710
  703    H    TYR  87           HN       TYR  87   1.028   2.497   2.497
  704    HA   TYR  87           HA       TYR  87   0.588   2.600   2.600
  705   1HB   TYR  87           HBS      TYR  87  -0.382   0.922   0.922
  706   2HB   TYR  87           HBR      TYR  87   1.168   0.037   0.037
  707    HD1  TYR  87           HD1      TYR  87   1.912  -0.125  -0.125
  708    HD2  TYR  87           HD2      TYR  87  -2.085   0.374   0.374
  709    HE1  TYR  87           HE1      TYR  87   1.082  -0.854  -0.854
  710    HE2  TYR  87           HE2      TYR  87  -2.921  -0.227  -0.227
  711    HH   TYR  87           HH       TYR  87  -1.498  -2.183  -2.183
  712    H    CYS  88           HN       CYS  88   3.338   1.403   1.403
  713    HA   CYS  88           HA       CYS  88   4.969   0.444   0.444
  714   1HB   CYS  88           HBS      CYS  88   5.144   0.875   0.875
  715   2HB   CYS  88           HBR      CYS  88   6.411   1.930   1.930
  716    H    VAL  89           HN       VAL  89   4.321   3.724   3.724
  717    HA   VAL  89           HA       VAL  89   6.535   4.797   4.797
  718    HB   VAL  89           HB       VAL  89   4.443   6.358   6.358
  719   1HG1  VAL  89           HMG      VAL  89   6.336   7.351   7.351
  720   2HG1  VAL  89           HMG      VAL  89   7.312   7.153   7.153
  721   3HG1  VAL  89           HMG      VAL  89   5.838   8.149   8.149
  722   1HG2  VAL  89           HMG      VAL  89   6.266   4.442   4.442
  723   2HG2  VAL  89           HMG      VAL  89   5.096   5.496   5.496
  724   3HG2  VAL  89           HMG      VAL  89   6.750   6.076   6.076
  725    H    HIS  90           HN       HIS  90   2.989   4.742   4.742
  726    HA   HIS  90           HA       HIS  90   2.703   6.666   6.666
  727   1HB   HIS  90           HBS      HIS  90   0.821   4.416   4.416
  728   2HB   HIS  90           HBR      HIS  90   0.436   5.675   5.675
  729    HD1  HIS  90           HD1      HIS  90   1.610   8.155   8.155
  730    HD2  HIS  90           HD2      HIS  90  -0.825   5.195   5.195
  731    HE1  HIS  90           HE1      HIS  90   0.484   9.180   9.180
  732    HE2  HIS  90           HE2      HIS  90  -1.077   7.430   7.430
  733    H    GLN  91           HN       GLN  91   3.359   3.223   3.223
  734    HA   GLN  91           HA       GLN  91   3.111   2.694   2.694
  735   1HB   GLN  91           HBR      GLN  91   4.647   1.386   1.386
  736   2HB   GLN  91           HBS      GLN  91   4.840   0.889   0.889
  737   1HG   GLN  91           HGR      GLN  91   2.328   0.807   0.807
  738   2HG   GLN  91           HGS      GLN  91   3.266  -0.577  -0.577
  739   1HE2  GLN  91           HE2      GLN  91   0.605   1.488   1.488
  740   2HE2  GLN  91           HE2      GLN  91   1.159   2.125   2.125
  741    H    ARG  92           HN       ARG  92   5.944   3.450   3.450
  742    HA   ARG  92           HA       ARG  92   7.601   4.761   4.761
  743   1HB   ARG  92           HBR      ARG  92   7.256   3.083   3.083
  744   2HB   ARG  92           HBS      ARG  92   7.805   1.800   1.800
  745   1HG   ARG  92           HGS      ARG  92   9.573   2.350   2.350
  746   2HG   ARG  92           HGR      ARG  92  10.028   2.898   2.898
  747   1HD   ARG  92           HDR      ARG  92  10.584   4.535   4.535
  748   2HD   ARG  92           HDS      ARG  92   9.411   5.159   5.159
  749    HE   ARG  92           HE       ARG  92   8.010   5.541   5.541
  750   1HH1  ARG  92           HH1      ARG  92  10.252   2.990   2.990
  751   2HH1  ARG  92           HH1      ARG  92   9.454   2.701   2.701
  752   1HH2  ARG  92           HH2      ARG  92   6.914   5.039   5.039
  753   2HH2  ARG  92           HH2      ARG  92   7.566   3.861   3.861
  754    H    ILE  93           HN       ILE  93   7.153   2.081   2.081
  755    HA   ILE  93           HA       ILE  93   9.988   1.556   1.556
  756    HB   ILE  93           HB       ILE  93   7.563   0.654   0.654
  757   1HG1  ILE  93           HG1      ILE  93   8.054  -1.496  -1.496
  758   2HG1  ILE  93           HG1      ILE  93   8.517  -0.187  -0.187
  759   1HG2  ILE  93           HMG      ILE  93  10.415  -0.241  -0.241
  760   2HG2  ILE  93           HMG      ILE  93   9.134  -1.421  -1.421
  761   3HG2  ILE  93           HMG      ILE  93   9.356   0.017   0.017
  762   1HD1  ILE  93           HMD      ILE  93   5.916   0.033   0.033
  763   2HD1  ILE  93           HMD      ILE  93   6.043  -1.113  -1.113
  764   3HD1  ILE  93           HMD      ILE  93   6.378   0.620   0.620
  765    H    ASP  94           HN       ASP  94  11.164   2.234   2.234
  766    HA   ASP  94           HA       ASP  94   9.770   3.799   3.799
  767   1HB   ASP  94           HBS      ASP  94  11.490   5.381   5.381
  768   2HB   ASP  94           HBR      ASP  94  10.952   5.458   5.458
  769    H    VAL  95           HN       VAL  95  10.565   3.530   3.530
  770    HA   VAL  95           HA       VAL  95  12.394   1.208   1.208
  771    HB   VAL  95           HB       VAL  95  10.836   0.104   0.104
  772   1HG1  VAL  95           HMG      VAL  95   9.379   1.528   1.528
  773   2HG1  VAL  95           HMG      VAL  95   8.698   0.160   0.160
  774   3HG1  VAL  95           HMG      VAL  95  10.189  -0.056  -0.056
  775   1HG2  VAL  95           HMG      VAL  95   9.848   2.735   2.735
  776   2HG2  VAL  95           HMG      VAL  95   9.708   1.173   1.173
  777   3HG2  VAL  95           HMG      VAL  95   8.526   1.615   1.615
  778    H    LYS  96           HN       LYS  96  12.393   0.868   0.868
  779    HA   LYS  96           HA       LYS  96  13.956   3.272   3.272
  780   1HB   LYS  96           HBS      LYS  96  14.726   0.467   0.467
  781   2HB   LYS  96           HBR      LYS  96  15.655   1.985   1.985
  782   1HG   LYS  96           HGS      LYS  96  15.075   0.437   0.437
  783   2HG   LYS  96           HGR      LYS  96  16.653   0.637   0.637
  784   1HD   LYS  96           HDR      LYS  96  15.946   3.208   3.208
  785   2HD   LYS  96           HDS      LYS  96  15.084   2.504   2.504
  786   1HE   LYS  96           HES      LYS  96  17.478   1.301   1.301
  787   2HE   LYS  96           HER      LYS  96  17.980   2.808   2.808
  788   1HZ   LYS  96           HZB      LYS  96  16.182   2.853   2.853
  789   2HZ   LYS  96           HZC      LYS  96  17.803   2.814   2.814
  790   3HZ   LYS  96           HZA      LYS  96  17.106   4.059   4.059
  791    H    ASP  97           HN       ASP  97  12.646   0.156   0.156
  792    HA   ASP  97           HA       ASP  97  11.167   1.717   1.717
  793   1HB   ASP  97           HBS      ASP  97  11.689   0.104   0.104
  794   2HB   ASP  97           HBR      ASP  97  13.183   0.335   0.335
  795    H    THR  98           HN       THR  98   9.426   0.203   0.203
  796    HA   THR  98           HA       THR  98   7.339  -0.254  -0.254
  797    HB   THR  98           HB       THR  98   7.756  -1.675  -1.675
  798    HG1  THR  98           HG1      THR  98   6.540   0.631   0.631
  799   1HG2  THR  98           HMG      THR  98   5.379  -1.336  -1.336
  800   2HG2  THR  98           HMG      THR  98   5.144  -1.287  -1.287
  801   3HG2  THR  98           HMG      THR  98   5.887  -2.717  -2.717
  802    H    LYS  99           HN       LYS  99   9.430  -2.717  -2.717
  803    HA   LYS  99           HA       LYS  99   8.001  -4.894  -4.894
  804   1HB   LYS  99           HBS      LYS  99   9.823  -6.300  -6.300
  805   2HB   LYS  99           HBR      LYS  99   9.510  -5.055  -5.055
  806   1HG   LYS  99           HGS      LYS  99  11.458  -3.818  -3.818
  807   2HG   LYS  99           HGR      LYS  99  11.913  -5.524  -5.524
  808   1HD   LYS  99           HDS      LYS  99  11.514  -5.610  -5.610
  809   2HD   LYS  99           HDR      LYS  99  11.785  -3.894  -3.894
  810   1HE   LYS  99           HER      LYS  99  13.962  -4.081  -4.081
  811   2HE   LYS  99           HES      LYS  99  13.761  -5.583  -5.583
  812   1HZ   LYS  99           HZC      LYS  99  13.127  -6.332  -6.332
  813   2HZ   LYS  99           HZA      LYS  99  14.310  -5.245  -5.245
  814   3HZ   LYS  99           HZB      LYS  99  14.600  -6.523  -6.523
  815    H    GLU 100           HN       GLU 100  10.535  -2.921  -2.921
  816    HA   GLU 100           HA       GLU 100  11.186  -4.712  -4.712
  817   1HB   GLU 100           HBR      GLU 100  11.628  -1.815  -1.815
  818   2HB   GLU 100           HBS      GLU 100  11.988  -2.383  -2.383
  819   1HG   GLU 100           HGR      GLU 100  13.567  -2.619  -2.619
  820   2HG   GLU 100           HGS      GLU 100  13.945  -2.607  -2.607
  821    H    ALA 101           HN       ALA 101   9.169  -1.765  -1.765
  822    HA   ALA 101           HA       ALA 101   8.131  -1.829  -1.829
  823   1HB   ALA 101           HMB      ALA 101   7.948  -0.114  -0.114
  824   2HB   ALA 101           HMB      ALA 101   6.357  -0.913  -0.913
  825   3HB   ALA 101           HMB      ALA 101   6.875  -0.097  -0.097
  826    H    LEU 102           HN       LEU 102   6.804  -2.990  -2.990
  827    HA   LEU 102           HA       LEU 102   4.423  -3.994  -3.994
  828   1HB   LEU 102           HBR      LEU 102   5.380  -3.510  -3.510
  829   2HB   LEU 102           HBS      LEU 102   5.590  -5.284  -5.284
  830    HG   LEU 102           HG       LEU 102   3.109  -5.369  -5.369
  831   1HD1  LEU 102           HMD      LEU 102   3.498  -2.528  -2.528
  832   2HD1  LEU 102           HMD      LEU 102   2.351  -3.087  -3.087
  833   3HD1  LEU 102           HMD      LEU 102   2.037  -3.429  -3.429
  834   1HD2  LEU 102           HMD      LEU 102   4.212  -4.532  -4.532
  835   2HD2  LEU 102           HMD      LEU 102   3.828  -6.170  -6.170
  836   3HD2  LEU 102           HMD      LEU 102   2.514  -5.023  -5.023
  837    H    ASP 103           HN       ASP 103   7.619  -5.336  -5.336
  838    HA   ASP 103           HA       ASP 103   6.793  -7.946  -7.946
  839   1HB   ASP 103           HBR      ASP 103   9.013  -7.191  -7.191
  840   2HB   ASP 103           HBS      ASP 103   9.508  -6.845  -6.845
  841    H    LYS 104           HN       LYS 104   8.216  -5.178  -5.178
  842    HA   LYS 104           HA       LYS 104   7.894  -6.302  -6.302
  843   1HB   LYS 104           HBS      LYS 104   9.126  -4.088  -4.088
  844   2HB   LYS 104           HBR      LYS 104   7.663  -3.350  -3.350
  845   1HG   LYS 104           HGS      LYS 104   9.228  -3.284  -3.284
  846   2HG   LYS 104           HGR      LYS 104   8.241  -4.726  -4.726
  847   1HD   LYS 104           HDR      LYS 104  10.219  -5.748  -5.748
  848   2HD   LYS 104           HDS      LYS 104  11.084  -4.459  -4.459
  849   1HE   LYS 104           HER      LYS 104   9.567  -5.766  -5.766
  850   2HE   LYS 104           HES      LYS 104  10.324  -7.038  -7.038
  851   1HZ   LYS 104           HZA      LYS 104  12.402  -5.649  -5.649
  852   2HZ   LYS 104           HZB      LYS 104  11.621  -4.914  -4.914
  853   3HZ   LYS 104           HZC      LYS 104  11.892  -6.524  -6.524
  854    H    ILE 105           HN       ILE 105   5.704  -4.828  -4.828
  855    HA   ILE 105           HA       ILE 105   3.593  -4.674  -4.674
  856    HB   ILE 105           HB       ILE 105   3.543  -4.156  -4.156
  857   1HG1  ILE 105           HG1      ILE 105   5.276  -2.927  -2.927
  858   2HG1  ILE 105           HG1      ILE 105   4.234  -1.958  -1.958
  859   1HG2  ILE 105           HMG      ILE 105   1.551  -3.681  -3.681
  860   2HG2  ILE 105           HMG      ILE 105   1.735  -2.433  -2.433
  861   3HG2  ILE 105           HMG      ILE 105   1.320  -4.105  -4.105
  862   1HD1  ILE 105           HMD      ILE 105   2.776  -1.759  -1.759
  863   2HD1  ILE 105           HMD      ILE 105   4.358  -2.070  -2.070
  864   3HD1  ILE 105           HMD      ILE 105   4.154  -0.678  -0.678
  865    H    GLU 106           HN       GLU 106   4.731  -6.914  -6.914
  866    HA   GLU 106           HA       GLU 106   2.290  -8.544  -8.544
  867   1HB   GLU 106           HBS      GLU 106   3.507  -8.234  -8.234
  868   2HB   GLU 106           HBR      GLU 106   4.987  -8.656  -8.656
  869   1HG   GLU 106           HGS      GLU 106   4.593 -10.865 -10.865
  870   2HG   GLU 106           HGR      GLU 106   2.815 -10.699 -10.699
  871    H    GLU 107           HN       GLU 107   4.860  -8.069  -8.069
  872    HA   GLU 107           HA       GLU 107   4.509 -10.733 -10.733
  873   1HB   GLU 107           HBR      GLU 107   6.631  -9.271  -9.271
  874   2HB   GLU 107           HBS      GLU 107   5.833  -8.219  -8.219
  875   1HG   GLU 107           HGS      GLU 107   7.020  -9.086  -9.086
  876   2HG   GLU 107           HGR      GLU 107   5.684 -10.265 -10.265
  877    H    GLU 108           HN       GLU 108   2.459  -8.417  -8.417
  878    HA   GLU 108           HA       GLU 108   0.857  -7.139  -7.139
  879   1HB   GLU 108           HBR      GLU 108   1.221  -8.664  -8.664
  880   2HB   GLU 108           HBS      GLU 108  -0.131  -7.916  -7.916
  881   1HG   GLU 108           HGS      GLU 108   0.985 -10.444 -10.444
  882   2HG   GLU 108           HGR      GLU 108  -0.464 -10.259 -10.259
  883    H    GLN 109           HN       GLN 109   3.912  -6.829  -6.829
  884    HA   GLN 109           HA       GLN 109   5.396  -5.579  -5.579
  885   1HB   GLN 109           HBR      GLN 109   4.144  -4.018  -4.018
  886   2HB   GLN 109           HBS      GLN 109   2.905  -3.857  -3.857
  887   1HG   GLN 109           HGS      GLN 109   4.414  -1.949  -1.949
  888   2HG   GLN 109           HGR      GLN 109   4.619  -2.910  -2.910
  889   1HE2  GLN 109           HE2      GLN 109   7.610  -2.379  -2.379
  890   2HE2  GLN 109           HE2      GLN 109   5.954  -2.275  -2.275
  891    H    ASN 110           HN       ASN 110   2.626  -4.354  -4.354
  892    HA   ASN 110           HA       ASN 110   3.785  -4.968  -4.968
  893   1HB   ASN 110           HBS      ASN 110   1.780  -4.219  -4.219
  894   2HB   ASN 110           HBR      ASN 110   2.155  -3.133  -3.133
  895   1HD2  ASN 110           HD2      ASN 110  -1.157  -5.594  -5.594
  896   2HD2  ASN 110           HD2      ASN 110   0.106  -5.830  -5.830
  897    H    LYS 111           HN       LYS 111   4.267  -6.963  -6.963
  898    HA   LYS 111           HA       LYS 111   3.493  -9.056  -9.056
  899   1HB   LYS 111           HBR      LYS 111   4.561 -10.562 -10.562
  900   2HB   LYS 111           HBS      LYS 111   5.540  -9.098  -9.098
  901   1HG   LYS 111           HGR      LYS 111   5.399  -8.403  -8.403
  902   2HG   LYS 111           HGS      LYS 111   3.700  -8.928  -8.928
  903   1HD   LYS 111           HDS      LYS 111   4.235 -10.886 -10.886
  904   2HD   LYS 111           HDR      LYS 111   5.505 -11.169 -11.169
  905   1HE   LYS 111           HES      LYS 111   7.140 -10.218 -10.218
  906   2HE   LYS 111           HER      LYS 111   5.982  -9.161  -9.161
  907   1HZ   LYS 111           HZB      LYS 111   6.197 -12.072 -12.072
  908   2HZ   LYS 111           HZC      LYS 111   6.791 -10.952 -10.952
  909   3HZ   LYS 111           HZA      LYS 111   5.178 -11.080 -11.080
  910    H    SER 112           HN       SER 112   2.122 -10.765 -10.765
  911    HA   SER 112           HA       SER 112   0.797 -11.576 -11.576
  912   1HB   SER 112           HBS      SER 112  -1.537 -11.177 -11.177
  913   2HB   SER 112           HBR      SER 112  -0.914 -10.144 -10.144
  914    HG   SER 112           HG       SER 112  -0.221  -9.828  -9.828
  915    H    LYS 113           HN       LYS 113   2.430 -12.531 -12.531
  916    HA   LYS 113           HA       LYS 113   0.704 -13.999 -13.999
  917   1HB   LYS 113           HBR      LYS 113   2.873 -13.081 -13.081
  918   2HB   LYS 113           HBS      LYS 113   3.706 -14.193 -14.193
  919   1HG   LYS 113           HGR      LYS 113   3.026 -16.112 -16.112
  920   2HG   LYS 113           HGS      LYS 113   1.909 -15.137 -15.137
  921   1HD   LYS 113           HDS      LYS 113   3.613 -15.315 -15.315
  922   2HD   LYS 113           HDR      LYS 113   4.027 -13.825 -13.825
  923   1HE   LYS 113           HES      LYS 113   5.909 -14.631 -14.631
  924   2HE   LYS 113           HER      LYS 113   5.138 -16.186 -16.186
  925   1HZ   LYS 113           HZC      LYS 113   5.757 -15.555 -15.555
  926   2HZ   LYS 113           HZA      LYS 113   6.924 -16.134 -16.134
  927   3HZ   LYS 113           HZB      LYS 113   5.578 -17.016 -17.016
  928    H    LYS 114           HN       LYS 114   0.985 -16.323 -16.323
  929    HA   LYS 114           HA       LYS 114   2.320 -18.015 -18.015
  930   1HB   LYS 114           HBR      LYS 114   0.175 -17.422 -17.422
  931   2HB   LYS 114           HBS      LYS 114  -0.678 -18.397 -18.397
  932   1HG   LYS 114           HGR      LYS 114   1.648 -19.515 -19.515
  933   2HG   LYS 114           HGS      LYS 114  -0.024 -19.549 -19.549
  934   1HD   LYS 114           HDS      LYS 114  -0.718 -20.725 -20.725
  935   2HD   LYS 114           HDR      LYS 114   0.956 -20.786 -20.786
  936   1HE   LYS 114           HES      LYS 114   1.562 -22.215 -22.215
  937   2HE   LYS 114           HER      LYS 114   0.008 -21.932 -21.932
  938   1HZ   LYS 114           HZB      LYS 114   0.327 -23.299 -23.299
  939   2HZ   LYS 114           HZC      LYS 114   0.051 -24.034 -24.034
  940   3HZ   LYS 114           HZA      LYS 114  -1.085 -23.055 -23.055
  941    H    LYS 115           HN       LYS 115  -0.719 -18.291 -18.291
  942    HA   LYS 115           HA       LYS 115  -1.205 -19.294 -19.294
  943   1HB   LYS 115           HBR      LYS 115   0.811 -17.868 -17.868
  944   2HB   LYS 115           HBS      LYS 115   1.768 -19.373 -19.373
  945   1HG   LYS 115           HGR      LYS 115   0.830 -20.274 -20.274
  946   2HG   LYS 115           HGS      LYS 115  -0.727 -19.427 -19.427
  947   1HD   LYS 115           HDS      LYS 115   0.900 -17.323 -17.323
  948   2HD   LYS 115           HDR      LYS 115   1.741 -18.551 -18.551
  949   1HE   LYS 115           HES      LYS 115  -1.147 -18.565 -18.565
  950   2HE   LYS 115           HER      LYS 115  -0.321 -17.050 -17.050
  951   1HZ   LYS 115           HZB      LYS 115   1.266 -19.079 -19.079
  952   2HZ   LYS 115           HZC      LYS 115  -0.249 -19.560 -19.560
  953   3HZ   LYS 115           HZA      LYS 115   0.306 -18.120 -18.120
  954    H    ALA 116           HN       ALA 116  -1.043 -21.278 -21.278
  955    HA   ALA 116           HA       ALA 116   0.831 -23.292 -23.292
  956   1HB   ALA 116           HMB      ALA 116  -1.721 -23.531 -23.531
  957   2HB   ALA 116           HMB      ALA 116  -0.796 -24.963 -24.963
  958   3HB   ALA 116           HMB      ALA 116  -0.034 -23.742 -23.742
  959    H    GLN 117           HN       GLN 117  -2.673 -23.841 -23.841
  960    HA   GLN 117           HA       GLN 117  -3.984 -24.713 -24.713
  961   1HB   GLN 117           HBR      GLN 117  -2.155 -23.100 -23.100
  962   2HB   GLN 117           HBS      GLN 117  -2.421 -24.644 -24.644
  963   1HG   GLN 117           HGS      GLN 117  -4.591 -22.768 -22.768
  964   2HG   GLN 117           HGR      GLN 117  -3.997 -22.883 -22.883
  965   1HE2  GLN 117           HE2      GLN 117  -7.036 -25.114 -25.114
  966   2HE2  GLN 117           HE2      GLN 117  -6.511 -23.614 -23.614
  967    H    GLN 118           HN       GLN 118  -3.926 -26.496 -26.496
  968    HA   GLN 118           HA       GLN 118  -1.887 -28.518 -28.518
  969   1HB   GLN 118           HBR      GLN 118  -4.265 -29.157 -29.157
  970   2HB   GLN 118           HBS      GLN 118  -4.537 -29.066 -29.066
  971   1HG   GLN 118           HGS      GLN 118  -2.213 -30.688 -30.688
  972   2HG   GLN 118           HGR      GLN 118  -3.714 -31.287 -31.287
  973   1HE2  GLN 118           HE2      GLN 118  -5.304 -32.231 -32.231
  974   2HE2  GLN 118           HE2      GLN 118  -5.563 -31.671 -31.671
  975    H    ALA 119           HN       ALA 119  -3.714 -27.135 -27.135
  976    HA   ALA 119           HA       ALA 119  -3.102 -26.696 -26.696
  977   1HB   ALA 119           HMB      ALA 119  -1.029 -25.959 -25.959
  978   2HB   ALA 119           HMB      ALA 119  -0.222 -26.932 -26.932
  979   3HB   ALA 119           HMB      ALA 119  -1.213 -25.525 -25.525
  980    H    ALA 120           HN       ALA 120  -3.587 -29.429 -29.429
  981    HA   ALA 120           HA       ALA 120  -3.608 -31.436 -31.436
  982   1HB   ALA 120           HMB      ALA 120  -3.513 -29.394 -29.394
  983   2HB   ALA 120           HMB      ALA 120  -2.244 -30.522 -30.522
  984   3HB   ALA 120           HMB      ALA 120  -3.912 -31.104 -31.104
  985    H    ALA 121           HN       ALA 121  -2.286 -33.128 -33.128
  986    HA   ALA 121           HA       ALA 121   0.490 -33.026 -33.026
  987   1HB   ALA 121           HMB      ALA 121  -0.473 -33.392 -33.392
  988   2HB   ALA 121           HMB      ALA 121   0.681 -34.633 -34.633
  989   3HB   ALA 121           HMB      ALA 121   1.127 -32.908 -32.908
  990    H    ASP 122           HN       ASP 122  -1.841 -34.111 -34.111
  991    HA   ASP 122           HA       ASP 122  -2.313 -35.898 -35.898
  992   1HB   ASP 122           HBS      ASP 122   0.389 -36.949 -36.949
  993   2HB   ASP 122           HBR      ASP 122  -0.558 -37.371 -37.371
  994    H    THR 123           HN       THR 123  -1.952 -38.563 -38.563
  995    HA   THR 123           HA       THR 123  -3.915 -39.110 -39.110
  996    HB   THR 123           HB       THR 123  -4.430 -39.842 -39.842
  997    HG1  THR 123           HG1      THR 123  -5.151 -41.465 -41.465
  998   1HG2  THR 123           HMG      THR 123  -1.721 -40.681 -40.681
  999   2HG2  THR 123           HMG      THR 123  -2.744 -42.128 -42.128
 1000   3HG2  THR 123           HMG      THR 123  -2.961 -40.736 -40.736
 1001    H    GLY 124           HN       GLY 124  -0.699 -40.270 -40.270
 1002   1HA   GLY 124           HAR      GLY 124   0.931 -41.398 -41.398
 1003   2HA   GLY 124           HAS      GLY 124   0.013 -41.016 -41.016
 1004    H    ASN 125           HN       ASN 125  -1.199 -42.842 -42.842
 1005    HA   ASN 125           HA       ASN 125  -1.461 -45.206 -45.206
 1006   1HB   ASN 125           HBS      ASN 125  -3.503 -43.540 -43.540
 1007   2HB   ASN 125           HBR      ASN 125  -3.617 -44.906 -44.906
 1008   1HD2  ASN 125           HD2      ASN 125  -4.795 -47.238 -47.238
 1009   2HD2  ASN 125           HD2      ASN 125  -4.219 -46.936 -46.936
 1010    H    ASN 126           HN       ASN 126  -2.453 -47.068 -47.068
 1011    HA   ASN 126           HA       ASN 126  -1.769 -48.735 -48.735
 1012   1HB   ASN 126           HBS      ASN 126  -1.812 -48.207 -48.207
 1013   2HB   ASN 126           HBR      ASN 126  -2.882 -47.029 -47.029
 1014   1HD2  ASN 126           HD2      ASN 126   0.620 -45.820 -45.820
 1015   2HD2  ASN 126           HD2      ASN 126   0.369 -47.482 -47.482
 1016    H    SER 127           HN       SER 127   0.027 -49.204 -49.204
 1017    HA   SER 127           HA       SER 127   2.178 -49.939 -49.939
 1018   1HB   SER 127           HBS      SER 127   2.433 -47.096 -47.096
 1019   2HB   SER 127           HBR      SER 127   3.901 -48.097 -48.097
 1020    HG   SER 127           HG       SER 127   2.267 -46.825 -46.825
 1021    H    GLN 128           HN       GLN 128   0.737 -50.277 -50.277
 1022    HA   GLN 128           HA       GLN 128   3.136 -50.836 -50.836
 1023   1HB   GLN 128           HBR      GLN 128   0.745 -49.185 -49.185
 1024   2HB   GLN 128           HBS      GLN 128   1.372 -50.263 -50.263
 1025   1HG   GLN 128           HGS      GLN 128   3.339 -48.572 -48.572
 1026   2HG   GLN 128           HGR      GLN 128   2.222 -47.751 -47.751
 1027   1HE2  GLN 128           HE2      GLN 128   5.235 -50.198 -50.198
 1028   2HE2  GLN 128           HE2      GLN 128   4.745 -50.182 -50.182
 1029    H    VAL 129           HN       VAL 129   2.502 -52.208 -52.208
 1030    HA   VAL 129           HA       VAL 129   0.852 -54.451 -54.451
 1031    HB   VAL 129           HB       VAL 129   3.509 -54.563 -54.563
 1032   1HG1  VAL 129           HMG      VAL 129   1.608 -56.712 -56.712
 1033   2HG1  VAL 129           HMG      VAL 129   3.360 -57.020 -57.020
 1034   3HG1  VAL 129           HMG      VAL 129   2.486 -56.532 -56.532
 1035   1HG2  VAL 129           HMG      VAL 129   2.903 -54.177 -54.177
 1036   2HG2  VAL 129           HMG      VAL 129   4.488 -54.345 -54.345
 1037   3HG2  VAL 129           HMG      VAL 129   3.629 -55.789 -55.789
 1038    H    SER 130           HN       SER 130   2.611 -54.452 -54.452
 1039    HA   SER 130           HA       SER 130   0.164 -55.292 -55.292
 1040   1HB   SER 130           HBS      SER 130   1.909 -55.370 -55.370
 1041   2HB   SER 130           HBR      SER 130   1.841 -56.628 -56.628
 1042    HG   SER 130           HG       SER 130   3.802 -56.270 -56.270
 1043    H    GLN 131           HN       GLN 131   0.256 -54.541 -54.541
 1044    HA   GLN 131           HA       GLN 131   0.153 -51.580 -51.580
 1045   1HB   GLN 131           HBR      GLN 131  -2.160 -52.827 -52.827
 1046   2HB   GLN 131           HBS      GLN 131  -1.833 -53.050 -53.050
 1047   1HG   GLN 131           HGS      GLN 131  -1.363 -50.496 -50.496
 1048   2HG   GLN 131           HGR      GLN 131  -2.257 -50.512 -50.512
 1049   1HE2  GLN 131           HE2      GLN 131  -4.250 -51.667 -51.667
 1050   2HE2  GLN 131           HE2      GLN 131  -2.579 -52.063 -52.063
 1051    H    ASN 132           HN       ASN 132   2.144 -51.475 -51.475
 1052    HA   ASN 132           HA       ASN 132   3.565 -51.217 -51.217
 1053   1HB   ASN 132           HBS      ASN 132   1.371 -51.882 -51.882
 1054   2HB   ASN 132           HBR      ASN 132   2.841 -50.892 -50.892
 1055   1HD2  ASN 132           HD2      ASN 132   1.483 -47.912 -47.912
 1056   2HD2  ASN 132           HD2      ASN 132   2.917 -48.766 -48.766
 1057    H    TYR 133           HN       TYR 133   3.022 -53.709 -53.709
 1058    HA   TYR 133           HA       TYR 133   4.241 -55.554 -55.554
 1059   1HB   TYR 133           HBS      TYR 133   2.995 -56.310 -56.310
 1060   2HB   TYR 133           HBR      TYR 133   3.609 -57.405 -57.405
 1061    HD1  TYR 133           HD1      TYR 133   2.418 -56.532 -56.532
 1062    HD2  TYR 133           HD2      TYR 133   0.701 -56.447 -56.447
 1063    HE1  TYR 133           HE1      TYR 133   0.174 -56.640 -56.640
 1064    HE2  TYR 133           HE2      TYR 133  -1.545 -56.584 -56.584
 1065    HH   TYR 133           HH       TYR 133  -2.395 -57.774 -57.774

  Start of MODEL    7
    1   1H    HIS   1           HNC      HIS   1   6.053  23.005  23.005
    2   2H    HIS   1           HNB      HIS   1   5.930  24.586  24.586
    3   3H    HIS   1           HN       HIS   1   4.589  23.657  23.657
    4    HA   HIS   1           HA       HIS   1   4.980  23.911  23.911
    5   1HB   HIS   1           HBS      HIS   1   7.821  22.896  22.896
    6   2HB   HIS   1           HBR      HIS   1   7.075  23.670  23.670
    7    HD1  HIS   1           HD1      HIS   1   6.449  26.348  26.348
    8    HD2  HIS   1           HD2      HIS   1   9.195  24.594  24.594
    9    HE1  HIS   1           HE1      HIS   1   7.789  28.224  28.224
   10    HE2  HIS   1           HE2      HIS   1   9.466  27.167  27.167
   11    H    MET   2           HN       MET   2   5.700  22.081  22.081
   12    HA   MET   2           HA       MET   2   5.292  19.971  19.971
   13   1HB   MET   2           HBR      MET   2   6.596  18.275  18.275
   14   2HB   MET   2           HBS      MET   2   7.498  19.815  19.815
   15   1HG   MET   2           HGR      MET   2   6.979  20.140  20.140
   16   2HG   MET   2           HGS      MET   2   5.895  18.729  18.729
   17   1HE   MET   2           HME      MET   2   6.347  16.577  16.577
   18   2HE   MET   2           HME      MET   2   7.894  15.693  15.693
   19   3HE   MET   2           HME      MET   2   7.292  16.439  16.439
   20    H    GLY   3           HN       GLY   3   3.123  21.135  21.135
   21   1HA   GLY   3           HAS      GLY   3   1.743  18.588  18.588
   22   2HA   GLY   3           HAR      GLY   3   1.531  19.976  19.976
   23    H    ALA   4           HN       ALA   4   0.984  22.091  22.091
   24    HA   ALA   4           HA       ALA   4  -0.477  23.329  23.329
   25   1HB   ALA   4           HMB      ALA   4   1.174  22.192  22.192
   26   2HB   ALA   4           HMB      ALA   4  -0.283  21.295  21.295
   27   3HB   ALA   4           HMB      ALA   4  -0.264  23.074  23.074
   28    H    ARG   5           HN       ARG   5  -2.149  22.717  22.717
   29    HA   ARG   5           HA       ARG   5  -4.180  21.895  21.895
   30   1HB   ARG   5           HBR      ARG   5  -5.047  22.623  22.623
   31   2HB   ARG   5           HBS      ARG   5  -4.455  21.128  21.128
   32   1HG   ARG   5           HGS      ARG   5  -6.372  20.110  20.110
   33   2HG   ARG   5           HGR      ARG   5  -6.118  20.397  20.397
   34   1HD   ARG   5           HDS      ARG   5  -7.082  22.657  22.657
   35   2HD   ARG   5           HDR      ARG   5  -8.220  21.328  21.328
   36    HE   ARG   5           HE       ARG   5  -7.069  23.239  23.239
   37   1HH1  ARG   5           HH1      ARG   5  -9.162  20.470  20.470
   38   2HH1  ARG   5           HH1      ARG   5  -9.778  20.438  20.438
   39   1HH2  ARG   5           HH2      ARG   5  -7.796  23.082  23.082
   40   2HH2  ARG   5           HH2      ARG   5  -9.004  21.915  21.915
   41    H    ALA   6           HN       ALA   6  -3.715  19.492  19.492
   42    HA   ALA   6           HA       ALA   6  -1.978  17.779  17.779
   43   1HB   ALA   6           HMB      ALA   6  -4.622  17.583  17.583
   44   2HB   ALA   6           HMB      ALA   6  -4.242  16.084  16.084
   45   3HB   ALA   6           HMB      ALA   6  -3.160  16.651  16.651
   46    H    SER   7           HN       SER   7  -1.121  16.640  16.640
   47    HA   SER   7           HA       SER   7  -2.580  16.597  16.597
   48   1HB   SER   7           HBS      SER   7  -0.355  17.792  17.792
   49   2HB   SER   7           HBR      SER   7   0.390  16.185  16.185
   50    HG   SER   7           HG       SER   7   0.351  17.139  17.139
   51    H    VAL   8           HN       VAL   8  -1.229  14.683  14.683
   52    HA   VAL   8           HA       VAL   8  -1.969  12.125  12.125
   53    HB   VAL   8           HB       VAL   8  -0.078  12.945  12.945
   54   1HG1  VAL   8           HMG      VAL   8   0.250  10.602  10.602
   55   2HG1  VAL   8           HMG      VAL   8  -1.239  10.184  10.184
   56   3HG1  VAL   8           HMG      VAL   8   0.190  10.758  10.758
   57   1HG2  VAL   8           HMG      VAL   8  -2.792  13.193  13.193
   58   2HG2  VAL   8           HMG      VAL   8  -1.803  13.013  13.013
   59   3HG2  VAL   8           HMG      VAL   8  -2.590  11.589  11.589
   60    H    LEU   9           HN       LEU   9   1.211  13.696  13.696
   61    HA   LEU   9           HA       LEU   9   2.368  11.520  11.520
   62   1HB   LEU   9           HBR      LEU   9   3.243  13.195  13.195
   63   2HB   LEU   9           HBS      LEU   9   4.427  12.272  12.272
   64    HG   LEU   9           HG       LEU   9   2.059  11.055  11.055
   65   1HD1  LEU   9           HMD      LEU   9   4.951  11.436  11.436
   66   2HD1  LEU   9           HMD      LEU   9   3.952  10.123  10.123
   67   3HD1  LEU   9           HMD      LEU   9   3.481  11.822  11.822
   68   1HD2  LEU   9           HMD      LEU   9   4.449   9.994   9.994
   69   2HD2  LEU   9           HMD      LEU   9   2.719   9.715   9.715
   70   3HD2  LEU   9           HMD      LEU   9   3.490   8.989   8.989
   71    H    SER  10           HN       SER  10   4.911  12.572  12.572
   72    HA   SER  10           HA       SER  10   4.406  14.719  14.719
   73   1HB   SER  10           HBS      SER  10   5.497  13.587  13.587
   74   2HB   SER  10           HBR      SER  10   4.414  12.362  12.362
   75    HG   SER  10           HG       SER  10   6.280  11.332  11.332
   76    H    GLY  11           HN       GLY  11   6.817  15.055  15.055
   77   1HA   GLY  11           HAR      GLY  11   8.359  16.417  16.417
   78   2HA   GLY  11           HAS      GLY  11   8.970  15.833  15.833
   79    H    GLY  12           HN       GLY  12   9.550  13.464  13.464
   80   1HA   GLY  12           HAR      GLY  12  11.488  12.910  12.910
   81   2HA   GLY  12           HAS      GLY  12  10.966  11.791  11.791
   82    H    GLU  13           HN       GLU  13   8.161  11.815  11.815
   83    HA   GLU  13           HA       GLU  13   8.303   9.457   9.457
   84   1HB   GLU  13           HBR      GLU  13   6.108  11.351  11.351
   85   2HB   GLU  13           HBS      GLU  13   5.798  10.040  10.040
   86   1HG   GLU  13           HGS      GLU  13   6.455   8.472   8.472
   87   2HG   GLU  13           HGR      GLU  13   6.783   9.756   9.756
   88    H    LEU  14           HN       LEU  14   7.366  12.789  12.789
   89    HA   LEU  14           HA       LEU  14   6.803  12.277  12.277
   90   1HB   LEU  14           HBR      LEU  14   6.339  14.286  14.286
   91   2HB   LEU  14           HBS      LEU  14   7.836  14.894  14.894
   92    HG   LEU  14           HG       LEU  14   6.825  15.035  15.035
   93   1HD1  LEU  14           HMD      LEU  14   4.630  13.386  13.386
   94   2HD1  LEU  14           HMD      LEU  14   4.332  14.387  14.387
   95   3HD1  LEU  14           HMD      LEU  14   5.551  13.088  13.088
   96   1HD2  LEU  14           HMD      LEU  14   5.574  16.188  16.188
   97   2HD2  LEU  14           HMD      LEU  14   6.040  16.955  16.955
   98   3HD2  LEU  14           HMD      LEU  14   4.467  16.129  16.129
   99    H    ASP  15           HN       ASP  15   9.587  13.677  13.677
  100    HA   ASP  15           HA       ASP  15  11.306  13.760  13.760
  101   1HB   ASP  15           HBS      ASP  15  11.593  14.979  14.979
  102   2HB   ASP  15           HBR      ASP  15  12.190  13.454  13.454
  103    H    LYS  16           HN       LYS  16  10.167  11.081  11.081
  104    HA   LYS  16           HA       LYS  16  12.087   9.258   9.258
  105   1HB   LYS  16           HBR      LYS  16  10.381   9.050   9.050
  106   2HB   LYS  16           HBS      LYS  16   9.608   8.051   8.051
  107   1HG   LYS  16           HGS      LYS  16  12.424   7.779   7.779
  108   2HG   LYS  16           HGR      LYS  16  11.063   6.635   6.635
  109   1HD   LYS  16           HDR      LYS  16  11.362   5.759   5.759
  110   2HD   LYS  16           HDS      LYS  16  11.786   7.277   7.277
  111   1HE   LYS  16           HER      LYS  16  13.675   5.922   5.922
  112   2HE   LYS  16           HES      LYS  16  13.548   5.379   5.379
  113   1HZ   LYS  16           HZC      LYS  16  13.930   7.778   7.778
  114   2HZ   LYS  16           HZA      LYS  16  14.382   8.003   8.003
  115   3HZ   LYS  16           HZB      LYS  16  15.215   6.970   6.970
  116    H    TRP  17           HN       TRP  17   8.723  10.368  10.368
  117    HA   TRP  17           HA       TRP  17   7.958   8.401   8.401
  118   1HB   TRP  17           HBS      TRP  17   6.330   9.606   9.606
  119   2HB   TRP  17           HBR      TRP  17   6.768  11.143  11.143
  120    HD1  TRP  17           HD1      TRP  17   6.089  11.320  11.320
  121    HE1  TRP  17           HE1      TRP  17   4.446  10.018  10.018
  122    HE3  TRP  17           HE3      TRP  17   5.219   7.384   7.384
  123    HZ2  TRP  17           HZ2      TRP  17   2.849   7.724   7.724
  124    HZ3  TRP  17           HZ3      TRP  17   3.437   5.801   5.801
  125    HH2  TRP  17           HH2      TRP  17   2.361   5.888   5.888
  126    H    GLU  18           HN       GLU  18   9.592  11.452  11.452
  127    HA   GLU  18           HA       GLU  18   9.062  11.567  11.567
  128   1HB   GLU  18           HBR      GLU  18   9.862  13.165  13.165
  129   2HB   GLU  18           HBS      GLU  18  11.325  12.929  12.929
  130   1HG   GLU  18           HGR      GLU  18   9.481  13.824  13.824
  131   2HG   GLU  18           HGS      GLU  18   9.494  14.840  14.840
  132    H    LYS  19           HN       LYS  19  10.327   9.062   9.062
  133    HA   LYS  19           HA       LYS  19  11.385   8.910   8.910
  134   1HB   LYS  19           HBS      LYS  19  13.501   9.732   9.732
  135   2HB   LYS  19           HBR      LYS  19  13.860   8.145   8.145
  136   1HG   LYS  19           HGR      LYS  19  13.867   9.018   9.018
  137   2HG   LYS  19           HGS      LYS  19  12.965  10.484  10.484
  138   1HD   LYS  19           HDS      LYS  19  15.811   9.837   9.837
  139   2HD   LYS  19           HDR      LYS  19  15.326  10.884  10.884
  140   1HE   LYS  19           HES      LYS  19  14.829  12.605  12.605
  141   2HE   LYS  19           HER      LYS  19  14.095  11.546  11.546
  142   1HZ   LYS  19           HZC      LYS  19  16.430  10.900  10.900
  143   2HZ   LYS  19           HZA      LYS  19  16.937  12.147  12.147
  144   3HZ   LYS  19           HZB      LYS  19  16.021  12.431  12.431
  145    H    ILE  20           HN       ILE  20   9.777   7.284   7.284
  146    HA   ILE  20           HA       ILE  20  11.107   4.824   4.824
  147    HB   ILE  20           HB       ILE  20   8.196   5.592   5.592
  148   1HG1  ILE  20           HG1      ILE  20   8.882   3.541   3.541
  149   2HG1  ILE  20           HG1      ILE  20  10.185   4.763   4.763
  150   1HG2  ILE  20           HMG      ILE  20   9.119   2.902   2.902
  151   2HG2  ILE  20           HMG      ILE  20   7.771   3.007   3.007
  152   3HG2  ILE  20           HMG      ILE  20   7.648   3.820   3.820
  153   1HD1  ILE  20           HMD      ILE  20   7.323   5.656   5.656
  154   2HD1  ILE  20           HMD      ILE  20   8.083   4.976   4.976
  155   3HD1  ILE  20           HMD      ILE  20   8.782   6.420   6.420
  156    H    ARG  21           HN       ARG  21  12.330   4.169   4.169
  157    HA   ARG  21           HA       ARG  21  11.945   4.493   4.493
  158   1HB   ARG  21           HBR      ARG  21  13.703   2.957   2.957
  159   2HB   ARG  21           HBS      ARG  21  13.265   2.054   2.054
  160   1HG   ARG  21           HGS      ARG  21  15.174   3.150   3.150
  161   2HG   ARG  21           HGR      ARG  21  13.907   4.297   4.297
  162   1HD   ARG  21           HDS      ARG  21  14.835   5.872   5.872
  163   2HD   ARG  21           HDR      ARG  21  14.556   4.895   4.895
  164    HE   ARG  21           HE       ARG  21  16.835   4.673   4.673
  165   1HH1  ARG  21           HH1      ARG  21  15.939   5.118   5.118
  166   2HH1  ARG  21           HH1      ARG  21  17.538   4.790   4.790
  167   1HH2  ARG  21           HH2      ARG  21  18.883   4.127   4.127
  168   2HH2  ARG  21           HH2      ARG  21  19.204   4.232   4.232
  169    H    LEU  22           HN       LEU  22  11.428   2.917   2.917
  170    HA   LEU  22           HA       LEU  22   9.394   0.909   0.909
  171   1HB   LEU  22           HBS      LEU  22   7.733   2.056   2.056
  172   2HB   LEU  22           HBR      LEU  22   8.282   3.032   3.032
  173    HG   LEU  22           HG       LEU  22   9.885   4.032   4.032
  174   1HD1  LEU  22           HMD      LEU  22   7.505   2.823   2.823
  175   2HD1  LEU  22           HMD      LEU  22   8.021   4.449   4.449
  176   3HD1  LEU  22           HMD      LEU  22   9.159   3.082   3.082
  177   1HD2  LEU  22           HMD      LEU  22   7.070   4.708   4.708
  178   2HD2  LEU  22           HMD      LEU  22   8.612   5.386   5.386
  179   3HD2  LEU  22           HMD      LEU  22   8.023   5.787   5.787
  180    H    ARG  23           HN       ARG  23  11.330   2.472   2.472
  181    HA   ARG  23           HA       ARG  23  11.845  -0.265  -0.265
  182   1HB   ARG  23           HBR      ARG  23  12.099   0.579   0.579
  183   2HB   ARG  23           HBS      ARG  23  10.411   0.605   0.605
  184   1HG   ARG  23           HGS      ARG  23  10.710   3.059   3.059
  185   2HG   ARG  23           HGR      ARG  23  12.290   2.960   2.960
  186   1HD   ARG  23           HDR      ARG  23  11.198   2.180   2.180
  187   2HD   ARG  23           HDS      ARG  23   9.614   2.238   2.238
  188    HE   ARG  23           HE       ARG  23  11.282   4.593   4.593
  189   1HH1  ARG  23           HH1      ARG  23   8.264   3.290   3.290
  190   2HH1  ARG  23           HH1      ARG  23   7.364   4.724   4.724
  191   1HH2  ARG  23           HH2      ARG  23  10.045   6.405   6.405
  192   2HH2  ARG  23           HH2      ARG  23   8.372   6.489   6.489
  193    HA   PRO  24           HA       PRO  24  15.713   1.564   1.564
  194   1HB   PRO  24           HBR      PRO  24  16.665  -1.070  -1.070
  195   2HB   PRO  24           HBS      PRO  24  16.628  -0.055  -0.055
  196   1HG   PRO  24           HGR      PRO  24  15.050  -2.168  -2.168
  197   2HG   PRO  24           HGS      PRO  24  14.772  -0.896  -0.896
  198   1HD   PRO  24           HDS      PRO  24  13.470  -1.492  -1.492
  199   2HD   PRO  24           HDR      PRO  24  12.966  -0.497  -0.497
  200    H    GLY  25           HN       GLY  25  14.881  -0.163  -0.163
  201   1HA   GLY  25           HAS      GLY  25  17.530   0.236   0.236
  202   2HA   GLY  25           HAR      GLY  25  16.165  -0.706  -0.706
  203    H    GLY  26           HN       GLY  26  14.332   1.550   1.550
  204   1HA   GLY  26           HAS      GLY  26  14.524   3.118   3.118
  205   2HA   GLY  26           HAR      GLY  26  13.078   2.956   2.956
  206    H    LYS  27           HN       LYS  27  14.987   3.245   3.245
  207    HA   LYS  27           HA       LYS  27  15.899   4.877   4.877
  208   1HB   LYS  27           HBS      LYS  27  16.091   6.633   6.633
  209   2HB   LYS  27           HBR      LYS  27  16.928   6.835   6.835
  210   1HG   LYS  27           HGR      LYS  27  18.361   4.987   4.987
  211   2HG   LYS  27           HGS      LYS  27  17.359   4.412   4.412
  212   1HD   LYS  27           HDS      LYS  27  17.966   6.808   6.808
  213   2HD   LYS  27           HDR      LYS  27  19.316   6.645   6.645
  214   1HE   LYS  27           HES      LYS  27  19.269   4.189   4.189
  215   2HE   LYS  27           HER      LYS  27  18.821   5.346   5.346
  216   1HZ   LYS  27           HZA      LYS  27  21.104   5.856   5.856
  217   2HZ   LYS  27           HZB      LYS  27  21.262   4.904   4.904
  218   3HZ   LYS  27           HZC      LYS  27  20.795   6.459   6.459
  219    H    LYS  28           HN       LYS  28  13.047   4.573   4.573
  220    HA   LYS  28           HA       LYS  28  12.005   7.285   7.285
  221   1HB   LYS  28           HBR      LYS  28  10.993   5.151   5.151
  222   2HB   LYS  28           HBS      LYS  28  10.077   5.093   5.093
  223   1HG   LYS  28           HGS      LYS  28   8.912   6.446   6.446
  224   2HG   LYS  28           HGR      LYS  28   9.413   7.440   7.440
  225   1HD   LYS  28           HDS      LYS  28  11.235   8.364   8.364
  226   2HD   LYS  28           HDR      LYS  28  11.030   7.195   7.195
  227   1HE   LYS  28           HER      LYS  28   8.554   8.490   8.490
  228   2HE   LYS  28           HES      LYS  28   9.807   9.763   9.763
  229   1HZ   LYS  28           HZC      LYS  28  10.625   8.132   8.132
  230   2HZ   LYS  28           HZA      LYS  28   9.003   8.097   8.097
  231   3HZ   LYS  28           HZB      LYS  28   9.798   9.524   9.524
  232    H    GLN  29           HN       GLN  29  10.890   7.780   7.780
  233    HA   GLN  29           HA       GLN  29  10.666   5.754   5.754
  234   1HB   GLN  29           HBR      GLN  29  11.603   7.523   7.523
  235   2HB   GLN  29           HBS      GLN  29  12.744   6.579   6.579
  236   1HG   GLN  29           HGR      GLN  29  12.099   8.853   8.853
  237   2HG   GLN  29           HGS      GLN  29  12.334   9.439   9.439
  238   1HE2  GLN  29           HE2      GLN  29  15.704   9.726   9.726
  239   2HE2  GLN  29           HE2      GLN  29  14.217  10.492  10.492
  240    H    TYR  30           HN       TYR  30   9.127   6.162   6.162
  241    HA   TYR  30           HA       TYR  30   6.959   7.906   7.906
  242   1HB   TYR  30           HBS      TYR  30   8.003   6.772   6.772
  243   2HB   TYR  30           HBR      TYR  30   6.464   7.656   7.656
  244    HD1  TYR  30           HD2      TYR  30   7.550   5.281   5.281
  245    HD2  TYR  30           HD1      TYR  30   5.264   5.724   5.724
  246    HE1  TYR  30           HE2      TYR  30   6.610   3.032   3.032
  247    HE2  TYR  30           HE1      TYR  30   4.384   3.444   3.444
  248    HH   TYR  30           HH       TYR  30   5.095   1.433   1.433
  249    H    LYS  31           HN       LYS  31   6.615   9.959   9.959
  250    HA   LYS  31           HA       LYS  31   7.721  11.163  11.163
  251   1HB   LYS  31           HBR      LYS  31   7.147  12.776  12.776
  252   2HB   LYS  31           HBS      LYS  31   7.822  13.344  13.344
  253   1HG   LYS  31           HGR      LYS  31   9.921  12.801  12.801
  254   2HG   LYS  31           HGS      LYS  31   9.418  11.205  11.205
  255   1HD   LYS  31           HDS      LYS  31   9.691  11.896  11.896
  256   2HD   LYS  31           HDR      LYS  31   8.415  13.057  13.057
  257   1HE   LYS  31           HES      LYS  31  11.354  13.524  13.524
  258   2HE   LYS  31           HER      LYS  31  10.346  14.175  14.175
  259   1HZ   LYS  31           HZB      LYS  31   9.312  14.736  14.736
  260   2HZ   LYS  31           HZC      LYS  31  10.797  15.377  15.377
  261   3HZ   LYS  31           HZA      LYS  31   9.584  15.744  15.744
  262    H    LEU  32           HN       LEU  32   6.255  13.427  13.427
  263    HA   LEU  32           HA       LEU  32   3.805  12.297  12.297
  264   1HB   LEU  32           HBS      LEU  32   5.039  15.057  15.057
  265   2HB   LEU  32           HBR      LEU  32   3.415  14.756  14.756
  266    HG   LEU  32           HG       LEU  32   6.021  13.556  13.556
  267   1HD1  LEU  32           HMD      LEU  32   5.287  16.084  16.084
  268   2HD1  LEU  32           HMD      LEU  32   4.245  15.383  15.383
  269   3HD1  LEU  32           HMD      LEU  32   6.010  15.157  15.157
  270   1HD2  LEU  32           HMD      LEU  32   3.676  12.316  12.316
  271   2HD2  LEU  32           HMD      LEU  32   4.841  12.347  12.347
  272   3HD2  LEU  32           HMD      LEU  32   3.459  13.472  13.472
  273    H    LYS  33           HN       LYS  33   4.712  13.580  13.580
  274    HA   LYS  33           HA       LYS  33   2.056  14.165  14.165
  275   1HB   LYS  33           HBR      LYS  33   4.328  14.760  14.760
  276   2HB   LYS  33           HBS      LYS  33   4.287  13.095  13.095
  277   1HG   LYS  33           HGS      LYS  33   2.478  13.535  13.535
  278   2HG   LYS  33           HGR      LYS  33   1.911  14.907  14.907
  279   1HD   LYS  33           HDS      LYS  33   3.586  16.329  16.329
  280   2HD   LYS  33           HDR      LYS  33   4.529  14.993  14.993
  281   1HE   LYS  33           HES      LYS  33   2.350  14.563  14.563
  282   2HE   LYS  33           HER      LYS  33   2.173  16.319  16.319
  283   1HZ   LYS  33           HZC      LYS  33   4.632  15.077  15.077
  284   2HZ   LYS  33           HZA      LYS  33   3.470  15.699  15.699
  285   3HZ   LYS  33           HZB      LYS  33   4.280  16.672  16.672
  286    H    HIS  34           HN       DHI  34   3.903  11.258  11.258
  287    HA   HIS  34           HA       DHI  34   2.024   9.514   9.514
  288   1HB   HIS  34           HBS      DHI  34   4.290   8.932   8.932
  289   2HB   HIS  34           HBR      DHI  34   3.104   7.689   7.689
  290    HD2  HIS  34           HD2      DHI  34   3.467   6.617   6.617
  291    HE1  HIS  34           HE1      DHI  34   7.230   8.398   8.398
  292    HE2  HIS  34           HE2      DHI  34   5.611   6.650   6.650
  293    H    ILE  35           HN       ILE  35   2.681  10.516  10.516
  294    HA   ILE  35           HA       ILE  35   0.641   8.935   8.935
  295    HB   ILE  35           HB       ILE  35   2.604  10.308  10.308
  296   1HG1  ILE  35           HG1      ILE  35   0.061  10.208  10.208
  297   2HG1  ILE  35           HG1      ILE  35   0.699   8.711   8.711
  298   1HG2  ILE  35           HMG      ILE  35   0.374  12.325  12.325
  299   2HG2  ILE  35           HMG      ILE  35   1.530  12.217  12.217
  300   3HG2  ILE  35           HMG      ILE  35   2.117  12.560  12.560
  301   1HD1  ILE  35           HMD      ILE  35   2.872  10.018  10.018
  302   2HD1  ILE  35           HMD      ILE  35   1.506  10.002  10.002
  303   3HD1  ILE  35           HMD      ILE  35   2.092   8.475   8.475
  304    H    VAL  36           HN       VAL  36   0.562  12.172  12.172
  305    HA   VAL  36           HA       VAL  36  -2.026  12.854  12.854
  306    HB   VAL  36           HB       VAL  36  -0.271  14.207  14.207
  307   1HG1  VAL  36           HMG      VAL  36  -3.063  14.723  14.723
  308   2HG1  VAL  36           HMG      VAL  36  -2.014  16.141  16.141
  309   3HG1  VAL  36           HMG      VAL  36  -2.069  15.337  15.337
  310   1HG2  VAL  36           HMG      VAL  36   0.097  14.073  14.073
  311   2HG2  VAL  36           HMG      VAL  36   0.685  15.377  15.377
  312   3HG2  VAL  36           HMG      VAL  36  -0.839  15.579  15.579
  313    H    TRP  37           HN       TRP  37  -0.620  11.656  11.656
  314    HA   TRP  37           HA       TRP  37  -2.987  11.171  11.171
  315   1HB   TRP  37           HBR      TRP  37  -0.740  10.936  10.936
  316   2HB   TRP  37           HBS      TRP  37  -0.440   9.555   9.555
  317    HD1  TRP  37           HD1      TRP  37  -1.978  10.403  10.403
  318    HE1  TRP  37           HE1      TRP  37  -2.723   8.236   8.236
  319    HE3  TRP  37           HE3      TRP  37  -1.477   7.232   7.232
  320    HZ2  TRP  37           HZ2      TRP  37  -2.998   5.530   5.530
  321    HZ3  TRP  37           HZ3      TRP  37  -1.954   4.852   4.852
  322    HH2  TRP  37           HH2      TRP  37  -2.735   4.014   4.014
  323    H    ALA  38           HN       ALA  38  -1.338   9.272   9.272
  324    HA   ALA  38           HA       ALA  38  -2.943   6.877   6.877
  325   1HB   ALA  38           HMB      ALA  38  -1.066   7.808   7.808
  326   2HB   ALA  38           HMB      ALA  38  -1.851   6.209   6.209
  327   3HB   ALA  38           HMB      ALA  38  -0.706   6.672   6.672
  328    H    SER  39           HN       SER  39  -2.524   8.998   8.998
  329    HA   SER  39           HA       SER  39  -4.733   7.970   7.970
  330   1HB   SER  39           HBS      SER  39  -3.023   9.112   9.112
  331   2HB   SER  39           HBR      SER  39  -3.297  10.621  10.621
  332    HG   SER  39           HG       SER  39  -4.329  11.061  11.061
  333    H    ARG  40           HN       ARG  40  -4.591  10.310  10.310
  334    HA   ARG  40           HA       ARG  40  -7.310  11.261  11.261
  335   1HB   ARG  40           HBS      ARG  40  -5.649  12.393  12.393
  336   2HB   ARG  40           HBR      ARG  40  -5.545  10.943  10.943
  337   1HG   ARG  40           HGS      ARG  40  -8.110  11.293  11.293
  338   2HG   ARG  40           HGR      ARG  40  -7.775  12.950  12.950
  339   1HD   ARG  40           HDR      ARG  40  -5.804  12.276  12.276
  340   2HD   ARG  40           HDS      ARG  40  -7.398  11.828  11.828
  341    HE   ARG  40           HE       ARG  40  -7.332  14.473  14.473
  342   1HH1  ARG  40           HH1      ARG  40  -7.075  12.558  12.558
  343   2HH1  ARG  40           HH1      ARG  40  -7.168  13.942  13.942
  344   1HH2  ARG  40           HH2      ARG  40  -7.322  16.269  16.269
  345   2HH2  ARG  40           HH2      ARG  40  -7.309  16.042  16.042
  346    H    GLU  41           HN       GLU  41  -5.781   8.803   8.803
  347    HA   GLU  41           HA       GLU  41  -8.239   8.082   8.082
  348   1HB   GLU  41           HBR      GLU  41  -5.557   7.724   7.724
  349   2HB   GLU  41           HBS      GLU  41  -5.964   6.244   6.244
  350   1HG   GLU  41           HGS      GLU  41  -5.791   6.630   6.630
  351   2HG   GLU  41           HGR      GLU  41  -6.851   5.379   5.379
  352    H    LEU  42           HN       LEU  42  -6.681   7.127   7.127
  353    HA   LEU  42           HA       LEU  42  -8.097   4.643   4.643
  354   1HB   LEU  42           HBR      LEU  42  -6.074   5.145   5.145
  355   2HB   LEU  42           HBS      LEU  42  -6.735   6.720   6.720
  356    HG   LEU  42           HG       LEU  42  -8.546   4.788   4.788
  357   1HD1  LEU  42           HMD      LEU  42  -5.837   3.709   3.709
  358   2HD1  LEU  42           HMD      LEU  42  -6.435   3.764   3.764
  359   3HD1  LEU  42           HMD      LEU  42  -7.369   2.906   2.906
  360   1HD2  LEU  42           HMD      LEU  42  -6.612   6.735   6.735
  361   2HD2  LEU  42           HMD      LEU  42  -8.355   6.525   6.525
  362   3HD2  LEU  42           HMD      LEU  42  -7.179   5.468   5.468
  363    H    GLU  43           HN       GLU  43  -8.382   7.883   7.883
  364    HA   GLU  43           HA       GLU  43 -10.742   7.406   7.406
  365   1HB   GLU  43           HBR      GLU  43  -9.176   9.180   9.180
  366   2HB   GLU  43           HBS      GLU  43  -9.379   9.780   9.780
  367   1HG   GLU  43           HGS      GLU  43 -11.713  10.345  10.345
  368   2HG   GLU  43           HGR      GLU  43 -11.203  10.189  10.189
  369    H    ARG  44           HN       ARG  44 -10.200   8.286   8.286
  370    HA   ARG  44           HA       ARG  44 -13.034   8.822   8.822
  371   1HB   ARG  44           HBS      ARG  44 -11.139  10.104  10.104
  372   2HB   ARG  44           HBR      ARG  44 -10.797   8.644   8.644
  373   1HG   ARG  44           HGR      ARG  44 -12.221   9.464   9.464
  374   2HG   ARG  44           HGS      ARG  44 -13.527   9.075   9.075
  375   1HD   ARG  44           HDS      ARG  44 -13.295  11.294  11.294
  376   2HD   ARG  44           HDR      ARG  44 -12.016  11.682  11.682
  377    HE   ARG  44           HE       ARG  44 -13.666  12.133  12.133
  378   1HH1  ARG  44           HH1      ARG  44 -15.091  10.298  10.298
  379   2HH1  ARG  44           HH1      ARG  44 -16.665  10.266  10.266
  380   1HH2  ARG  44           HH2      ARG  44 -15.705  11.960  11.960
  381   2HH2  ARG  44           HH2      ARG  44 -17.014  11.208  11.208
  382    H    PHE  45           HN       PHE  45 -10.997   6.098   6.098
  383    HA   PHE  45           HA       PHE  45 -12.570   4.372   4.372
  384   1HB   PHE  45           HBS      PHE  45 -10.378   3.997   3.997
  385   2HB   PHE  45           HBR      PHE  45 -11.668   2.773   2.773
  386    HD1  PHE  45           HD2      PHE  45 -12.538   2.128   2.128
  387    HD2  PHE  45           HD1      PHE  45  -8.661   3.314   3.314
  388    HE1  PHE  45           HE2      PHE  45 -11.541   1.062   1.062
  389    HE2  PHE  45           HE1      PHE  45  -7.649   2.267   2.267
  390    HZ   PHE  45           HZ       PHE  45  -9.092   1.194   1.194
  391    H    ALA  46           HN       ALA  46 -12.325   4.613   4.613
  392    HA   ALA  46           HA       ALA  46 -15.245   4.610   4.610
  393   1HB   ALA  46           HMB      ALA  46 -13.530   2.212   2.212
  394   2HB   ALA  46           HMB      ALA  46 -14.611   2.280   2.280
  395   3HB   ALA  46           HMB      ALA  46 -15.287   2.400   2.400
  396    H    VAL  47           HN       VAL  47 -12.508   5.858   5.858
  397    HA   VAL  47           HA       VAL  47 -12.518   4.930   4.930
  398    HB   VAL  47           HB       VAL  47 -10.122   5.806   5.806
  399   1HG1  VAL  47           HMG      VAL  47 -10.454   4.390   4.390
  400   2HG1  VAL  47           HMG      VAL  47  -8.943   4.324   4.324
  401   3HG1  VAL  47           HMG      VAL  47  -9.566   5.888   5.888
  402   1HG2  VAL  47           HMG      VAL  47 -11.227   3.013   3.013
  403   2HG2  VAL  47           HMG      VAL  47 -11.101   3.939   3.939
  404   3HG2  VAL  47           HMG      VAL  47  -9.626   3.412   3.412
  405    H    ASN  48           HN       ASN  48 -11.344   6.370   6.370
  406    HA   ASN  48           HA       ASN  48 -11.746   9.240   9.240
  407   1HB   ASN  48           HBS      ASN  48 -13.354   8.637   8.637
  408   2HB   ASN  48           HBR      ASN  48 -12.117   7.808   7.808
  409   1HD2  ASN  48           HD2      ASN  48 -12.952  11.674  11.674
  410   2HD2  ASN  48           HD2      ASN  48 -13.954  10.551  10.551
  411    HA   PRO  49           HA       PRO  49  -7.606   9.672   9.672
  412   1HB   PRO  49           HBR      PRO  49  -7.356  12.281  12.281
  413   2HB   PRO  49           HBS      PRO  49  -7.895  11.603  11.603
  414   1HG   PRO  49           HGR      PRO  49  -9.370  12.996  12.996
  415   2HG   PRO  49           HGS      PRO  49  -9.719  12.752  12.752
  416   1HD   PRO  49           HDS      PRO  49 -10.810  11.418  11.418
  417   2HD   PRO  49           HDR      PRO  49 -10.995  11.040  11.040
  418    H    GLY  50           HN       GLY  50  -8.641  11.713  11.713
  419   1HA   GLY  50           HAS      GLY  50  -6.537  11.410  11.410
  420   2HA   GLY  50           HAR      GLY  50  -8.211  11.603  11.603
  421    H    LEU  51           HN       LEU  51  -9.001   9.137   9.137
  422    HA   LEU  51           HA       LEU  51  -8.924   7.330   7.330
  423   1HB   LEU  51           HBR      LEU  51 -10.645   7.885   7.885
  424   2HB   LEU  51           HBS      LEU  51  -9.745   6.579   6.579
  425    HG   LEU  51           HG       LEU  51 -11.252   6.374   6.374
  426   1HD1  LEU  51           HMD      LEU  51 -11.981   5.950   5.950
  427   2HD1  LEU  51           HMD      LEU  51 -12.359   4.584   4.584
  428   3HD1  LEU  51           HMD      LEU  51 -13.007   6.206   6.206
  429   1HD2  LEU  51           HMD      LEU  51  -9.419   4.562   4.562
  430   2HD2  LEU  51           HMD      LEU  51  -9.616   4.784   4.784
  431   3HD2  LEU  51           HMD      LEU  51 -10.822   3.851   3.851
  432    H    LEU  52           HN       LEU  52  -7.618   7.335   7.335
  433    HA   LEU  52           HA       LEU  52  -5.835   5.207   5.207
  434   1HB   LEU  52           HBR      LEU  52  -5.966   5.011   5.011
  435   2HB   LEU  52           HBS      LEU  52  -6.938   6.500   6.500
  436    HG   LEU  52           HG       LEU  52  -5.214   6.463   6.463
  437   1HD1  LEU  52           HMD      LEU  52  -4.738   8.504   8.504
  438   2HD1  LEU  52           HMD      LEU  52  -4.079   8.604   8.604
  439   3HD1  LEU  52           HMD      LEU  52  -5.841   8.631   8.631
  440   1HD2  LEU  52           HMD      LEU  52  -3.675   5.170   5.170
  441   2HD2  LEU  52           HMD      LEU  52  -3.045   5.997   5.997
  442   3HD2  LEU  52           HMD      LEU  52  -2.999   6.813   6.813
  443    H    GLU  53           HN       GLU  53  -5.628   8.561   8.561
  444    HA   GLU  53           HA       GLU  53  -2.814   8.935   8.935
  445   1HB   GLU  53           HBS      GLU  53  -3.967  10.780  10.780
  446   2HB   GLU  53           HBR      GLU  53  -5.254  10.177  10.177
  447   1HG   GLU  53           HGS      GLU  53  -4.117  10.591  10.591
  448   2HG   GLU  53           HGR      GLU  53  -2.632  11.084  11.084
  449    H    THR  54           HN       THR  54  -5.071   7.787   7.787
  450    HA   THR  54           HA       THR  54  -2.960   7.103   7.103
  451    HB   THR  54           HB       THR  54  -4.631   5.887   5.887
  452    HG1  THR  54           HG1      THR  54  -6.120   6.320   6.320
  453   1HG2  THR  54           HMG      THR  54  -4.948   8.541   8.541
  454   2HG2  THR  54           HMG      THR  54  -6.553   7.919   7.919
  455   3HG2  THR  54           HMG      THR  54  -5.908   7.585   7.585
  456    H    SER  55           HN       SER  55  -2.224   4.989   4.989
  457    HA   SER  55           HA       SER  55  -1.812   3.091   3.091
  458   1HB   SER  55           HBS      SER  55  -1.819   1.610   1.610
  459   2HB   SER  55           HBR      SER  55  -0.416   2.475   2.475
  460    HG   SER  55           HG       SER  55  -0.285   3.487   3.487
  461    H    GLU  56           HN       GLU  56  -4.408   3.571   3.571
  462    HA   GLU  56           HA       GLU  56  -5.386   0.899   0.899
  463   1HB   GLU  56           HBR      GLU  56  -5.829   3.279   3.279
  464   2HB   GLU  56           HBS      GLU  56  -7.227   3.120   3.120
  465   1HG   GLU  56           HGR      GLU  56  -7.306   0.713   0.713
  466   2HG   GLU  56           HGS      GLU  56  -6.393   1.670   1.670
  467    H    GLY  57           HN       GLY  57  -6.410   3.881   3.881
  468   1HA   GLY  57           HAR      GLY  57  -8.540   2.636   2.636
  469   2HA   GLY  57           HAS      GLY  57  -7.790   4.227   4.227
  470    H    CYS  58           HN       CYS  58  -5.086   3.361   3.361
  471    HA   CYS  58           HA       CYS  58  -4.893   2.545   2.545
  472   1HB   CYS  58           HBR      CYS  58  -3.221   3.709   3.709
  473   2HB   CYS  58           HBS      CYS  58  -2.573   2.045   2.045
  474    H    ARG  59           HN       ARG  59  -4.943   0.681   0.681
  475    HA   ARG  59           HA       ARG  59  -4.447  -1.837  -1.837
  476   1HB   ARG  59           HBR      ARG  59  -4.137  -1.228  -1.228
  477   2HB   ARG  59           HBS      ARG  59  -5.876  -1.613  -1.613
  478   1HG   ARG  59           HGS      ARG  59  -5.518  -3.823  -3.823
  479   2HG   ARG  59           HGR      ARG  59  -4.284  -3.650  -3.650
  480   1HD   ARG  59           HDS      ARG  59  -2.637  -3.001  -3.001
  481   2HD   ARG  59           HDR      ARG  59  -3.867  -3.134  -3.134
  482    HE   ARG  59           HE       ARG  59  -3.228  -5.513  -5.513
  483   1HH1  ARG  59           HH1      ARG  59  -2.843  -3.801  -3.801
  484   2HH1  ARG  59           HH1      ARG  59  -2.560  -5.251  -5.251
  485   1HH2  ARG  59           HH2      ARG  59  -2.986  -7.398  -7.398
  486   2HH2  ARG  59           HH2      ARG  59  -2.642  -7.288  -7.288
  487    H    GLN  60           HN       GLN  60  -7.169   0.229   0.229
  488    HA   GLN  60           HA       GLN  60  -9.230  -1.865  -1.865
  489   1HB   GLN  60           HBR      GLN  60  -9.204   0.944   0.944
  490   2HB   GLN  60           HBS      GLN  60 -10.365   0.620   0.620
  491   1HG   GLN  60           HGR      GLN  60 -11.817  -0.219  -0.219
  492   2HG   GLN  60           HGS      GLN  60 -10.619  -1.423  -1.423
  493   1HE2  GLN  60           HE2      GLN  60 -11.752   1.660   1.660
  494   2HE2  GLN  60           HE2      GLN  60 -12.487   1.266   1.266
  495    H    ILE  61           HN       ILE  61  -7.335   0.365   0.365
  496    HA   ILE  61           HA       ILE  61  -8.649  -0.463  -0.463
  497    HB   ILE  61           HB       ILE  61  -6.112   1.209   1.209
  498   1HG1  ILE  61           HG1      ILE  61  -7.805   2.507   2.507
  499   2HG1  ILE  61           HG1      ILE  61  -7.697   3.036   3.036
  500   1HG2  ILE  61           HMG      ILE  61  -6.416  -0.114  -0.114
  501   2HG2  ILE  61           HMG      ILE  61  -7.564   1.200   1.200
  502   3HG2  ILE  61           HMG      ILE  61  -5.865   1.583   1.583
  503   1HD1  ILE  61           HMD      ILE  61  -9.709   0.944   0.944
  504   2HD1  ILE  61           HMD      ILE  61 -10.020   2.673   2.673
  505   3HD1  ILE  61           HMD      ILE  61  -9.747   2.102   2.102
  506    H    LEU  62           HN       LEU  62  -5.274  -0.859  -0.859
  507    HA   LEU  62           HA       LEU  62  -4.520  -2.502  -2.502
  508   1HB   LEU  62           HBR      LEU  62  -3.217  -1.219  -1.219
  509   2HB   LEU  62           HBS      LEU  62  -3.281  -2.801  -2.801
  510    HG   LEU  62           HG       LEU  62  -2.044  -3.831  -3.831
  511   1HD1  LEU  62           HMD      LEU  62  -2.947  -1.980  -1.980
  512   2HD1  LEU  62           HMD      LEU  62  -1.442  -1.151  -1.151
  513   3HD1  LEU  62           HMD      LEU  62  -1.371  -2.774  -2.774
  514   1HD2  LEU  62           HMD      LEU  62  -1.002  -1.376  -1.376
  515   2HD2  LEU  62           HMD      LEU  62  -0.650  -3.096  -3.096
  516   3HD2  LEU  62           HMD      LEU  62   0.050  -2.283  -2.283
  517    H    GLY  63           HN       GLY  63  -6.339  -3.245  -3.245
  518   1HA   GLY  63           HAR      GLY  63  -6.221  -6.132  -6.132
  519   2HA   GLY  63           HAS      GLY  63  -7.411  -5.187  -5.187
  520    H    GLN  64           HN       GLN  64  -8.833  -3.750  -3.750
  521    HA   GLN  64           HA       GLN  64 -10.511  -5.534  -5.534
  522   1HB   GLN  64           HBR      GLN  64 -10.746  -2.961  -2.961
  523   2HB   GLN  64           HBS      GLN  64 -10.675  -2.740  -2.740
  524   1HG   GLN  64           HGR      GLN  64 -12.413  -4.928  -4.928
  525   2HG   GLN  64           HGS      GLN  64 -12.865  -3.601  -3.601
  526   1HE2  GLN  64           HE2      GLN  64 -13.931  -1.367  -1.367
  527   2HE2  GLN  64           HE2      GLN  64 -13.210  -1.470  -1.470
  528    H    LEU  65           HN       LEU  65  -7.590  -4.038  -4.038
  529    HA   LEU  65           HA       LEU  65  -8.465  -3.613  -3.613
  530   1HB   LEU  65           HBR      LEU  65  -7.385  -1.966  -1.966
  531   2HB   LEU  65           HBS      LEU  65  -5.856  -2.841  -2.841
  532    HG   LEU  65           HG       LEU  65  -6.176  -2.274  -2.274
  533   1HD1  LEU  65           HMD      LEU  65  -8.607  -1.143  -1.143
  534   2HD1  LEU  65           HMD      LEU  65  -7.633   0.102   0.102
  535   3HD1  LEU  65           HMD      LEU  65  -8.127  -1.366  -1.366
  536   1HD2  LEU  65           HMD      LEU  65  -5.026  -0.970  -0.970
  537   2HD2  LEU  65           HMD      LEU  65  -4.766  -0.573  -0.573
  538   3HD2  LEU  65           HMD      LEU  65  -5.983   0.320   0.320
  539    H    GLN  66           HN       GLN  66  -5.966  -5.426  -5.426
  540    HA   GLN  66           HA       GLN  66  -4.521  -6.384  -6.384
  541   1HB   GLN  66           HBR      GLN  66  -4.837  -7.133  -7.133
  542   2HB   GLN  66           HBS      GLN  66  -4.771  -8.602  -8.602
  543   1HG   GLN  66           HGS      GLN  66  -2.751  -6.874  -6.874
  544   2HG   GLN  66           HGR      GLN  66  -2.649  -6.843  -6.843
  545   1HE2  GLN  66           HE2      GLN  66  -2.435 -10.598 -10.598
  546   2HE2  GLN  66           HE2      GLN  66  -3.672  -9.487  -9.487
  547    HA   PRO  67           HA       PRO  67  -7.966  -9.812  -9.812
  548   1HB   PRO  67           HBS      PRO  67 -10.262  -8.897  -8.897
  549   2HB   PRO  67           HBR      PRO  67  -9.440 -10.233 -10.233
  550   1HG   PRO  67           HGR      PRO  67  -9.597  -7.731  -7.731
  551   2HG   PRO  67           HGS      PRO  67  -9.117  -9.192  -9.192
  552   1HD   PRO  67           HDS      PRO  67  -7.468  -7.173  -7.173
  553   2HD   PRO  67           HDR      PRO  67  -6.997  -8.730  -8.730
  554    H    SER  68           HN       SER  68  -8.817  -6.463  -6.463
  555    HA   SER  68           HA       SER  68 -10.762  -6.566  -6.566
  556   1HB   SER  68           HBS      SER  68  -9.667  -4.537  -4.537
  557   2HB   SER  68           HBR      SER  68 -10.120  -3.915  -3.915
  558    HG   SER  68           HG       SER  68 -11.621  -5.246  -5.246
  559    H    LEU  69           HN       LEU  69  -7.368  -6.502  -6.502
  560    HA   LEU  69           HA       LEU  69  -6.887  -4.694  -4.694
  561   1HB   LEU  69           HBR      LEU  69  -5.289  -6.850  -6.850
  562   2HB   LEU  69           HBS      LEU  69  -4.643  -5.850  -5.850
  563    HG   LEU  69           HG       LEU  69  -5.609  -4.814  -4.814
  564   1HD1  LEU  69           HMD      LEU  69  -3.141  -6.020  -6.020
  565   2HD1  LEU  69           HMD      LEU  69  -2.859  -4.270  -4.270
  566   3HD1  LEU  69           HMD      LEU  69  -3.557  -5.204  -5.204
  567   1HD2  LEU  69           HMD      LEU  69  -5.906  -3.351  -3.351
  568   2HD2  LEU  69           HMD      LEU  69  -4.809  -2.689  -2.689
  569   3HD2  LEU  69           HMD      LEU  69  -4.143  -3.423  -3.423
  570    H    GLN  70           HN       GLN  70  -7.423  -8.173  -8.173
  571    HA   GLN  70           HA       GLN  70  -6.925  -8.964  -8.964
  572   1HB   GLN  70           HBR      GLN  70  -8.133 -10.938 -10.938
  573   2HB   GLN  70           HBS      GLN  70  -7.307 -10.500 -10.500
  574   1HG   GLN  70           HGS      GLN  70  -9.230 -10.363 -10.363
  575   2HG   GLN  70           HGR      GLN  70 -10.020  -9.422  -9.422
  576   1HE2  GLN  70           HE2      GLN  70 -12.136 -12.049 -12.049
  577   2HE2  GLN  70           HE2      GLN  70 -11.903 -10.376 -10.376
  578    H    THR  71           HN       THR  71  -9.395  -6.969  -6.969
  579    HA   THR  71           HA       THR  71 -10.944  -7.129  -7.129
  580    HB   THR  71           HB       THR  71 -11.975  -8.781  -8.781
  581    HG1  THR  71           HG1      THR  71 -13.239  -6.405  -6.405
  582   1HG2  THR  71           HMG      THR  71 -11.292  -7.038  -7.038
  583   2HG2  THR  71           HMG      THR  71 -12.970  -7.631  -7.631
  584   3HG2  THR  71           HMG      THR  71 -11.622  -8.788  -8.788
  585    H    GLY  72           HN       GLY  72  -9.202  -5.134  -5.134
  586   1HA   GLY  72           HAR      GLY  72 -11.043  -2.845  -2.845
  587   2HA   GLY  72           HAS      GLY  72  -9.440  -2.818  -2.818
  588    H    SER  73           HN       SER  73  -7.557  -3.250  -3.250
  589    HA   SER  73           HA       SER  73  -7.586  -3.359  -3.359
  590   1HB   SER  73           HBR      SER  73  -6.880  -1.022  -1.022
  591   2HB   SER  73           HBS      SER  73  -8.612  -1.254  -1.254
  592    HG   SER  73           HG       SER  73  -8.457   0.338   0.338
  593    H    GLU  74           HN       GLU  74  -5.437  -2.696  -2.696
  594    HA   GLU  74           HA       GLU  74  -3.104  -3.148  -3.148
  595   1HB   GLU  74           HBR      GLU  74  -1.930  -2.786  -2.786
  596   2HB   GLU  74           HBS      GLU  74  -3.322  -3.610  -3.610
  597   1HG   GLU  74           HGR      GLU  74  -3.625  -2.320  -2.320
  598   2HG   GLU  74           HGS      GLU  74  -4.058  -1.076  -1.076
  599    H    GLU  75           HN       GLU  75  -5.222  -0.516  -0.516
  600    HA   GLU  75           HA       GLU  75  -3.538   1.578   1.578
  601   1HB   GLU  75           HBR      GLU  75  -5.124   2.131   2.131
  602   2HB   GLU  75           HBS      GLU  75  -6.254   1.077   1.077
  603   1HG   GLU  75           HGS      GLU  75  -7.410   2.622   2.622
  604   2HG   GLU  75           HGR      GLU  75  -6.195   3.034   3.034
  605    H    LEU  76           HN       LEU  76  -5.747  -0.672  -0.672
  606    HA   LEU  76           HA       LEU  76  -5.595   0.634   0.634
  607   1HB   LEU  76           HBR      LEU  76  -7.234  -1.246  -1.246
  608   2HB   LEU  76           HBS      LEU  76  -6.198  -2.243  -2.243
  609    HG   LEU  76           HG       LEU  76  -8.114  -0.038  -0.038
  610   1HD1  LEU  76           HMD      LEU  76  -8.032  -2.975  -2.975
  611   2HD1  LEU  76           HMD      LEU  76  -8.457  -2.203  -2.203
  612   3HD1  LEU  76           HMD      LEU  76  -9.413  -1.852  -1.852
  613   1HD2  LEU  76           HMD      LEU  76  -5.744  -0.092  -0.092
  614   2HD2  LEU  76           HMD      LEU  76  -7.226   0.069   0.069
  615   3HD2  LEU  76           HMD      LEU  76  -6.416  -1.512  -1.512
  616    H    ARG  77           HN       ARG  77  -3.691  -1.531  -1.531
  617    HA   ARG  77           HA       ARG  77  -2.161  -2.766  -2.766
  618   1HB   ARG  77           HBR      ARG  77  -2.148  -2.726  -2.726
  619   2HB   ARG  77           HBS      ARG  77  -0.503  -2.602  -2.602
  620   1HG   ARG  77           HGS      ARG  77  -2.541  -4.780  -4.780
  621   2HG   ARG  77           HGR      ARG  77  -1.087  -4.924  -4.924
  622   1HD   ARG  77           HDS      ARG  77  -0.069  -3.947  -3.947
  623   2HD   ARG  77           HDR      ARG  77  -1.382  -5.019  -5.019
  624    HE   ARG  77           HE       ARG  77  -0.285  -6.865  -6.865
  625   1HH1  ARG  77           HH1      ARG  77   1.502  -3.861  -3.861
  626   2HH1  ARG  77           HH1      ARG  77   3.016  -4.670  -4.670
  627   1HH2  ARG  77           HH2      ARG  77   1.734  -7.880  -7.880
  628   2HH2  ARG  77           HH2      ARG  77   3.148  -6.944  -6.944
  629    H    SER  78           HN       SER  78  -1.975   0.203   0.203
  630    HA   SER  78           HA       SER  78   0.372   1.220   1.220
  631   1HB   SER  78           HBR      SER  78  -1.887   2.447   2.447
  632   2HB   SER  78           HBS      SER  78  -0.717   3.474   3.474
  633    HG   SER  78           HG       SER  78  -0.107   1.323   1.323
  634    H    LEU  79           HN       LEU  79  -3.115   1.759   1.759
  635    HA   LEU  79           HA       LEU  79  -2.779   3.489   3.489
  636   1HB   LEU  79           HBR      LEU  79  -4.903   1.893   1.893
  637   2HB   LEU  79           HBS      LEU  79  -5.164   2.212   2.212
  638    HG   LEU  79           HG       LEU  79  -6.321   3.876   3.876
  639   1HD1  LEU  79           HMD      LEU  79  -3.961   4.561   4.561
  640   2HD1  LEU  79           HMD      LEU  79  -4.479   5.866   5.866
  641   3HD1  LEU  79           HMD      LEU  79  -5.627   5.184   5.184
  642   1HD2  LEU  79           HMD      LEU  79  -3.877   3.716   3.716
  643   2HD2  LEU  79           HMD      LEU  79  -5.543   4.151   4.151
  644   3HD2  LEU  79           HMD      LEU  79  -4.469   5.376   5.376
  645    H    TYR  80           HN       TYR  80  -2.749  -0.026  -0.026
  646    HA   TYR  80           HA       TYR  80  -2.724  -0.584  -0.584
  647   1HB   TYR  80           HBS      TYR  80  -3.134  -2.286  -2.286
  648   2HB   TYR  80           HBR      TYR  80  -1.435  -2.126  -2.126
  649    HD1  TYR  80           HD1      TYR  80  -3.552  -3.113  -3.113
  650    HD2  TYR  80           HD2      TYR  80   0.266  -3.345  -3.345
  651    HE1  TYR  80           HE1      TYR  80  -2.892  -4.872  -4.872
  652    HE2  TYR  80           HE2      TYR  80   0.967  -5.038  -5.038
  653    HH   TYR  80           HH       TYR  80  -0.656  -6.909  -6.909
  654    H    ASN  81           HN       ASN  81  -0.196   0.103   0.103
  655    HA   ASN  81           HA       ASN  81   1.863  -0.621  -0.621
  656   1HB   ASN  81           HBS      ASN  81   3.305  -0.351  -0.351
  657   2HB   ASN  81           HBR      ASN  81   1.769  -0.513  -0.513
  658   1HD2  ASN  81           HD2      ASN  81   3.780   2.158   2.158
  659   2HD2  ASN  81           HD2      ASN  81   4.115   0.525   0.525
  660    H    THR  82           HN       THR  82   0.394   2.497   2.497
  661    HA   THR  82           HA       THR  82   2.316   3.935   3.935
  662    HB   THR  82           HB       THR  82  -0.093   5.469   5.469
  663    HG1  THR  82           HG1      THR  82   0.839   4.139   4.139
  664   1HG2  THR  82           HMG      THR  82   2.620   5.835   5.835
  665   2HG2  THR  82           HMG      THR  82   1.884   6.140   6.140
  666   3HG2  THR  82           HMG      THR  82   1.317   7.040   7.040
  667    H    ILE  83           HN       ILE  83  -0.730   2.283   2.283
  668    HA   ILE  83           HA       ILE  83  -1.241   3.308   3.308
  669    HB   ILE  83           HB       ILE  83  -2.296   1.095   1.095
  670   1HG1  ILE  83           HG1      ILE  83  -3.093   3.323   3.323
  671   2HG1  ILE  83           HG1      ILE  83  -4.402   2.323   2.323
  672   1HG2  ILE  83           HMG      ILE  83  -2.146   0.366   0.366
  673   2HG2  ILE  83           HMG      ILE  83  -3.694   1.248   1.248
  674   3HG2  ILE  83           HMG      ILE  83  -3.430  -0.129  -0.129
  675   1HD1  ILE  83           HMD      ILE  83  -3.608   3.231   3.231
  676   2HD1  ILE  83           HMD      ILE  83  -2.723   4.456   4.456
  677   3HD1  ILE  83           HMD      ILE  83  -4.500   4.353   4.353
  678    H    ALA  84           HN       ALA  84   0.357   0.308   0.308
  679    HA   ALA  84           HA       ALA  84   0.840  -0.670  -0.670
  680   1HB   ALA  84           HMB      ALA  84   2.166  -1.233  -1.233
  681   2HB   ALA  84           HMB      ALA  84   2.566  -2.108  -2.108
  682   3HB   ALA  84           HMB      ALA  84   0.911  -2.174  -2.174
  683    H    VAL  85           HN       VAL  85   2.702   1.527   1.527
  684    HA   VAL  85           HA       VAL  85   4.870   1.822   1.822
  685    HB   VAL  85           HB       VAL  85   3.896   3.551   3.551
  686   1HG1  VAL  85           HMG      VAL  85   5.059   4.811   4.811
  687   2HG1  VAL  85           HMG      VAL  85   6.534   3.989   3.989
  688   3HG1  VAL  85           HMG      VAL  85   5.634   5.059   5.059
  689   1HG2  VAL  85           HMG      VAL  85   5.157   1.206   1.206
  690   2HG2  VAL  85           HMG      VAL  85   5.437   2.544   2.544
  691   3HG2  VAL  85           HMG      VAL  85   6.569   2.271   2.271
  692    H    LEU  86           HN       LEU  86   2.004   3.862   3.862
  693    HA   LEU  86           HA       LEU  86   2.502   5.688   5.688
  694   1HB   LEU  86           HBR      LEU  86   0.925   5.729   5.729
  695   2HB   LEU  86           HBS      LEU  86  -0.281   5.062   5.062
  696    HG   LEU  86           HG       LEU  86  -0.456   7.011   7.011
  697   1HD1  LEU  86           HMD      LEU  86   2.233   7.814   7.814
  698   2HD1  LEU  86           HMD      LEU  86   1.138   8.949   8.949
  699   3HD1  LEU  86           HMD      LEU  86   1.793   7.543   7.543
  700   1HD2  LEU  86           HMD      LEU  86  -0.056   7.361   7.361
  701   2HD2  LEU  86           HMD      LEU  86  -1.511   7.596   7.596
  702   3HD2  LEU  86           HMD      LEU  86  -0.232   8.837   8.837
  703    H    TYR  87           HN       TYR  87   1.078   2.518   2.518
  704    HA   TYR  87           HA       TYR  87   0.509   2.611   2.611
  705   1HB   TYR  87           HBS      TYR  87  -0.243   0.831   0.831
  706   2HB   TYR  87           HBR      TYR  87   1.366   0.082   0.082
  707    HD1  TYR  87           HD1      TYR  87   2.020   0.038   0.038
  708    HD2  TYR  87           HD2      TYR  87  -1.968   0.342   0.342
  709    HE1  TYR  87           HE1      TYR  87   1.180  -0.748  -0.748
  710    HE2  TYR  87           HE2      TYR  87  -2.810  -0.055  -0.055
  711    HH   TYR  87           HH       TYR  87  -0.629  -1.506  -1.506
  712    H    CYS  88           HN       CYS  88   3.465   1.737   1.737
  713    HA   CYS  88           HA       CYS  88   5.077   0.877   0.877
  714   1HB   CYS  88           HBS      CYS  88   5.876   2.429   2.429
  715   2HB   CYS  88           HBR      CYS  88   6.984   1.644   1.644
  716    H    VAL  89           HN       VAL  89   4.721   4.050   4.050
  717    HA   VAL  89           HA       VAL  89   6.328   5.498   5.498
  718    HB   VAL  89           HB       VAL  89   3.979   6.629   6.629
  719   1HG1  VAL  89           HMG      VAL  89   6.605   7.730   7.730
  720   2HG1  VAL  89           HMG      VAL  89   5.740   8.486   8.486
  721   3HG1  VAL  89           HMG      VAL  89   4.954   8.353   8.353
  722   1HG2  VAL  89           HMG      VAL  89   6.123   5.118   5.118
  723   2HG2  VAL  89           HMG      VAL  89   4.770   5.948   5.948
  724   3HG2  VAL  89           HMG      VAL  89   6.288   6.822   6.822
  725    H    HIS  90           HN       HIS  90   2.810   4.929   4.929
  726    HA   HIS  90           HA       HIS  90   2.228   6.700   6.700
  727   1HB   HIS  90           HBS      HIS  90   0.645   4.386   4.386
  728   2HB   HIS  90           HBR      HIS  90   0.083   5.256   5.256
  729    HD1  HIS  90           HD1      HIS  90   1.404   8.035   8.035
  730    HD2  HIS  90           HD2      HIS  90  -1.336   5.332   5.332
  731    HE1  HIS  90           HE1      HIS  90   0.234   9.228   9.228
  732    HE2  HIS  90           HE2      HIS  90  -1.490   7.627   7.627
  733    H    GLN  91           HN       GLN  91   3.009   3.255   3.255
  734    HA   GLN  91           HA       GLN  91   2.241   2.752   2.752
  735   1HB   GLN  91           HBS      GLN  91   2.289   0.917   0.917
  736   2HB   GLN  91           HBR      GLN  91   4.031   1.182   1.182
  737   1HG   GLN  91           HGS      GLN  91   4.542  -0.137  -0.137
  738   2HG   GLN  91           HGR      GLN  91   3.588   0.889   0.889
  739   1HE2  GLN  91           HE2      GLN  91   2.462  -2.826  -2.826
  740   2HE2  GLN  91           HE2      GLN  91   4.040  -2.170  -2.170
  741    H    ARG  92           HN       ARG  92   5.222   3.626   3.626
  742    HA   ARG  92           HA       ARG  92   6.977   4.380   4.380
  743   1HB   ARG  92           HBR      ARG  92   6.456   2.537   2.537
  744   2HB   ARG  92           HBS      ARG  92   6.851   1.354   1.354
  745   1HG   ARG  92           HGR      ARG  92   9.067   1.538   1.538
  746   2HG   ARG  92           HGS      ARG  92   8.985   3.299   3.299
  747   1HD   ARG  92           HDS      ARG  92   7.836   1.383   1.383
  748   2HD   ARG  92           HDR      ARG  92   9.599   1.659   1.659
  749    HE   ARG  92           HE       ARG  92   9.214   3.964   3.964
  750   1HH1  ARG  92           HH1      ARG  92   6.218   2.109   2.109
  751   2HH1  ARG  92           HH1      ARG  92   5.401   3.152   3.152
  752   1HH2  ARG  92           HH2      ARG  92   8.154   5.232   5.232
  753   2HH2  ARG  92           HH2      ARG  92   6.495   4.921   4.921
  754    H    ILE  93           HN       ILE  93   6.440   1.753   1.753
  755    HA   ILE  93           HA       ILE  93   9.209   1.119   1.119
  756    HB   ILE  93           HB       ILE  93   6.744   0.475   0.475
  757   1HG1  ILE  93           HG1      ILE  93   7.567  -1.805  -1.805
  758   2HG1  ILE  93           HG1      ILE  93   7.693  -0.451  -0.451
  759   1HG2  ILE  93           HMG      ILE  93   9.312   0.130   0.130
  760   2HG2  ILE  93           HMG      ILE  93   8.989  -1.428  -1.428
  761   3HG2  ILE  93           HMG      ILE  93   7.925  -0.869  -0.869
  762   1HD1  ILE  93           HMD      ILE  93   5.286   0.124   0.124
  763   2HD1  ILE  93           HMD      ILE  93   5.286  -1.612  -1.612
  764   3HD1  ILE  93           HMD      ILE  93   5.521  -1.097  -1.097
  765    H    ASP  94           HN       ASP  94  10.633   1.698   1.698
  766    HA   ASP  94           HA       ASP  94   9.664   3.617   3.617
  767   1HB   ASP  94           HBS      ASP  94  11.690   4.844   4.844
  768   2HB   ASP  94           HBR      ASP  94  10.998   4.945   4.945
  769    H    VAL  95           HN       VAL  95  10.479   3.378   3.378
  770    HA   VAL  95           HA       VAL  95  11.999   0.868   0.868
  771    HB   VAL  95           HB       VAL  95  10.351   0.116   0.116
  772   1HG1  VAL  95           HMG      VAL  95   9.776   0.353   0.353
  773   2HG1  VAL  95           HMG      VAL  95   8.528   1.477   1.477
  774   3HG1  VAL  95           HMG      VAL  95   8.552  -0.211  -0.211
  775   1HG2  VAL  95           HMG      VAL  95   9.715   2.924   2.924
  776   2HG2  VAL  95           HMG      VAL  95   9.449   1.504   1.504
  777   3HG2  VAL  95           HMG      VAL  95   8.264   1.918   1.918
  778    H    LYS  96           HN       LYS  96  12.031   0.794   0.794
  779    HA   LYS  96           HA       LYS  96  13.814   3.092   3.092
  780   1HB   LYS  96           HBR      LYS  96  15.272   1.199   1.199
  781   2HB   LYS  96           HBS      LYS  96  14.465   0.183   0.183
  782   1HG   LYS  96           HGR      LYS  96  15.456   1.309   1.309
  783   2HG   LYS  96           HGS      LYS  96  15.760   2.782   2.782
  784   1HD   LYS  96           HDS      LYS  96  17.821   1.597   1.597
  785   2HD   LYS  96           HDR      LYS  96  17.526   1.780   1.780
  786   1HE   LYS  96           HES      LYS  96  18.408  -0.469  -0.469
  787   2HE   LYS  96           HER      LYS  96  17.035  -0.449  -0.449
  788   1HZ   LYS  96           HZA      LYS  96  16.370  -0.438  -0.438
  789   2HZ   LYS  96           HZB      LYS  96  17.032  -1.821  -1.821
  790   3HZ   LYS  96           HZC      LYS  96  15.667  -1.236  -1.236
  791    H    ASP  97           HN       ASP  97  12.453   0.069   0.069
  792    HA   ASP  97           HA       ASP  97  11.144   1.754   1.754
  793   1HB   ASP  97           HBS      ASP  97  11.573   0.129   0.129
  794   2HB   ASP  97           HBR      ASP  97  13.057   0.209   0.209
  795    H    THR  98           HN       THR  98   9.322   0.366   0.366
  796    HA   THR  98           HA       THR  98   7.173  -0.221  -0.221
  797    HB   THR  98           HB       THR  98   7.518  -1.737  -1.737
  798    HG1  THR  98           HG1      THR  98   6.942   0.886   0.886
  799   1HG2  THR  98           HMG      THR  98   5.262  -0.698  -0.698
  800   2HG2  THR  98           HMG      THR  98   5.099  -0.541  -0.541
  801   3HG2  THR  98           HMG      THR  98   5.386  -2.141  -2.141
  802    H    LYS  99           HN       LYS  99   9.428  -2.503  -2.503
  803    HA   LYS  99           HA       LYS  99   7.986  -4.776  -4.776
  804   1HB   LYS  99           HBR      LYS  99  10.781  -4.308  -4.308
  805   2HB   LYS  99           HBS      LYS  99  10.344  -5.917  -5.917
  806   1HG   LYS  99           HGR      LYS  99   8.756  -4.520  -4.520
  807   2HG   LYS  99           HGS      LYS  99  10.129  -5.612  -5.612
  808   1HD   LYS  99           HDR      LYS  99   8.468  -7.085  -7.085
  809   2HD   LYS  99           HDS      LYS  99   8.845  -7.287  -7.287
  810   1HE   LYS  99           HER      LYS  99   6.864  -5.199  -5.199
  811   2HE   LYS  99           HES      LYS  99   6.359  -6.808  -6.808
  812   1HZ   LYS  99           HZA      LYS  99   7.523  -6.757  -6.757
  813   2HZ   LYS  99           HZB      LYS  99   6.086  -5.991  -5.991
  814   3HZ   LYS  99           HZC      LYS  99   6.213  -7.563  -7.563
  815    H    GLU 100           HN       GLU 100  10.456  -2.956  -2.956
  816    HA   GLU 100           HA       GLU 100  10.907  -5.021  -5.021
  817   1HB   GLU 100           HBS      GLU 100  12.587  -3.779  -3.779
  818   2HB   GLU 100           HBR      GLU 100  12.487  -3.337  -3.337
  819   1HG   GLU 100           HGS      GLU 100  12.791  -1.342  -1.342
  820   2HG   GLU 100           HGR      GLU 100  11.111  -1.312  -1.312
  821    H    ALA 101           HN       ALA 101   9.215  -1.878  -1.878
  822    HA   ALA 101           HA       ALA 101   8.165  -1.954  -1.954
  823   1HB   ALA 101           HMB      ALA 101   7.511  -0.593  -0.593
  824   2HB   ALA 101           HMB      ALA 101   6.227  -0.695  -0.695
  825   3HB   ALA 101           HMB      ALA 101   7.783   0.079   0.079
  826    H    LEU 102           HN       LEU 102   6.836  -3.062  -3.062
  827    HA   LEU 102           HA       LEU 102   4.323  -3.844  -3.844
  828   1HB   LEU 102           HBS      LEU 102   5.481  -3.475  -3.475
  829   2HB   LEU 102           HBR      LEU 102   5.325  -5.255  -5.255
  830    HG   LEU 102           HG       LEU 102   2.867  -4.834  -4.834
  831   1HD1  LEU 102           HMD      LEU 102   3.737  -2.174  -2.174
  832   2HD1  LEU 102           HMD      LEU 102   2.841  -2.377  -2.377
  833   3HD1  LEU 102           HMD      LEU 102   2.053  -2.754  -2.754
  834   1HD2  LEU 102           HMD      LEU 102   4.136  -5.448  -5.448
  835   2HD2  LEU 102           HMD      LEU 102   2.383  -5.125  -5.125
  836   3HD2  LEU 102           HMD      LEU 102   3.516  -3.855  -3.855
  837    H    ASP 103           HN       ASP 103   7.412  -5.505  -5.505
  838    HA   ASP 103           HA       ASP 103   6.361  -8.122  -8.122
  839   1HB   ASP 103           HBS      ASP 103   8.642  -7.412  -7.412
  840   2HB   ASP 103           HBR      ASP 103   9.192  -7.424  -7.424
  841    H    LYS 104           HN       LYS 104   8.120  -5.662  -5.662
  842    HA   LYS 104           HA       LYS 104   7.821  -6.859  -6.859
  843   1HB   LYS 104           HBS      LYS 104   8.979  -4.585  -4.585
  844   2HB   LYS 104           HBR      LYS 104   7.534  -3.890  -3.890
  845   1HG   LYS 104           HGR      LYS 104   9.551  -5.754  -5.754
  846   2HG   LYS 104           HGS      LYS 104   9.445  -3.984  -3.984
  847   1HD   LYS 104           HDR      LYS 104   8.207  -4.426  -4.426
  848   2HD   LYS 104           HDS      LYS 104   6.915  -4.695  -4.695
  849   1HE   LYS 104           HER      LYS 104   7.134  -6.455  -6.455
  850   2HE   LYS 104           HES      LYS 104   7.298  -7.083  -7.083
  851   1HZ   LYS 104           HZA      LYS 104   9.609  -6.372  -6.372
  852   2HZ   LYS 104           HZB      LYS 104   8.965  -7.873  -7.873
  853   3HZ   LYS 104           HZC      LYS 104   9.595  -7.244  -7.244
  854    H    ILE 105           HN       ILE 105   5.442  -5.260  -5.260
  855    HA   ILE 105           HA       ILE 105   3.607  -5.149  -5.149
  856    HB   ILE 105           HB       ILE 105   4.103  -3.544  -3.544
  857   1HG1  ILE 105           HG1      ILE 105   3.835  -1.692  -1.692
  858   2HG1  ILE 105           HG1      ILE 105   3.249  -2.789  -2.789
  859   1HG2  ILE 105           HMG      ILE 105   1.339  -4.081  -4.081
  860   2HG2  ILE 105           HMG      ILE 105   1.792  -2.364  -2.364
  861   3HG2  ILE 105           HMG      ILE 105   1.970  -3.470  -3.470
  862   1HD1  ILE 105           HMD      ILE 105   5.970  -3.143  -3.143
  863   2HD1  ILE 105           HMD      ILE 105   5.711  -1.981  -1.981
  864   3HD1  ILE 105           HMD      ILE 105   5.385  -3.717  -3.717
  865    H    GLU 106           HN       GLU 106   4.176  -6.871  -6.871
  866    HA   GLU 106           HA       GLU 106   1.607  -8.271  -8.271
  867   1HB   GLU 106           HBR      GLU 106   3.062  -8.103  -8.103
  868   2HB   GLU 106           HBS      GLU 106   4.359  -8.669  -8.669
  869   1HG   GLU 106           HGR      GLU 106   3.769 -10.881 -10.881
  870   2HG   GLU 106           HGS      GLU 106   2.100 -10.434 -10.434
  871    H    GLU 107           HN       GLU 107   4.498  -8.203  -8.203
  872    HA   GLU 107           HA       GLU 107   3.897 -10.790 -10.790
  873   1HB   GLU 107           HBR      GLU 107   6.179  -9.722  -9.722
  874   2HB   GLU 107           HBS      GLU 107   5.910  -8.681  -8.681
  875   1HG   GLU 107           HGS      GLU 107   7.351 -10.009 -10.009
  876   2HG   GLU 107           HGR      GLU 107   5.840 -10.680 -10.680
  877    H    GLU 108           HN       GLU 108   2.226  -8.190  -8.190
  878    HA   GLU 108           HA       GLU 108   0.617  -7.411  -7.411
  879   1HB   GLU 108           HBR      GLU 108   1.249  -9.938  -9.938
  880   2HB   GLU 108           HBS      GLU 108   1.667  -8.980  -8.980
  881   1HG   GLU 108           HGS      GLU 108  -0.265  -9.636  -9.636
  882   2HG   GLU 108           HGR      GLU 108  -0.692  -8.034  -8.034
  883    H    GLN 109           HN       GLN 109   3.629  -6.711  -6.711
  884    HA   GLN 109           HA       GLN 109   4.831  -4.918  -4.918
  885   1HB   GLN 109           HBR      GLN 109   3.562  -2.966  -2.966
  886   2HB   GLN 109           HBS      GLN 109   2.638  -4.074  -4.074
  887   1HG   GLN 109           HGS      GLN 109   1.916  -4.209  -4.209
  888   2HG   GLN 109           HGR      GLN 109   1.607  -2.632  -2.632
  889   1HE2  GLN 109           HE2      GLN 109  -1.145  -5.345  -5.345
  890   2HE2  GLN 109           HE2      GLN 109  -0.086  -4.964  -4.964
  891    H    ASN 110           HN       ASN 110   5.266  -6.756  -6.756
  892    HA   ASN 110           HA       ASN 110   5.989  -7.088  -7.088
  893   1HB   ASN 110           HBS      ASN 110   5.028  -4.406  -4.406
  894   2HB   ASN 110           HBR      ASN 110   6.365  -5.427  -5.427
  895   1HD2  ASN 110           HD2      ASN 110   8.727  -4.367  -4.367
  896   2HD2  ASN 110           HD2      ASN 110   8.250  -5.709  -5.709
  897    H    LYS 111           HN       LYS 111   5.074  -8.126  -8.126
  898    HA   LYS 111           HA       LYS 111   3.411  -9.386  -9.386
  899   1HB   LYS 111           HBR      LYS 111   2.322  -7.096  -7.096
  900   2HB   LYS 111           HBS      LYS 111   1.325  -7.427  -7.427
  901   1HG   LYS 111           HGR      LYS 111  -0.092  -8.429  -8.429
  902   2HG   LYS 111           HGS      LYS 111   1.084  -9.775  -9.775
  903   1HD   LYS 111           HDS      LYS 111   2.210  -8.269  -8.269
  904   2HD   LYS 111           HDR      LYS 111   0.578  -7.677  -7.677
  905   1HE   LYS 111           HES      LYS 111   0.189 -10.398 -10.398
  906   2HE   LYS 111           HER      LYS 111   1.717 -10.219 -10.219
  907   1HZ   LYS 111           HZA      LYS 111  -0.602  -8.575  -8.575
  908   2HZ   LYS 111           HZB      LYS 111  -0.481 -10.096 -10.096
  909   3HZ   LYS 111           HZC      LYS 111   0.668  -8.992  -8.992
  910    H    SER 112           HN       SER 112   3.919 -10.900 -10.900
  911    HA   SER 112           HA       SER 112   2.265 -10.799 -10.799
  912   1HB   SER 112           HBS      SER 112   4.081 -11.856 -11.856
  913   2HB   SER 112           HBR      SER 112   4.682 -10.392 -10.392
  914    HG   SER 112           HG       SER 112   6.213 -11.753 -11.753
  915    H    LYS 113           HN       LYS 113   1.890 -12.888 -12.888
  916    HA   LYS 113           HA       LYS 113   1.322 -15.103 -15.103
  917   1HB   LYS 113           HBR      LYS 113   3.015 -15.380 -15.380
  918   2HB   LYS 113           HBS      LYS 113   2.427 -16.702 -16.702
  919   1HG   LYS 113           HGR      LYS 113   4.002 -14.583 -14.583
  920   2HG   LYS 113           HGS      LYS 113   4.902 -15.582 -15.582
  921   1HD   LYS 113           HDS      LYS 113   5.206 -16.721 -16.721
  922   2HD   LYS 113           HDR      LYS 113   3.945 -17.594 -17.594
  923   1HE   LYS 113           HES      LYS 113   2.420 -17.207 -17.207
  924   2HE   LYS 113           HER      LYS 113   2.920 -15.502 -15.502
  925   1HZ   LYS 113           HZB      LYS 113   4.884 -17.266 -17.266
  926   2HZ   LYS 113           HZC      LYS 113   3.455 -17.537 -17.537
  927   3HZ   LYS 113           HZA      LYS 113   4.117 -16.045 -16.045
  928    H    LYS 114           HN       LYS 114  -0.297 -16.412 -16.412
  929    HA   LYS 114           HA       LYS 114  -1.258 -16.155 -16.155
  930   1HB   LYS 114           HBR      LYS 114  -2.911 -15.613 -15.613
  931   2HB   LYS 114           HBS      LYS 114  -3.647 -16.472 -16.472
  932   1HG   LYS 114           HGR      LYS 114  -2.297 -14.260 -14.260
  933   2HG   LYS 114           HGS      LYS 114  -3.109 -13.638 -13.638
  934   1HD   LYS 114           HDS      LYS 114  -5.234 -14.444 -14.444
  935   2HD   LYS 114           HDR      LYS 114  -4.507 -15.296 -15.296
  936   1HE   LYS 114           HES      LYS 114  -4.333 -12.305 -12.305
  937   2HE   LYS 114           HER      LYS 114  -5.660 -13.152 -13.152
  938   1HZ   LYS 114           HZC      LYS 114  -3.891 -14.210 -14.210
  939   2HZ   LYS 114           HZA      LYS 114  -2.807 -13.181 -13.181
  940   3HZ   LYS 114           HZB      LYS 114  -4.043 -12.602 -12.602
  941    H    LYS 115           HN       LYS 115   0.214 -18.011 -18.011
  942    HA   LYS 115           HA       LYS 115  -1.667 -20.256 -20.256
  943   1HB   LYS 115           HBR      LYS 115   0.528 -19.279 -19.279
  944   2HB   LYS 115           HBS      LYS 115   0.981 -20.895 -20.895
  945   1HG   LYS 115           HGR      LYS 115  -1.573 -21.354 -21.354
  946   2HG   LYS 115           HGS      LYS 115  -1.025 -20.115 -20.115
  947   1HD   LYS 115           HDS      LYS 115   0.757 -22.437 -22.437
  948   2HD   LYS 115           HDR      LYS 115  -0.664 -22.696 -22.696
  949   1HE   LYS 115           HES      LYS 115   0.251 -20.524 -20.524
  950   2HE   LYS 115           HER      LYS 115   1.786 -21.175 -21.175
  951   1HZ   LYS 115           HZA      LYS 115   1.150 -23.296 -23.296
  952   2HZ   LYS 115           HZB      LYS 115  -0.141 -22.581 -22.581
  953   3HZ   LYS 115           HZC      LYS 115   1.370 -22.108 -22.108
  954    H    ALA 116           HN       ALA 116  -1.895 -21.344 -21.344
  955    HA   ALA 116           HA       ALA 116  -0.054 -21.382 -21.382
  956   1HB   ALA 116           HMB      ALA 116  -2.652 -22.304 -22.304
  957   2HB   ALA 116           HMB      ALA 116  -1.729 -23.743 -23.743
  958   3HB   ALA 116           HMB      ALA 116  -1.765 -22.301 -22.301
  959    H    GLN 117           HN       GLN 117   1.239 -23.012 -23.012
  960    HA   GLN 117           HA       GLN 117   2.651 -24.786 -24.786
  961   1HB   GLN 117           HBR      GLN 117   0.551 -25.784 -25.784
  962   2HB   GLN 117           HBS      GLN 117   2.058 -26.718 -26.718
  963   1HG   GLN 117           HGS      GLN 117   0.360 -27.566 -27.566
  964   2HG   GLN 117           HGR      GLN 117   1.645 -26.766 -26.766
  965   1HE2  GLN 117           HE2      GLN 117  -2.188 -25.722 -25.722
  966   2HE2  GLN 117           HE2      GLN 117  -1.618 -27.157 -27.157
  967    H    GLN 118           HN       GLN 118   1.974 -25.160 -25.160
  968    HA   GLN 118           HA       GLN 118   4.517 -24.041 -24.041
  969   1HB   GLN 118           HBR      GLN 118   4.297 -26.894 -26.894
  970   2HB   GLN 118           HBS      GLN 118   4.995 -26.556 -26.556
  971   1HG   GLN 118           HGS      GLN 118   6.102 -24.794 -24.794
  972   2HG   GLN 118           HGR      GLN 118   6.301 -26.510 -26.510
  973   1HE2  GLN 118           HE2      GLN 118   9.263 -25.444 -25.444
  974   2HE2  GLN 118           HE2      GLN 118   8.472 -24.927 -24.927
  975    H    ALA 119           HN       ALA 119   2.650 -26.873 -26.873
  976    HA   ALA 119           HA       ALA 119   1.445 -25.515 -25.515
  977   1HB   ALA 119           HMB      ALA 119   3.928 -25.549 -25.549
  978   2HB   ALA 119           HMB      ALA 119   3.797 -27.325 -27.325
  979   3HB   ALA 119           HMB      ALA 119   2.865 -26.314 -26.314
  980    H    ALA 120           HN       ALA 120   0.601 -27.251 -27.251
  981    HA   ALA 120           HA       ALA 120  -0.865 -28.995 -28.995
  982   1HB   ALA 120           HMB      ALA 120  -1.767 -28.220 -28.220
  983   2HB   ALA 120           HMB      ALA 120  -0.719 -29.442 -29.442
  984   3HB   ALA 120           HMB      ALA 120  -1.991 -29.947 -29.947
  985    H    ALA 121           HN       ALA 121  -0.465 -30.984 -30.984
  986    HA   ALA 121           HA       ALA 121   2.189 -31.819 -31.819
  987   1HB   ALA 121           HMB      ALA 121   0.037 -32.355 -32.355
  988   2HB   ALA 121           HMB      ALA 121   0.066 -33.849 -33.849
  989   3HB   ALA 121           HMB      ALA 121   1.487 -33.392 -33.392
  990    H    ASP 122           HN       ASP 122   3.330 -32.448 -32.448
  991    HA   ASP 122           HA       ASP 122   2.095 -33.532 -33.532
  992   1HB   ASP 122           HBS      ASP 122   4.389 -33.630 -33.630
  993   2HB   ASP 122           HBR      ASP 122   3.885 -32.033 -32.033
  994    H    THR 123           HN       THR 123   4.074 -34.926 -34.926
  995    HA   THR 123           HA       THR 123   3.304 -37.615 -37.615
  996    HB   THR 123           HB       THR 123   5.450 -38.226 -38.226
  997    HG1  THR 123           HG1      THR 123   6.028 -36.652 -36.652
  998   1HG2  THR 123           HMG      THR 123   5.053 -38.375 -38.375
  999   2HG2  THR 123           HMG      THR 123   6.210 -37.020 -37.020
 1000   3HG2  THR 123           HMG      THR 123   6.675 -38.579 -38.579
 1001    H    GLY 124           HN       GLY 124   1.385 -37.672 -37.672
 1002   1HA   GLY 124           HAR      GLY 124   1.778 -38.157 -38.157
 1003   2HA   GLY 124           HAS      GLY 124   0.238 -37.586 -37.586
 1004    H    ASN 125           HN       ASN 125  -1.178 -39.022 -39.022
 1005    HA   ASN 125           HA       ASN 125  -0.223 -41.777 -41.777
 1006   1HB   ASN 125           HBS      ASN 125  -2.835 -40.993 -40.993
 1007   2HB   ASN 125           HBR      ASN 125  -2.475 -42.612 -42.612
 1008   1HD2  ASN 125           HD2      ASN 125  -1.774 -42.326 -42.326
 1009   2HD2  ASN 125           HD2      ASN 125  -3.111 -41.797 -41.797
 1010    H    ASN 126           HN       ASN 126  -3.394 -40.294 -40.294
 1011    HA   ASN 126           HA       ASN 126  -4.663 -40.170 -40.170
 1012   1HB   ASN 126           HBS      ASN 126  -2.593 -38.519 -38.519
 1013   2HB   ASN 126           HBR      ASN 126  -2.316 -39.534 -39.534
 1014   1HD2  ASN 126           HD2      ASN 126  -5.706 -37.174 -37.174
 1015   2HD2  ASN 126           HD2      ASN 126  -4.894 -37.708 -37.708
 1016    H    SER 127           HN       SER 127  -3.252 -42.749 -42.749
 1017    HA   SER 127           HA       SER 127  -4.477 -44.099 -44.099
 1018   1HB   SER 127           HBS      SER 127  -2.668 -45.409 -45.409
 1019   2HB   SER 127           HBR      SER 127  -2.188 -43.692 -43.692
 1020    HG   SER 127           HG       SER 127  -0.431 -44.500 -44.500
 1021    H    GLN 128           HN       GLN 128  -3.852 -46.620 -46.620
 1022    HA   GLN 128           HA       GLN 128  -4.612 -47.053 -47.053
 1023   1HB   GLN 128           HBR      GLN 128  -6.217 -47.447 -47.447
 1024   2HB   GLN 128           HBS      GLN 128  -5.391 -49.031 -49.031
 1025   1HG   GLN 128           HGS      GLN 128  -6.502 -49.710 -49.710
 1026   2HG   GLN 128           HGR      GLN 128  -6.261 -48.152 -48.152
 1027   1HE2  GLN 128           HE2      GLN 128  -9.321 -46.723 -46.723
 1028   2HE2  GLN 128           HE2      GLN 128  -7.685 -46.395 -46.395
 1029    H    VAL 129           HN       VAL 129  -2.706 -48.252 -48.252
 1030    HA   VAL 129           HA       VAL 129  -1.722 -50.472 -50.472
 1031    HB   VAL 129           HB       VAL 129  -1.714 -50.088 -50.088
 1032   1HG1  VAL 129           HMG      VAL 129  -0.521 -52.215 -52.215
 1033   2HG1  VAL 129           HMG      VAL 129  -1.217 -52.664 -52.664
 1034   3HG1  VAL 129           HMG      VAL 129   0.100 -51.469 -51.469
 1035   1HG2  VAL 129           HMG      VAL 129  -3.489 -51.646 -51.646
 1036   2HG2  VAL 129           HMG      VAL 129  -3.929 -50.500 -50.500
 1037   3HG2  VAL 129           HMG      VAL 129  -3.293 -52.109 -52.109
 1038    H    SER 130           HN       SER 130  -0.278 -49.215 -49.215
 1039    HA   SER 130           HA       SER 130   2.339 -49.465 -49.465
 1040   1HB   SER 130           HBS      SER 130   2.916 -46.980 -46.980
 1041   2HB   SER 130           HBR      SER 130   2.369 -47.422 -47.422
 1042    HG   SER 130           HG       SER 130   0.978 -45.938 -45.938
 1043    H    GLN 131           HN       GLN 131   1.081 -47.147 -47.147
 1044    HA   GLN 131           HA       GLN 131   1.272 -49.022 -49.022
 1045   1HB   GLN 131           HBR      GLN 131   2.931 -47.847 -47.847
 1046   2HB   GLN 131           HBS      GLN 131   3.631 -48.647 -48.647
 1047   1HG   GLN 131           HGS      GLN 131   2.883 -45.822 -45.822
 1048   2HG   GLN 131           HGR      GLN 131   4.173 -46.096 -46.096
 1049   1HE2  GLN 131           HE2      GLN 131   6.595 -47.219 -47.219
 1050   2HE2  GLN 131           HE2      GLN 131   6.048 -47.302 -47.302
 1051    H    ASN 132           HN       ASN 132  -0.586 -48.555 -48.555
 1052    HA   ASN 132           HA       ASN 132  -1.582 -45.821 -45.821
 1053   1HB   ASN 132           HBS      ASN 132  -2.757 -48.196 -48.196
 1054   2HB   ASN 132           HBR      ASN 132  -3.309 -47.886 -47.886
 1055   1HD2  ASN 132           HD2      ASN 132  -5.534 -45.315 -45.315
 1056   2HD2  ASN 132           HD2      ASN 132  -4.737 -46.213 -46.213
 1057    H    TYR 133           HN       TYR 133  -1.021 -48.271 -48.271
 1058    HA   TYR 133           HA       TYR 133  -0.433 -48.052 -48.052
 1059   1HB   TYR 133           HBS      TYR 133   1.066 -46.269 -46.269
 1060   2HB   TYR 133           HBR      TYR 133   0.168 -45.142 -45.142
 1061    HD1  TYR 133           HD2      TYR 133   2.454 -48.066 -48.066
 1062    HD2  TYR 133           HD1      TYR 133   0.755 -44.934 -44.934
 1063    HE1  TYR 133           HE2      TYR 133   3.971 -48.623 -48.623
 1064    HE2  TYR 133           HE1      TYR 133   2.289 -45.462 -45.462
 1065    HH   TYR 133           HH       TYR 133   3.548 -48.362 -48.362

  Start of MODEL    8
    1   1H    HIS   1           HNC      HIS   1   8.088  27.561  27.561
    2   2H    HIS   1           HN       HIS   1   8.870  27.566  27.566
    3   3H    HIS   1           HNB      HIS   1   8.309  28.965  28.965
    4    HA   HIS   1           HA       HIS   1   9.914  29.194  29.194
    5   1HB   HIS   1           HBS      HIS   1  10.910  28.012  28.012
    6   2HB   HIS   1           HBR      HIS   1  12.039  27.864  27.864
    7    HD1  HIS   1           HD1      HIS   1   9.750  30.884  30.884
    8    HD2  HIS   1           HD2      HIS   1  13.765  29.833  29.833
    9    HE1  HIS   1           HE1      HIS   1  11.031  33.032  33.032
   10    HE2  HIS   1           HE2      HIS   1  13.463  32.403  32.403
   11    H    MET   2           HN       MET   2   9.019  25.943  25.943
   12    HA   MET   2           HA       MET   2  10.193  25.015  25.015
   13   1HB   MET   2           HBR      MET   2  11.149  23.057  23.057
   14   2HB   MET   2           HBS      MET   2  11.858  24.514  24.514
   15   1HG   MET   2           HGS      MET   2   9.483  23.129  23.129
   16   2HG   MET   2           HGR      MET   2  11.119  22.467  22.467
   17   1HE   MET   2           HME      MET   2  12.674  23.068  23.068
   18   2HE   MET   2           HME      MET   2  13.258  24.748  24.748
   19   3HE   MET   2           HME      MET   2  12.447  23.996  23.996
   20    H    GLY   3           HN       GLY   3   9.132  23.385  23.385
   21   1HA   GLY   3           HAS      GLY   3   7.714  21.489  21.489
   22   2HA   GLY   3           HAR      GLY   3   6.900  22.050  22.050
   23    H    ALA   4           HN       ALA   4   4.914  22.741  22.741
   24    HA   ALA   4           HA       ALA   4   2.993  23.518  23.518
   25   1HB   ALA   4           HMB      ALA   4   4.996  25.321  25.321
   26   2HB   ALA   4           HMB      ALA   4   3.999  24.927  24.927
   27   3HB   ALA   4           HMB      ALA   4   3.231  25.561  25.561
   28    H    ARG   5           HN       ARG   5   4.692  21.148  21.148
   29    HA   ARG   5           HA       ARG   5   2.768  20.451  20.451
   30   1HB   ARG   5           HBS      ARG   5   5.740  19.891  19.891
   31   2HB   ARG   5           HBR      ARG   5   4.447  19.226  19.226
   32   1HG   ARG   5           HGS      ARG   5   3.970  21.362  21.362
   33   2HG   ARG   5           HGR      ARG   5   4.970  22.197  22.197
   34   1HD   ARG   5           HDS      ARG   5   6.623  20.290  20.290
   35   2HD   ARG   5           HDR      ARG   5   5.711  21.114  21.114
   36    HE   ARG   5           HE       ARG   5   6.710  23.171  23.171
   37   1HH1  ARG   5           HH1      ARG   5   7.661  20.607  20.607
   38   2HH1  ARG   5           HH1      ARG   5   9.099  21.429  21.429
   39   1HH2  ARG   5           HH2      ARG   5   8.664  24.156  24.156
   40   2HH2  ARG   5           HH2      ARG   5   9.667  23.439  23.439
   41    H    ALA   6           HN       ALA   6   2.111  18.356  18.356
   42    HA   ALA   6           HA       ALA   6   3.204  16.389  16.389
   43   1HB   ALA   6           HMB      ALA   6   1.251  18.421  18.421
   44   2HB   ALA   6           HMB      ALA   6   0.896  16.727  16.727
   45   3HB   ALA   6           HMB      ALA   6   2.447  17.463  17.463
   46    H    SER   7           HN       SER   7   0.446  17.674  17.674
   47    HA   SER   7           HA       SER   7  -1.451  16.682  16.682
   48   1HB   SER   7           HBS      SER   7   0.180  16.972  16.972
   49   2HB   SER   7           HBR      SER   7   1.252  15.742  15.742
   50    HG   SER   7           HG       SER   7  -1.273  15.421  15.421
   51    H    VAL   8           HN       VAL   8  -0.795  13.777  13.777
   52    HA   VAL   8           HA       VAL   8  -2.045  12.027  12.027
   53    HB   VAL   8           HB       VAL   8   0.095  11.726  11.726
   54   1HG1  VAL   8           HMG      VAL   8  -1.213   9.678   9.678
   55   2HG1  VAL   8           HMG      VAL   8  -1.023   9.276   9.276
   56   3HG1  VAL   8           HMG      VAL   8   0.402   9.697   9.697
   57   1HG2  VAL   8           HMG      VAL   8  -2.828  11.965  11.965
   58   2HG2  VAL   8           HMG      VAL   8  -1.600  12.278  12.278
   59   3HG2  VAL   8           HMG      VAL   8  -2.177  10.618  10.618
   60    H    LEU   9           HN       LEU   9   1.383  12.790  12.790
   61    HA   LEU   9           HA       LEU   9   2.166  10.744  10.744
   62   1HB   LEU   9           HBR      LEU   9   3.560  12.644  12.644
   63   2HB   LEU   9           HBS      LEU   9   4.476  11.572  11.572
   64    HG   LEU   9           HG       LEU   9   2.433  10.471  10.471
   65   1HD1  LEU   9           HMD      LEU   9   5.328  11.196  11.196
   66   2HD1  LEU   9           HMD      LEU   9   4.424  10.006  10.006
   67   3HD1  LEU   9           HMD      LEU   9   3.886  11.703  11.703
   68   1HD2  LEU   9           HMD      LEU   9   4.830   9.478   9.478
   69   2HD2  LEU   9           HMD      LEU   9   3.136   8.933   8.933
   70   3HD2  LEU   9           HMD      LEU   9   4.117   8.550   8.550
   71    H    SER  10           HN       SER  10   4.562  11.736  11.736
   72    HA   SER  10           HA       SER  10   3.700  13.965  13.965
   73   1HB   SER  10           HBS      SER  10   5.130  13.250  13.250
   74   2HB   SER  10           HBR      SER  10   4.310  11.763  11.763
   75    HG   SER  10           HG       SER  10   6.805  12.046  12.046
   76    H    GLY  11           HN       GLY  11   5.903  15.063  15.063
   77   1HA   GLY  11           HAR      GLY  11   7.041  16.464  16.464
   78   2HA   GLY  11           HAS      GLY  11   7.779  16.313  16.313
   79    H    GLY  12           HN       GLY  12   8.863  14.113  14.113
   80   1HA   GLY  12           HAR      GLY  12  10.995  13.752  13.752
   81   2HA   GLY  12           HAS      GLY  12  10.481  12.555  12.555
   82    H    GLU  13           HN       GLU  13   7.973  11.859  11.859
   83    HA   GLU  13           HA       GLU  13   8.797   9.759   9.759
   84   1HB   GLU  13           HBR      GLU  13   6.112  10.829  10.829
   85   2HB   GLU  13           HBS      GLU  13   6.275   9.503   9.503
   86   1HG   GLU  13           HGS      GLU  13   7.144   8.123   8.123
   87   2HG   GLU  13           HGR      GLU  13   7.473   9.408   9.408
   88    H    LEU  14           HN       LEU  14   7.691  12.951  12.951
   89    HA   LEU  14           HA       LEU  14   7.023  12.427  12.427
   90   1HB   LEU  14           HBR      LEU  14   6.376  14.370  14.370
   91   2HB   LEU  14           HBS      LEU  14   7.769  15.131  15.131
   92    HG   LEU  14           HG       LEU  14   6.669  15.159  15.159
   93   1HD1  LEU  14           HMD      LEU  14   4.832  13.180  13.180
   94   2HD1  LEU  14           HMD      LEU  14   4.194  14.244  14.244
   95   3HD1  LEU  14           HMD      LEU  14   5.567  13.161  13.161
   96   1HD2  LEU  14           HMD      LEU  14   5.886  16.619  16.619
   97   2HD2  LEU  14           HMD      LEU  14   5.070  16.727  16.727
   98   3HD2  LEU  14           HMD      LEU  14   4.354  15.751  15.751
   99    H    ASP  15           HN       ASP  15   9.655  13.986  13.986
  100    HA   ASP  15           HA       ASP  15  11.530  14.077  14.077
  101   1HB   ASP  15           HBR      ASP  15  12.025  13.792  13.792
  102   2HB   ASP  15           HBS      ASP  15  13.245  14.221  14.221
  103    H    LYS  16           HN       LYS  16  10.206  11.387  11.387
  104    HA   LYS  16           HA       LYS  16  12.241   9.576   9.576
  105   1HB   LYS  16           HBS      LYS  16  10.005   9.375   9.375
  106   2HB   LYS  16           HBR      LYS  16  10.165   7.985   7.985
  107   1HG   LYS  16           HGS      LYS  16  11.481   7.335   7.335
  108   2HG   LYS  16           HGR      LYS  16  12.685   8.046   8.046
  109   1HD   LYS  16           HDS      LYS  16  11.570  10.065  10.065
  110   2HD   LYS  16           HDR      LYS  16  12.074   8.693   8.693
  111   1HE   LYS  16           HES      LYS  16  13.958   9.713   9.713
  112   2HE   LYS  16           HER      LYS  16  13.729  10.636  10.636
  113   1HZ   LYS  16           HZB      LYS  16  14.010   8.018   8.018
  114   2HZ   LYS  16           HZC      LYS  16  15.156   8.256   8.256
  115   3HZ   LYS  16           HZA      LYS  16  15.108   9.212   9.212
  116    H    TRP  17           HN       TRP  17   8.758  10.301  10.301
  117    HA   TRP  17           HA       TRP  17   8.374   8.484   8.484
  118   1HB   TRP  17           HBS      TRP  17   6.557   9.276   9.276
  119   2HB   TRP  17           HBR      TRP  17   6.763  10.938  10.938
  120    HD1  TRP  17           HD1      TRP  17   6.340  11.108  11.108
  121    HE1  TRP  17           HE1      TRP  17   4.862   9.719   9.719
  122    HE3  TRP  17           HE3      TRP  17   5.283   7.259   7.259
  123    HZ2  TRP  17           HZ2      TRP  17   3.262   7.421   7.421
  124    HZ3  TRP  17           HZ3      TRP  17   3.680   5.553   5.553
  125    HH2  TRP  17           HH2      TRP  17   2.726   5.593   5.593
  126    H    GLU  18           HN       GLU  18   9.808  11.594  11.594
  127    HA   GLU  18           HA       GLU  18   9.181  12.151  12.151
  128   1HB   GLU  18           HBR      GLU  18   9.603  13.573  13.573
  129   2HB   GLU  18           HBS      GLU  18  11.226  13.344  13.344
  130   1HG   GLU  18           HGR      GLU  18  10.268  14.447  14.447
  131   2HG   GLU  18           HGS      GLU  18   9.497  15.277  15.277
  132    H    LYS  19           HN       LYS  19  10.676   9.674   9.674
  133    HA   LYS  19           HA       LYS  19  11.843   9.882   9.882
  134   1HB   LYS  19           HBS      LYS  19  13.719  11.105  11.105
  135   2HB   LYS  19           HBR      LYS  19  14.015   9.759   9.759
  136   1HG   LYS  19           HGS      LYS  19  15.389   8.839   8.839
  137   2HG   LYS  19           HGR      LYS  19  14.015   8.646   8.646
  138   1HD   LYS  19           HDS      LYS  19  14.473  11.041  11.041
  139   2HD   LYS  19           HDR      LYS  19  15.914  10.978  10.978
  140   1HE   LYS  19           HER      LYS  19  16.961   9.412   9.412
  141   2HE   LYS  19           HES      LYS  19  15.436   8.912   8.912
  142   1HZ   LYS  19           HZB      LYS  19  15.375  11.187  11.187
  143   2HZ   LYS  19           HZC      LYS  19  16.889  11.436  11.436
  144   3HZ   LYS  19           HZA      LYS  19  16.610  10.275  10.275
  145    H    ILE  20           HN       ILE  20  10.264   8.150   8.150
  146    HA   ILE  20           HA       ILE  20  11.585   5.652   5.652
  147    HB   ILE  20           HB       ILE  20   8.647   6.428   6.428
  148   1HG1  ILE  20           HG1      ILE  20  10.353   4.884   4.884
  149   2HG1  ILE  20           HG1      ILE  20  10.248   6.671   6.671
  150   1HG2  ILE  20           HMG      ILE  20   8.804   4.273   4.273
  151   2HG2  ILE  20           HMG      ILE  20   9.549   3.550   3.550
  152   3HG2  ILE  20           HMG      ILE  20   7.891   4.201   4.201
  153   1HD1  ILE  20           HMD      ILE  20   7.627   5.374   5.374
  154   2HD1  ILE  20           HMD      ILE  20   8.632   4.962   4.962
  155   3HD1  ILE  20           HMD      ILE  20   8.286   6.669   6.669
  156    H    ARG  21           HN       ARG  21  10.810   3.778   3.778
  157    HA   ARG  21           HA       ARG  21  11.057   4.710   4.710
  158   1HB   ARG  21           HBR      ARG  21  12.344   2.368   2.368
  159   2HB   ARG  21           HBS      ARG  21  12.424   2.658   2.658
  160   1HG   ARG  21           HGR      ARG  21  13.346   5.027   5.027
  161   2HG   ARG  21           HGS      ARG  21  13.836   4.024   4.024
  162   1HD   ARG  21           HDS      ARG  21  15.148   2.620   2.620
  163   2HD   ARG  21           HDR      ARG  21  14.412   3.229   3.229
  164    HE   ARG  21           HE       ARG  21  16.019   4.864   4.864
  165   1HH1  ARG  21           HH1      ARG  21  15.798   3.595   3.595
  166   2HH1  ARG  21           HH1      ARG  21  16.963   4.713   4.713
  167   1HH2  ARG  21           HH2      ARG  21  17.441   6.393   6.393
  168   2HH2  ARG  21           HH2      ARG  21  17.893   6.296   6.296
  169    H    LEU  22           HN       LEU  22   9.603   4.034   4.034
  170    HA   LEU  22           HA       LEU  22   8.349   1.366   1.366
  171   1HB   LEU  22           HBR      LEU  22   6.726   2.102   2.102
  172   2HB   LEU  22           HBS      LEU  22   6.641   3.009   3.009
  173    HG   LEU  22           HG       LEU  22   8.224   4.150   4.150
  174   1HD1  LEU  22           HMD      LEU  22   5.660   3.317   3.317
  175   2HD1  LEU  22           HMD      LEU  22   5.395   4.968   4.968
  176   3HD1  LEU  22           HMD      LEU  22   6.451   4.701   4.701
  177   1HD2  LEU  22           HMD      LEU  22   6.573   5.132   5.132
  178   2HD2  LEU  22           HMD      LEU  22   8.326   5.301   5.301
  179   3HD2  LEU  22           HMD      LEU  22   7.177   6.218   6.218
  180    H    ARG  23           HN       ARG  23   7.770   1.075   1.075
  181    HA   ARG  23           HA       ARG  23   9.667   2.003   2.003
  182   1HB   ARG  23           HBR      ARG  23  11.007   0.005   0.005
  183   2HB   ARG  23           HBS      ARG  23  11.388   0.677   0.677
  184   1HG   ARG  23           HGS      ARG  23   9.460  -1.250  -1.250
  185   2HG   ARG  23           HGR      ARG  23  10.448  -1.984  -1.984
  186   1HD   ARG  23           HDS      ARG  23  11.439  -0.825  -0.825
  187   2HD   ARG  23           HDR      ARG  23  11.330  -2.554  -2.554
  188    HE   ARG  23           HE       ARG  23  12.908  -1.306  -1.306
  189   1HH1  ARG  23           HH1      ARG  23  13.065  -1.623  -1.623
  190   2HH1  ARG  23           HH1      ARG  23  14.786  -1.807  -1.807
  191   1HH2  ARG  23           HH2      ARG  23  15.143  -1.679  -1.679
  192   2HH2  ARG  23           HH2      ARG  23  15.964  -1.838  -1.838
  193    HA   PRO  24           HA       PRO  24   5.688   0.188   0.188
  194   1HB   PRO  24           HBR      PRO  24   5.636   2.331   2.331
  195   2HB   PRO  24           HBS      PRO  24   4.534   1.952   1.952
  196   1HG   PRO  24           HGS      PRO  24   6.173   4.029   4.029
  197   2HG   PRO  24           HGR      PRO  24   5.353   3.408   3.408
  198   1HD   PRO  24           HDS      PRO  24   8.082   3.157   3.157
  199   2HD   PRO  24           HDR      PRO  24   7.346   2.947   2.947
  200    H    GLY  25           HN       GLY  25   8.597   0.975   0.975
  201   1HA   GLY  25           HAR      GLY  25   8.549  -1.613  -1.613
  202   2HA   GLY  25           HAS      GLY  25   8.488  -0.318  -0.318
  203    H    GLY  26           HN       GLY  26  10.054   0.032   0.032
  204   1HA   GLY  26           HAS      GLY  26  12.425  -0.439  -0.439
  205   2HA   GLY  26           HAR      GLY  26  12.706   0.122   0.122
  206    H    LYS  27           HN       LYS  27  12.739   0.958   0.958
  207    HA   LYS  27           HA       LYS  27  13.457   2.839   2.839
  208   1HB   LYS  27           HBS      LYS  27  15.204   2.489   2.489
  209   2HB   LYS  27           HBR      LYS  27  14.352   3.704   3.704
  210   1HG   LYS  27           HGS      LYS  27  16.165   4.821   4.821
  211   2HG   LYS  27           HGR      LYS  27  14.660   5.340   5.340
  212   1HD   LYS  27           HDR      LYS  27  16.206   4.977   4.977
  213   2HD   LYS  27           HDS      LYS  27  15.135   3.604   3.604
  214   1HE   LYS  27           HES      LYS  27  17.376   3.067   3.067
  215   2HE   LYS  27           HER      LYS  27  17.925   3.632   3.632
  216   1HZ   LYS  27           HZB      LYS  27  15.855   1.600   1.600
  217   2HZ   LYS  27           HZC      LYS  27  17.404   1.157   1.157
  218   3HZ   LYS  27           HZA      LYS  27  16.986   1.850   1.850
  219    H    LYS  28           HN       LYS  28  11.268   3.497   3.497
  220    HA   LYS  28           HA       LYS  28  11.021   6.277   6.277
  221   1HB   LYS  28           HBR      LYS  28   8.804   4.254   4.254
  222   2HB   LYS  28           HBS      LYS  28   8.478   5.969   5.969
  223   1HG   LYS  28           HGS      LYS  28   9.952   5.467   5.467
  224   2HG   LYS  28           HGR      LYS  28   8.266   4.877   4.877
  225   1HD   LYS  28           HDR      LYS  28   7.446   7.040   7.040
  226   2HD   LYS  28           HDS      LYS  28   9.022   7.676   7.676
  227   1HE   LYS  28           HES      LYS  28   9.015   8.458   8.458
  228   2HE   LYS  28           HER      LYS  28   9.357   6.771   6.771
  229   1HZ   LYS  28           HZA      LYS  28   6.593   7.365   7.365
  230   2HZ   LYS  28           HZB      LYS  28   7.255   8.168   8.168
  231   3HZ   LYS  28           HZC      LYS  28   7.307   6.536   6.536
  232    H    GLN  29           HN       GLN  29  10.164   7.719   7.719
  233    HA   GLN  29           HA       GLN  29  11.007   6.801   6.801
  234   1HB   GLN  29           HBS      GLN  29  11.274   9.609   9.609
  235   2HB   GLN  29           HBR      GLN  29  12.081   8.857   8.857
  236   1HG   GLN  29           HGS      GLN  29  13.571   7.672   7.672
  237   2HG   GLN  29           HGR      GLN  29  12.530   7.775   7.775
  238   1HE2  GLN  29           HE2      GLN  29  13.403  11.286  11.286
  239   2HE2  GLN  29           HE2      GLN  29  11.994  10.290  10.290
  240    H    TYR  30           HN       TYR  30   9.632   6.884   6.884
  241    HA   TYR  30           HA       TYR  30   7.110   8.206   8.206
  242   1HB   TYR  30           HBS      TYR  30   8.816   7.117   7.117
  243   2HB   TYR  30           HBR      TYR  30   7.261   7.943   7.943
  244    HD1  TYR  30           HD2      TYR  30   8.369   5.366   5.366
  245    HD2  TYR  30           HD1      TYR  30   5.745   6.316   6.316
  246    HE1  TYR  30           HE2      TYR  30   7.487   3.076   3.076
  247    HE2  TYR  30           HE1      TYR  30   4.954   3.988   3.988
  248    HH   TYR  30           HH       TYR  30   4.906   2.048   2.048
  249    H    LYS  31           HN       LYS  31   6.577  10.217  10.217
  250    HA   LYS  31           HA       LYS  31   7.866  11.686  11.686
  251   1HB   LYS  31           HBR      LYS  31   7.045  13.785  13.785
  252   2HB   LYS  31           HBS      LYS  31   8.508  12.990  12.990
  253   1HG   LYS  31           HGR      LYS  31   6.550  11.805  11.805
  254   2HG   LYS  31           HGS      LYS  31   5.850  13.429  13.429
  255   1HD   LYS  31           HDR      LYS  31   8.316  14.157  14.157
  256   2HD   LYS  31           HDS      LYS  31   8.314  12.630  12.630
  257   1HE   LYS  31           HER      LYS  31   7.545  13.994  13.994
  258   2HE   LYS  31           HES      LYS  31   5.986  13.523  13.523
  259   1HZ   LYS  31           HZA      LYS  31   6.586  15.623  15.623
  260   2HZ   LYS  31           HZB      LYS  31   7.355  16.058  16.058
  261   3HZ   LYS  31           HZC      LYS  31   5.755  15.734  15.734
  262    H    LEU  32           HN       LEU  32   6.221  13.608  13.608
  263    HA   LEU  32           HA       LEU  32   3.820  12.389  12.389
  264   1HB   LEU  32           HBS      LEU  32   5.388  14.557  14.557
  265   2HB   LEU  32           HBR      LEU  32   3.920  15.331  15.331
  266    HG   LEU  32           HG       LEU  32   2.544  14.278  14.278
  267   1HD1  LEU  32           HMD      LEU  32   3.794  12.143  12.143
  268   2HD1  LEU  32           HMD      LEU  32   5.092  12.990  12.990
  269   3HD1  LEU  32           HMD      LEU  32   3.467  12.865  12.865
  270   1HD2  LEU  32           HMD      LEU  32   4.124  16.331  16.331
  271   2HD2  LEU  32           HMD      LEU  32   3.219  15.610  15.610
  272   3HD2  LEU  32           HMD      LEU  32   4.944  15.224  15.224
  273    H    LYS  33           HN       LYS  33   4.635  13.739  13.739
  274    HA   LYS  33           HA       LYS  33   1.951  14.269  14.269
  275   1HB   LYS  33           HBS      LYS  33   4.403  14.736  14.736
  276   2HB   LYS  33           HBR      LYS  33   3.929  13.280  13.280
  277   1HG   LYS  33           HGR      LYS  33   2.556  14.471  14.471
  278   2HG   LYS  33           HGS      LYS  33   1.731  15.175  15.175
  279   1HD   LYS  33           HDR      LYS  33   4.161  16.477  16.477
  280   2HD   LYS  33           HDS      LYS  33   3.757  16.328  16.328
  281   1HE   LYS  33           HER      LYS  33   1.569  17.191  17.191
  282   2HE   LYS  33           HES      LYS  33   2.930  18.334  18.334
  283   1HZ   LYS  33           HZB      LYS  33   1.616  17.122  17.122
  284   2HZ   LYS  33           HZC      LYS  33   1.047  18.493  18.493
  285   3HZ   LYS  33           HZA      LYS  33   2.553  18.458  18.458
  286    H    HIS  34           HN       DHI  34   3.899  11.400  11.400
  287    HA   HIS  34           HA       DHI  34   2.033   9.632   9.632
  288   1HB   HIS  34           HBR      DHI  34   4.353   9.105   9.105
  289   2HB   HIS  34           HBS      DHI  34   3.178   7.829   7.829
  290    HD2  HIS  34           HD2      DHI  34   3.403   6.809   6.809
  291    HE1  HIS  34           HE1      DHI  34   7.208   8.477   8.477
  292    HE2  HIS  34           HE2      DHI  34   5.516   6.800   6.800
  293    H    ILE  35           HN       ILE  35   2.740  10.583  10.583
  294    HA   ILE  35           HA       ILE  35   0.766   8.923   8.923
  295    HB   ILE  35           HB       ILE  35   2.751  10.324  10.324
  296   1HG1  ILE  35           HG1      ILE  35   0.315  10.035  10.035
  297   2HG1  ILE  35           HG1      ILE  35   0.941   8.605   8.605
  298   1HG2  ILE  35           HMG      ILE  35   0.427  12.222  12.222
  299   2HG2  ILE  35           HMG      ILE  35   1.700  12.120  12.120
  300   3HG2  ILE  35           HMG      ILE  35   2.123  12.564  12.564
  301   1HD1  ILE  35           HMD      ILE  35   3.117   9.989   9.989
  302   2HD1  ILE  35           HMD      ILE  35   1.825   9.665   9.665
  303   3HD1  ILE  35           HMD      ILE  35   2.530   8.322   8.322
  304    H    VAL  36           HN       VAL  36   0.595  12.221  12.221
  305    HA   VAL  36           HA       VAL  36  -1.993  12.782  12.782
  306    HB   VAL  36           HB       VAL  36  -0.297  14.272  14.272
  307   1HG1  VAL  36           HMG      VAL  36  -3.029  14.569  14.569
  308   2HG1  VAL  36           HMG      VAL  36  -2.383  15.839  15.839
  309   3HG1  VAL  36           HMG      VAL  36  -1.890  15.775  15.775
  310   1HG2  VAL  36           HMG      VAL  36   0.062  14.027  14.027
  311   2HG2  VAL  36           HMG      VAL  36   0.671  15.351  15.351
  312   3HG2  VAL  36           HMG      VAL  36  -0.858  15.545  15.545
  313    H    TRP  37           HN       TRP  37  -0.597  11.717  11.717
  314    HA   TRP  37           HA       TRP  37  -2.971  11.279  11.279
  315   1HB   TRP  37           HBR      TRP  37  -0.769  11.049  11.049
  316   2HB   TRP  37           HBS      TRP  37  -0.412   9.670   9.670
  317    HD1  TRP  37           HD1      TRP  37  -2.338  10.562  10.562
  318    HE1  TRP  37           HE1      TRP  37  -3.507   8.482   8.482
  319    HE3  TRP  37           HE3      TRP  37  -1.259   7.311   7.311
  320    HZ2  TRP  37           HZ2      TRP  37  -4.013   5.852   5.852
  321    HZ3  TRP  37           HZ3      TRP  37  -2.032   4.993   4.993
  322    HH2  TRP  37           HH2      TRP  37  -3.472   4.298   4.298
  323    H    ALA  38           HN       ALA  38  -1.326   9.311   9.311
  324    HA   ALA  38           HA       ALA  38  -2.836   6.885   6.885
  325   1HB   ALA  38           HMB      ALA  38  -1.127   7.757   7.757
  326   2HB   ALA  38           HMB      ALA  38  -1.750   6.111   6.111
  327   3HB   ALA  38           HMB      ALA  38  -0.574   6.825   6.825
  328    H    SER  39           HN       SER  39  -2.567   8.913   8.913
  329    HA   SER  39           HA       SER  39  -4.894   7.929   7.929
  330   1HB   SER  39           HBS      SER  39  -3.300   9.004   9.004
  331   2HB   SER  39           HBR      SER  39  -3.373  10.513  10.513
  332    HG   SER  39           HG       SER  39  -4.441  10.753  10.753
  333    H    ARG  40           HN       ARG  40  -4.547  10.132  10.132
  334    HA   ARG  40           HA       ARG  40  -7.279  11.167  11.167
  335   1HB   ARG  40           HBR      ARG  40  -5.051  11.048  11.048
  336   2HB   ARG  40           HBS      ARG  40  -6.730  11.243  11.243
  337   1HG   ARG  40           HGR      ARG  40  -6.239  13.087  13.087
  338   2HG   ARG  40           HGS      ARG  40  -4.952  13.245  13.245
  339   1HD   ARG  40           HDS      ARG  40  -7.889  13.185  13.185
  340   2HD   ARG  40           HDR      ARG  40  -6.983  14.686  14.686
  341    HE   ARG  40           HE       ARG  40  -6.973  13.207  13.207
  342   1HH1  ARG  40           HH1      ARG  40  -5.044  15.324  15.324
  343   2HH1  ARG  40           HH1      ARG  40  -3.911  15.693  15.693
  344   1HH2  ARG  40           HH2      ARG  40  -5.398  13.609  13.609
  345   2HH2  ARG  40           HH2      ARG  40  -4.111  14.724  14.724
  346    H    GLU  41           HN       GLU  41  -5.625   8.823   8.823
  347    HA   GLU  41           HA       GLU  41  -8.000   7.968   7.968
  348   1HB   GLU  41           HBR      GLU  41  -5.305   7.654   7.654
  349   2HB   GLU  41           HBS      GLU  41  -5.707   6.158   6.158
  350   1HG   GLU  41           HGR      GLU  41  -5.745   5.507   5.507
  351   2HG   GLU  41           HGS      GLU  41  -7.428   6.074   6.074
  352    H    LEU  42           HN       LEU  42  -6.478   6.966   6.966
  353    HA   LEU  42           HA       LEU  42  -7.989   4.548   4.548
  354   1HB   LEU  42           HBR      LEU  42  -5.976   5.046   5.046
  355   2HB   LEU  42           HBS      LEU  42  -6.636   6.631   6.631
  356    HG   LEU  42           HG       LEU  42  -8.508   4.804   4.804
  357   1HD1  LEU  42           HMD      LEU  42  -6.188   3.325   3.325
  358   2HD1  LEU  42           HMD      LEU  42  -6.110   3.739   3.739
  359   3HD1  LEU  42           HMD      LEU  42  -7.535   2.889   2.889
  360   1HD2  LEU  42           HMD      LEU  42  -6.405   6.558   6.558
  361   2HD2  LEU  42           HMD      LEU  42  -8.162   6.511   6.511
  362   3HD2  LEU  42           HMD      LEU  42  -7.095   5.331   5.331
  363    H    GLU  43           HN       GLU  43  -8.237   7.845   7.845
  364    HA   GLU  43           HA       GLU  43 -10.536   7.387   7.387
  365   1HB   GLU  43           HBR      GLU  43  -8.842   9.169   9.169
  366   2HB   GLU  43           HBS      GLU  43  -9.369   9.804   9.804
  367   1HG   GLU  43           HGS      GLU  43 -11.403   9.738   9.738
  368   2HG   GLU  43           HGR      GLU  43 -10.035  10.841  10.841
  369    H    ARG  44           HN       ARG  44 -10.131   8.237   8.237
  370    HA   ARG  44           HA       ARG  44 -13.053   8.619   8.619
  371   1HB   ARG  44           HBS      ARG  44 -12.444   9.365   9.365
  372   2HB   ARG  44           HBR      ARG  44 -11.814  10.377  10.377
  373   1HG   ARG  44           HGS      ARG  44  -9.786   8.503   8.503
  374   2HG   ARG  44           HGR      ARG  44 -10.396   9.061   9.061
  375   1HD   ARG  44           HDS      ARG  44  -9.375  10.742  10.742
  376   2HD   ARG  44           HDR      ARG  44  -8.618  10.490  10.490
  377    HE   ARG  44           HE       ARG  44 -10.722  11.631  11.631
  378   1HH1  ARG  44           HH1      ARG  44  -9.165  12.438  12.438
  379   2HH1  ARG  44           HH1      ARG  44  -9.979  13.960  13.960
  380   1HH2  ARG  44           HH2      ARG  44 -11.821  13.597  13.597
  381   2HH2  ARG  44           HH2      ARG  44 -11.459  14.630  14.630
  382    H    PHE  45           HN       PHE  45 -10.813   6.139   6.139
  383    HA   PHE  45           HA       PHE  45 -12.210   4.448   4.448
  384   1HB   PHE  45           HBS      PHE  45 -10.126   4.063   4.063
  385   2HB   PHE  45           HBR      PHE  45 -11.360   2.773   2.773
  386    HD1  PHE  45           HD2      PHE  45 -11.939   1.841   1.841
  387    HD2  PHE  45           HD1      PHE  45  -8.377   3.881   3.881
  388    HE1  PHE  45           HE2      PHE  45 -10.803   0.980   0.980
  389    HE2  PHE  45           HE1      PHE  45  -7.256   3.114   3.114
  390    HZ   PHE  45           HZ       PHE  45  -8.460   1.648   1.648
  391    H    ALA  46           HN       ALA  46 -12.179   4.515   4.515
  392    HA   ALA  46           HA       ALA  46 -15.107   4.372   4.372
  393   1HB   ALA  46           HMB      ALA  46 -13.256   2.005   2.005
  394   2HB   ALA  46           HMB      ALA  46 -14.969   2.065   2.065
  395   3HB   ALA  46           HMB      ALA  46 -14.529   2.176   2.176
  396    H    VAL  47           HN       VAL  47 -12.505   5.719   5.719
  397    HA   VAL  47           HA       VAL  47 -12.540   4.674   4.674
  398    HB   VAL  47           HB       VAL  47 -10.171   5.647   5.647
  399   1HG1  VAL  47           HMG      VAL  47 -10.447   4.354   4.354
  400   2HG1  VAL  47           HMG      VAL  47  -8.954   4.193   4.193
  401   3HG1  VAL  47           HMG      VAL  47  -9.534   5.806   5.806
  402   1HG2  VAL  47           HMG      VAL  47 -11.171   2.825   2.825
  403   2HG2  VAL  47           HMG      VAL  47 -11.063   3.718   3.718
  404   3HG2  VAL  47           HMG      VAL  47  -9.579   3.259   3.259
  405    H    ASN  48           HN       ASN  48 -11.397   6.103   6.103
  406    HA   ASN  48           HA       ASN  48 -11.933   8.964   8.964
  407   1HB   ASN  48           HBS      ASN  48 -13.554   8.345   8.345
  408   2HB   ASN  48           HBR      ASN  48 -12.343   7.474   7.474
  409   1HD2  ASN  48           HD2      ASN  48 -13.199  11.273  11.273
  410   2HD2  ASN  48           HD2      ASN  48 -14.185  10.190  10.190
  411    HA   PRO  49           HA       PRO  49  -7.803   9.514   9.514
  412   1HB   PRO  49           HBR      PRO  49  -7.655  12.133  12.133
  413   2HB   PRO  49           HBS      PRO  49  -7.998  11.482  11.482
  414   1HG   PRO  49           HGR      PRO  49  -9.731  12.799  12.799
  415   2HG   PRO  49           HGS      PRO  49  -9.920  12.481  12.481
  416   1HD   PRO  49           HDR      PRO  49 -11.117  11.162  11.162
  417   2HD   PRO  49           HDS      PRO  49 -11.180  10.750  10.750
  418    H    GLY  50           HN       GLY  50  -8.982  11.367  11.367
  419   1HA   GLY  50           HAR      GLY  50  -6.811  10.988  10.988
  420   2HA   GLY  50           HAS      GLY  50  -8.507  11.215  11.215
  421    H    LEU  51           HN       LEU  51  -9.222   8.776   8.776
  422    HA   LEU  51           HA       LEU  51  -9.262   6.866   6.866
  423   1HB   LEU  51           HBR      LEU  51 -10.771   7.446   7.446
  424   2HB   LEU  51           HBS      LEU  51  -9.738   6.212   6.212
  425    HG   LEU  51           HG       LEU  51 -11.527   5.836   5.836
  426   1HD1  LEU  51           HMD      LEU  51 -11.824   5.301   5.301
  427   2HD1  LEU  51           HMD      LEU  51 -12.504   4.131   4.131
  428   3HD1  LEU  51           HMD      LEU  51 -13.027   5.834   5.834
  429   1HD2  LEU  51           HMD      LEU  51  -9.335   4.276   4.276
  430   2HD2  LEU  51           HMD      LEU  51 -10.071   4.179   4.179
  431   3HD2  LEU  51           HMD      LEU  51 -10.844   3.358   3.358
  432    H    LEU  52           HN       LEU  52  -7.712   6.843   6.843
  433    HA   LEU  52           HA       LEU  52  -5.840   4.882   4.882
  434   1HB   LEU  52           HBS      LEU  52  -5.702   4.634   4.634
  435   2HB   LEU  52           HBR      LEU  52  -6.873   5.966   5.966
  436    HG   LEU  52           HG       LEU  52  -5.090   6.218   6.218
  437   1HD1  LEU  52           HMD      LEU  52  -6.068   8.236   8.236
  438   2HD1  LEU  52           HMD      LEU  52  -4.605   8.253   8.253
  439   3HD1  LEU  52           HMD      LEU  52  -4.467   8.459   8.459
  440   1HD2  LEU  52           HMD      LEU  52  -3.503   5.067   5.067
  441   2HD2  LEU  52           HMD      LEU  52  -2.911   5.928   5.928
  442   3HD2  LEU  52           HMD      LEU  52  -2.999   6.771   6.771
  443    H    GLU  53           HN       GLU  53  -5.864   8.274   8.274
  444    HA   GLU  53           HA       GLU  53  -3.104   8.910   8.910
  445   1HB   GLU  53           HBR      GLU  53  -5.368  10.230  10.230
  446   2HB   GLU  53           HBS      GLU  53  -5.186   9.869   9.869
  447   1HG   GLU  53           HGR      GLU  53  -2.882  11.068  11.068
  448   2HG   GLU  53           HGS      GLU  53  -3.746  11.781  11.781
  449    H    THR  54           HN       THR  54  -5.221   7.453   7.453
  450    HA   THR  54           HA       THR  54  -2.963   6.924   6.924
  451    HB   THR  54           HB       THR  54  -4.544   5.897   5.897
  452    HG1  THR  54           HG1      THR  54  -6.194   6.090   6.090
  453   1HG2  THR  54           HMG      THR  54  -4.862   8.478   8.478
  454   2HG2  THR  54           HMG      THR  54  -6.506   7.841   7.841
  455   3HG2  THR  54           HMG      THR  54  -5.738   7.703   7.703
  456    H    SER  55           HN       SER  55  -2.406   4.766   4.766
  457    HA   SER  55           HA       SER  55  -1.915   2.777   2.777
  458   1HB   SER  55           HBR      SER  55  -1.750   2.975   2.975
  459   2HB   SER  55           HBS      SER  55  -1.961   1.338   1.338
  460    HG   SER  55           HG       SER  55   0.236   2.847   2.847
  461    H    GLU  56           HN       GLU  56  -4.620   3.319   3.319
  462    HA   GLU  56           HA       GLU  56  -5.651   0.664   0.664
  463   1HB   GLU  56           HBS      GLU  56  -5.981   2.859   2.859
  464   2HB   GLU  56           HBR      GLU  56  -7.297   3.138   3.138
  465   1HG   GLU  56           HGR      GLU  56  -7.539   0.506   0.506
  466   2HG   GLU  56           HGS      GLU  56  -6.984   1.663   1.663
  467    H    GLY  57           HN       GLY  57  -6.548   3.663   3.663
  468   1HA   GLY  57           HAR      GLY  57  -8.557   2.337   2.337
  469   2HA   GLY  57           HAS      GLY  57  -7.981   4.014   4.014
  470    H    CYS  58           HN       CYS  58  -5.195   3.326   3.326
  471    HA   CYS  58           HA       CYS  58  -4.949   2.533   2.533
  472   1HB   CYS  58           HBR      CYS  58  -3.300   3.781   3.781
  473   2HB   CYS  58           HBS      CYS  58  -2.747   2.126   2.126
  474    H    ARG  59           HN       ARG  59  -5.136   0.797   0.797
  475    HA   ARG  59           HA       ARG  59  -4.499  -1.736  -1.736
  476   1HB   ARG  59           HBR      ARG  59  -4.630  -0.743  -0.743
  477   2HB   ARG  59           HBS      ARG  59  -6.114  -1.731  -1.731
  478   1HG   ARG  59           HGR      ARG  59  -3.471  -2.883  -2.883
  479   2HG   ARG  59           HGS      ARG  59  -3.899  -2.803  -2.803
  480   1HD   ARG  59           HDS      ARG  59  -6.028  -3.820  -3.820
  481   2HD   ARG  59           HDR      ARG  59  -4.550  -4.821  -4.821
  482    HE   ARG  59           HE       ARG  59  -6.371  -4.294  -4.294
  483   1HH1  ARG  59           HH1      ARG  59  -3.529  -5.942  -5.942
  484   2HH1  ARG  59           HH1      ARG  59  -3.330  -6.925  -6.925
  485   1HH2  ARG  59           HH2      ARG  59  -5.959  -5.459  -5.459
  486   2HH2  ARG  59           HH2      ARG  59  -4.684  -6.630  -6.630
  487    H    GLN  60           HN       GLN  60  -7.452   0.088   0.088
  488    HA   GLN  60           HA       GLN  60  -9.265  -2.219  -2.219
  489   1HB   GLN  60           HBR      GLN  60 -10.019  -0.282  -0.282
  490   2HB   GLN  60           HBS      GLN  60  -9.834   0.757   0.757
  491   1HG   GLN  60           HGR      GLN  60 -11.446  -1.434  -1.434
  492   2HG   GLN  60           HGS      GLN  60 -12.053  -0.880  -0.880
  493   1HE2  GLN  60           HE2      GLN  60 -13.463   2.075   2.075
  494   2HE2  GLN  60           HE2      GLN  60 -13.052   1.054   1.054
  495    H    ILE  61           HN       ILE  61  -7.603   0.247   0.247
  496    HA   ILE  61           HA       ILE  61  -8.761  -0.544  -0.544
  497    HB   ILE  61           HB       ILE  61  -6.242   1.069   1.069
  498   1HG1  ILE  61           HG1      ILE  61  -7.933   2.421   2.421
  499   2HG1  ILE  61           HG1      ILE  61  -7.731   2.921   2.921
  500   1HG2  ILE  61           HMG      ILE  61  -6.209  -0.181  -0.181
  501   2HG2  ILE  61           HMG      ILE  61  -7.452   0.987   0.987
  502   3HG2  ILE  61           HMG      ILE  61  -5.854   1.566   1.566
  503   1HD1  ILE  61           HMD      ILE  61  -9.820   0.882   0.882
  504   2HD1  ILE  61           HMD      ILE  61 -10.109   2.626   2.626
  505   3HD1  ILE  61           HMD      ILE  61  -9.767   1.986   1.986
  506    H    LEU  62           HN       LEU  62  -5.508  -1.079  -1.079
  507    HA   LEU  62           HA       LEU  62  -4.532  -2.288  -2.288
  508   1HB   LEU  62           HBR      LEU  62  -3.308  -1.255  -1.255
  509   2HB   LEU  62           HBS      LEU  62  -3.520  -2.826  -2.826
  510    HG   LEU  62           HG       LEU  62  -2.091  -3.929  -3.929
  511   1HD1  LEU  62           HMD      LEU  62  -2.940  -2.663  -2.663
  512   2HD1  LEU  62           HMD      LEU  62  -1.790  -1.374  -1.374
  513   3HD1  LEU  62           HMD      LEU  62  -1.193  -3.005  -3.005
  514   1HD2  LEU  62           HMD      LEU  62  -1.096  -1.195  -1.195
  515   2HD2  LEU  62           HMD      LEU  62  -0.912  -2.751  -2.751
  516   3HD2  LEU  62           HMD      LEU  62  -0.029  -2.455  -2.455
  517    H    GLY  63           HN       GLY  63  -6.426  -3.615  -3.615
  518   1HA   GLY  63           HAS      GLY  63  -6.045  -6.357  -6.357
  519   2HA   GLY  63           HAR      GLY  63  -7.085  -5.828  -5.828
  520    H    GLN  64           HN       GLN  64  -8.602  -3.865  -3.865
  521    HA   GLN  64           HA       GLN  64 -10.483  -5.459  -5.459
  522   1HB   GLN  64           HBS      GLN  64 -10.763  -3.131  -3.131
  523   2HB   GLN  64           HBR      GLN  64 -10.432  -2.512  -2.512
  524   1HG   GLN  64           HGR      GLN  64 -12.259  -3.981  -3.981
  525   2HG   GLN  64           HGS      GLN  64 -12.642  -4.404  -4.404
  526   1HE2  GLN  64           HE2      GLN  64 -15.057  -1.896  -1.896
  527   2HE2  GLN  64           HE2      GLN  64 -14.713  -3.590  -3.590
  528    H    LEU  65           HN       LEU  65  -7.455  -4.199  -4.199
  529    HA   LEU  65           HA       LEU  65  -8.220  -3.474  -3.474
  530   1HB   LEU  65           HBR      LEU  65  -7.283  -1.884  -1.884
  531   2HB   LEU  65           HBS      LEU  65  -5.762  -2.818  -2.818
  532    HG   LEU  65           HG       LEU  65  -5.695  -2.228  -2.228
  533   1HD1  LEU  65           HMD      LEU  65  -8.030  -0.649  -0.649
  534   2HD1  LEU  65           HMD      LEU  65  -6.868   0.188   0.188
  535   3HD1  LEU  65           HMD      LEU  65  -7.670  -1.301  -1.301
  536   1HD2  LEU  65           HMD      LEU  65  -4.542  -1.207  -1.207
  537   2HD2  LEU  65           HMD      LEU  65  -4.355  -0.443  -0.443
  538   3HD2  LEU  65           HMD      LEU  65  -5.528   0.215   0.215
  539    H    GLN  66           HN       GLN  66  -5.860  -5.418  -5.418
  540    HA   GLN  66           HA       GLN  66  -4.569  -6.738  -6.738
  541   1HB   GLN  66           HBR      GLN  66  -5.928  -8.167  -8.167
  542   2HB   GLN  66           HBS      GLN  66  -4.548  -8.763  -8.763
  543   1HG   GLN  66           HGS      GLN  66  -3.666  -6.307  -6.307
  544   2HG   GLN  66           HGR      GLN  66  -4.650  -6.890  -6.890
  545   1HE2  GLN  66           HE2      GLN  66  -2.546 -10.002 -10.002
  546   2HE2  GLN  66           HE2      GLN  66  -4.131  -9.706  -9.706
  547    HA   PRO  67           HA       PRO  67  -8.437  -9.451  -9.451
  548   1HB   PRO  67           HBR      PRO  67 -10.739  -8.452  -8.452
  549   2HB   PRO  67           HBS      PRO  67  -9.990  -9.764  -9.764
  550   1HG   PRO  67           HGR      PRO  67 -10.138  -7.167  -7.167
  551   2HG   PRO  67           HGS      PRO  67  -9.888  -8.615  -8.615
  552   1HD   PRO  67           HDS      PRO  67  -7.978  -6.808  -6.808
  553   2HD   PRO  67           HDR      PRO  67  -7.708  -8.376  -8.376
  554    H    SER  68           HN       SER  68  -8.755  -6.031  -6.031
  555    HA   SER  68           HA       SER  68 -10.682  -5.832  -5.832
  556   1HB   SER  68           HBS      SER  68  -9.579  -4.044  -4.044
  557   2HB   SER  68           HBR      SER  68  -9.783  -3.274  -3.274
  558    HG   SER  68           HG       SER  68 -11.879  -3.608  -3.608
  559    H    LEU  69           HN       LEU  69  -7.329  -6.187  -6.187
  560    HA   LEU  69           HA       LEU  69  -6.480  -4.369  -4.369
  561   1HB   LEU  69           HBR      LEU  69  -5.259  -6.731  -6.731
  562   2HB   LEU  69           HBS      LEU  69  -4.415  -5.819  -5.819
  563    HG   LEU  69           HG       LEU  69  -5.332  -4.749  -4.749
  564   1HD1  LEU  69           HMD      LEU  69  -2.980  -6.127  -6.127
  565   2HD1  LEU  69           HMD      LEU  69  -2.546  -4.413  -4.413
  566   3HD1  LEU  69           HMD      LEU  69  -3.311  -5.310  -5.310
  567   1HD2  LEU  69           HMD      LEU  69  -4.740  -3.488  -3.488
  568   2HD2  LEU  69           HMD      LEU  69  -5.333  -2.769  -2.769
  569   3HD2  LEU  69           HMD      LEU  69  -3.583  -2.972  -2.972
  570    H    GLN  70           HN       GLN  70  -7.498  -7.745  -7.745
  571    HA   GLN  70           HA       GLN  70  -6.912  -8.582  -8.582
  572   1HB   GLN  70           HBR      GLN  70  -8.355 -10.412 -10.412
  573   2HB   GLN  70           HBS      GLN  70  -7.580 -10.072 -10.072
  574   1HG   GLN  70           HGS      GLN  70  -9.558  -9.885  -9.885
  575   2HG   GLN  70           HGR      GLN  70 -10.072  -8.643  -8.643
  576   1HE2  GLN  70           HE2      GLN  70 -11.246 -11.340 -11.340
  577   2HE2  GLN  70           HE2      GLN  70  -9.917 -10.230 -10.230
  578    H    THR  71           HN       THR  71  -9.218  -6.324  -6.324
  579    HA   THR  71           HA       THR  71 -10.657  -6.353  -6.353
  580    HB   THR  71           HB       THR  71 -11.979  -7.832  -7.832
  581    HG1  THR  71           HG1      THR  71 -12.945  -6.448  -6.448
  582   1HG2  THR  71           HMG      THR  71 -10.814  -7.023  -7.023
  583   2HG2  THR  71           HMG      THR  71 -12.285  -6.027  -6.027
  584   3HG2  THR  71           HMG      THR  71 -12.418  -7.800  -7.800
  585    H    GLY  72           HN       GLY  72  -8.826  -4.535  -4.535
  586   1HA   GLY  72           HAR      GLY  72 -10.354  -2.060  -2.060
  587   2HA   GLY  72           HAS      GLY  72  -8.814  -2.224  -2.224
  588    H    SER  73           HN       SER  73  -6.905  -2.868  -2.868
  589    HA   SER  73           HA       SER  73  -6.663  -2.607  -2.607
  590   1HB   SER  73           HBS      SER  73  -5.755  -0.309  -0.309
  591   2HB   SER  73           HBR      SER  73  -7.514  -0.375  -0.375
  592    HG   SER  73           HG       SER  73  -7.028   1.152   1.152
  593    H    GLU  74           HN       GLU  74  -4.465  -2.399  -2.399
  594    HA   GLU  74           HA       GLU  74  -2.305  -3.119  -3.119
  595   1HB   GLU  74           HBS      GLU  74  -1.906  -1.481  -1.481
  596   2HB   GLU  74           HBR      GLU  74  -0.979  -2.767  -2.767
  597   1HG   GLU  74           HGS      GLU  74  -3.454  -3.779  -3.779
  598   2HG   GLU  74           HGR      GLU  74  -2.949  -2.599  -2.599
  599    H    GLU  75           HN       GLU  75  -4.101  -0.242  -0.242
  600    HA   GLU  75           HA       GLU  75  -2.010   1.513   1.513
  601   1HB   GLU  75           HBS      GLU  75  -4.257   2.957   2.957
  602   2HB   GLU  75           HBR      GLU  75  -2.991   2.903   2.903
  603   1HG   GLU  75           HGR      GLU  75  -4.481   0.946   0.946
  604   2HG   GLU  75           HGS      GLU  75  -5.690   1.821   1.821
  605    H    LEU  76           HN       LEU  76  -4.622  -0.374  -0.374
  606    HA   LEU  76           HA       LEU  76  -4.744   0.983   0.983
  607   1HB   LEU  76           HBS      LEU  76  -6.215  -1.002  -1.002
  608   2HB   LEU  76           HBR      LEU  76  -5.456  -1.821  -1.821
  609    HG   LEU  76           HG       LEU  76  -7.506   0.390   0.390
  610   1HD1  LEU  76           HMD      LEU  76  -7.624  -2.379  -2.379
  611   2HD1  LEU  76           HMD      LEU  76  -7.744  -1.830  -1.830
  612   3HD1  LEU  76           HMD      LEU  76  -8.894  -1.221  -1.221
  613   1HD2  LEU  76           HMD      LEU  76  -5.712  -0.534  -0.534
  614   2HD2  LEU  76           HMD      LEU  76  -5.868   1.112   1.112
  615   3HD2  LEU  76           HMD      LEU  76  -7.226   0.380   0.380
  616    H    ARG  77           HN       ARG  77  -2.868  -1.385  -1.385
  617    HA   ARG  77           HA       ARG  77  -1.542  -2.581  -2.581
  618   1HB   ARG  77           HBR      ARG  77  -1.620  -3.049  -3.049
  619   2HB   ARG  77           HBS      ARG  77   0.065  -2.597  -2.597
  620   1HG   ARG  77           HGS      ARG  77   0.289  -4.400  -4.400
  621   2HG   ARG  77           HGR      ARG  77  -1.466  -4.735  -4.735
  622   1HD   ARG  77           HDR      ARG  77  -1.082  -6.215  -6.215
  623   2HD   ARG  77           HDS      ARG  77  -0.643  -4.858  -4.858
  624    HE   ARG  77           HE       ARG  77   1.594  -5.425  -5.425
  625   1HH1  ARG  77           HH1      ARG  77  -0.387  -7.404  -7.404
  626   2HH1  ARG  77           HH1      ARG  77   0.956  -8.347  -8.347
  627   1HH2  ARG  77           HH2      ARG  77   3.346  -6.592  -6.592
  628   2HH2  ARG  77           HH2      ARG  77   3.070  -7.887  -7.887
  629    H    SER  78           HN       SER  78  -1.018   0.135   0.135
  630    HA   SER  78           HA       SER  78   1.368   1.095   1.095
  631   1HB   SER  78           HBR      SER  78   0.250   1.744   1.744
  632   2HB   SER  78           HBS      SER  78  -0.570   2.967   2.967
  633    HG   SER  78           HG       SER  78   1.876   2.957   2.957
  634    H    LEU  79           HN       LEU  79  -2.104   1.860   1.860
  635    HA   LEU  79           HA       LEU  79  -1.935   3.542   3.542
  636   1HB   LEU  79           HBR      LEU  79  -3.869   2.850   2.850
  637   2HB   LEU  79           HBS      LEU  79  -4.122   1.515   1.515
  638    HG   LEU  79           HG       LEU  79  -4.766   2.983   2.983
  639   1HD1  LEU  79           HMD      LEU  79  -3.008   4.711   4.711
  640   2HD1  LEU  79           HMD      LEU  79  -4.019   5.327   5.327
  641   3HD1  LEU  79           HMD      LEU  79  -4.623   5.380   5.380
  642   1HD2  LEU  79           HMD      LEU  79  -5.847   3.606   3.606
  643   2HD2  LEU  79           HMD      LEU  79  -6.588   2.689   2.689
  644   3HD2  LEU  79           HMD      LEU  79  -6.478   4.465   4.465
  645    H    TYR  80           HN       TYR  80  -1.287   0.179   0.179
  646    HA   TYR  80           HA       TYR  80  -1.898  -0.418  -0.418
  647   1HB   TYR  80           HBS      TYR  80  -2.609  -1.998  -1.998
  648   2HB   TYR  80           HBR      TYR  80  -0.969  -2.098  -2.098
  649    HD1  TYR  80           HD1      TYR  80  -3.063  -3.068  -3.068
  650    HD2  TYR  80           HD2      TYR  80   0.566  -3.683  -3.683
  651    HE1  TYR  80           HE1      TYR  80  -2.606  -5.072  -5.072
  652    HE2  TYR  80           HE2      TYR  80   0.904  -5.810  -5.810
  653    HH   TYR  80           HH       TYR  80  -1.225  -6.834  -6.834
  654    H    ASN  81           HN       ASN  81   0.872   0.258   0.258
  655    HA   ASN  81           HA       ASN  81   2.798  -0.611  -0.611
  656   1HB   ASN  81           HBS      ASN  81   4.492   0.314   0.314
  657   2HB   ASN  81           HBR      ASN  81   3.358  -0.601  -0.601
  658   1HD2  ASN  81           HD2      ASN  81   3.881   2.185   2.185
  659   2HD2  ASN  81           HD2      ASN  81   4.495   0.619   0.619
  660    H    THR  82           HN       THR  82   1.120   2.354   2.354
  661    HA   THR  82           HA       THR  82   2.610   3.984   3.984
  662    HB   THR  82           HB       THR  82   0.025   5.197   5.197
  663    HG1  THR  82           HG1      THR  82   1.283   3.976   3.976
  664   1HG2  THR  82           HMG      THR  82   2.815   5.719   5.719
  665   2HG2  THR  82           HMG      THR  82   1.642   6.338   6.338
  666   3HG2  THR  82           HMG      THR  82   1.512   6.817   6.817
  667    H    ILE  83           HN       ILE  83  -0.465   2.265   2.265
  668    HA   ILE  83           HA       ILE  83  -1.018   3.255   3.255
  669    HB   ILE  83           HB       ILE  83  -2.070   1.013   1.013
  670   1HG1  ILE  83           HG1      ILE  83  -2.807   3.246   3.246
  671   2HG1  ILE  83           HG1      ILE  83  -4.159   2.322   2.322
  672   1HG2  ILE  83           HMG      ILE  83  -1.974   0.354   0.354
  673   2HG2  ILE  83           HMG      ILE  83  -3.406   1.418   1.418
  674   3HG2  ILE  83           HMG      ILE  83  -3.388   0.001   0.001
  675   1HD1  ILE  83           HMD      ILE  83  -3.509   3.348   3.348
  676   2HD1  ILE  83           HMD      ILE  83  -2.419   4.426   4.426
  677   3HD1  ILE  83           HMD      ILE  83  -4.178   4.487   4.487
  678    H    ALA  84           HN       ALA  84   0.395   0.165   0.165
  679    HA   ALA  84           HA       ALA  84   0.827  -0.868  -0.868
  680   1HB   ALA  84           HMB      ALA  84   1.944  -1.500  -1.500
  681   2HB   ALA  84           HMB      ALA  84   2.622  -2.278  -2.278
  682   3HB   ALA  84           HMB      ALA  84   0.893  -2.466  -2.466
  683    H    VAL  85           HN       VAL  85   2.811   1.227   1.227
  684    HA   VAL  85           HA       VAL  85   5.053   1.404   1.404
  685    HB   VAL  85           HB       VAL  85   3.956   3.301   3.301
  686   1HG1  VAL  85           HMG      VAL  85   5.339   4.326   4.326
  687   2HG1  VAL  85           HMG      VAL  85   6.720   3.597   3.597
  688   3HG1  VAL  85           HMG      VAL  85   5.683   4.783   4.783
  689   1HG2  VAL  85           HMG      VAL  85   5.289   0.925   0.925
  690   2HG2  VAL  85           HMG      VAL  85   5.212   2.256   2.256
  691   3HG2  VAL  85           HMG      VAL  85   6.602   2.125   2.125
  692    H    LEU  86           HN       LEU  86   2.187   3.501   3.501
  693    HA   LEU  86           HA       LEU  86   2.959   5.325   5.325
  694   1HB   LEU  86           HBR      LEU  86   1.311   5.488   5.488
  695   2HB   LEU  86           HBS      LEU  86   0.101   4.857   4.857
  696    HG   LEU  86           HG       LEU  86   0.103   6.791   6.791
  697   1HD1  LEU  86           HMD      LEU  86   2.539   7.091   7.091
  698   2HD1  LEU  86           HMD      LEU  86   2.610   7.700   7.700
  699   3HD1  LEU  86           HMD      LEU  86   1.716   8.610   8.610
  700   1HD2  LEU  86           HMD      LEU  86   0.305   7.191   7.191
  701   2HD2  LEU  86           HMD      LEU  86  -1.091   7.373   7.373
  702   3HD2  LEU  86           HMD      LEU  86   0.172   8.631   8.631
  703    H    TYR  87           HN       TYR  87   1.048   2.372   2.372
  704    HA   TYR  87           HA       TYR  87   0.643   2.445   2.445
  705   1HB   TYR  87           HBS      TYR  87  -0.325   0.771   0.771
  706   2HB   TYR  87           HBR      TYR  87   1.228  -0.104  -0.104
  707    HD1  TYR  87           HD1      TYR  87   1.961  -0.234  -0.234
  708    HD2  TYR  87           HD2      TYR  87  -2.032   0.228   0.228
  709    HE1  TYR  87           HE1      TYR  87   1.124  -1.011  -1.011
  710    HE2  TYR  87           HE2      TYR  87  -2.875  -0.383  -0.383
  711    HH   TYR  87           HH       TYR  87  -1.838  -2.239  -2.239
  712    H    CYS  88           HN       CYS  88   3.361   1.251   1.251
  713    HA   CYS  88           HA       CYS  88   5.047   0.372   0.372
  714   1HB   CYS  88           HBS      CYS  88   5.173   0.697   0.697
  715   2HB   CYS  88           HBR      CYS  88   6.434   1.799   1.799
  716    H    VAL  89           HN       VAL  89   4.339   3.607   3.607
  717    HA   VAL  89           HA       VAL  89   6.426   4.792   4.792
  718    HB   VAL  89           HB       VAL  89   4.174   6.206   6.206
  719   1HG1  VAL  89           HMG      VAL  89   6.980   7.033   7.033
  720   2HG1  VAL  89           HMG      VAL  89   5.957   7.941   7.941
  721   3HG1  VAL  89           HMG      VAL  89   5.436   7.728   7.728
  722   1HG2  VAL  89           HMG      VAL  89   6.215   4.515   4.515
  723   2HG2  VAL  89           HMG      VAL  89   4.848   5.350   5.350
  724   3HG2  VAL  89           HMG      VAL  89   6.397   6.198   6.198
  725    H    HIS  90           HN       HIS  90   2.865   4.662   4.662
  726    HA   HIS  90           HA       HIS  90   2.621   6.480   6.480
  727   1HB   HIS  90           HBS      HIS  90   0.700   4.271   4.271
  728   2HB   HIS  90           HBR      HIS  90   0.348   5.559   5.559
  729    HD1  HIS  90           HD1      HIS  90   1.521   8.007   8.007
  730    HD2  HIS  90           HD2      HIS  90  -0.910   5.049   5.049
  731    HE1  HIS  90           HE1      HIS  90   0.357   9.053   9.053
  732    HE2  HIS  90           HE2      HIS  90  -1.165   7.286   7.286
  733    H    GLN  91           HN       GLN  91   3.603   3.192   3.192
  734    HA   GLN  91           HA       GLN  91   3.025   2.557   2.557
  735   1HB   GLN  91           HBS      GLN  91   2.971   0.819   0.819
  736   2HB   GLN  91           HBR      GLN  91   4.687   1.099   1.099
  737   1HG   GLN  91           HGS      GLN  91   4.564  -0.852  -0.852
  738   2HG   GLN  91           HGR      GLN  91   5.263   0.460   0.460
  739   1HE2  GLN  91           HE2      GLN  91   2.655  -1.543  -1.543
  740   2HE2  GLN  91           HE2      GLN  91   4.060  -1.961  -1.961
  741    H    ARG  92           HN       ARG  92   5.986   3.357   3.357
  742    HA   ARG  92           HA       ARG  92   7.593   4.334   4.334
  743   1HB   ARG  92           HBS      ARG  92   7.239   1.469   1.469
  744   2HB   ARG  92           HBR      ARG  92   8.940   1.994   1.994
  745   1HG   ARG  92           HGS      ARG  92   7.276   3.790   3.790
  746   2HG   ARG  92           HGR      ARG  92   7.406   2.130   2.130
  747   1HD   ARG  92           HDS      ARG  92   9.577   2.345   2.345
  748   2HD   ARG  92           HDR      ARG  92   9.916   3.301   3.301
  749    HE   ARG  92           HE       ARG  92   9.093   4.326   4.326
  750   1HH1  ARG  92           HH1      ARG  92   9.392   5.037   5.037
  751   2HH1  ARG  92           HH1      ARG  92   9.679   6.725   6.725
  752   1HH2  ARG  92           HH2      ARG  92   9.598   6.514   6.514
  753   2HH2  ARG  92           HH2      ARG  92   9.793   7.562   7.562
  754    H    ILE  93           HN       ILE  93   7.153   2.250   2.250
  755    HA   ILE  93           HA       ILE  93  10.038   1.736   1.736
  756    HB   ILE  93           HB       ILE  93   7.651   0.680   0.680
  757   1HG1  ILE  93           HG1      ILE  93   8.338  -1.431  -1.431
  758   2HG1  ILE  93           HG1      ILE  93   8.710  -0.082  -0.082
  759   1HG2  ILE  93           HMG      ILE  93   9.879   0.470   0.470
  760   2HG2  ILE  93           HMG      ILE  93  10.415  -0.516  -0.516
  761   3HG2  ILE  93           HMG      ILE  93   9.089  -1.091  -1.091
  762   1HD1  ILE  93           HMD      ILE  93   6.056  -0.380  -0.380
  763   2HD1  ILE  93           HMD      ILE  93   6.388  -1.057  -1.057
  764   3HD1  ILE  93           HMD      ILE  93   6.464   0.704   0.704
  765    H    ASP  94           HN       ASP  94  11.164   2.485   2.485
  766    HA   ASP  94           HA       ASP  94   9.659   3.941   3.941
  767   1HB   ASP  94           HBS      ASP  94  11.363   5.549   5.549
  768   2HB   ASP  94           HBR      ASP  94  10.797   5.672   5.672
  769    H    VAL  95           HN       VAL  95  10.406   3.658   3.658
  770    HA   VAL  95           HA       VAL  95  12.242   1.341   1.341
  771    HB   VAL  95           HB       VAL  95  10.690   0.268   0.268
  772   1HG1  VAL  95           HMG      VAL  95   9.348   1.615   1.615
  773   2HG1  VAL  95           HMG      VAL  95   8.500   0.413   0.413
  774   3HG1  VAL  95           HMG      VAL  95   9.990  -0.041  -0.041
  775   1HG2  VAL  95           HMG      VAL  95   9.609   2.943   2.943
  776   2HG2  VAL  95           HMG      VAL  95   9.663   1.476   1.476
  777   3HG2  VAL  95           HMG      VAL  95   8.378   1.674   1.674
  778    H    LYS  96           HN       LYS  96  12.230   1.002   1.002
  779    HA   LYS  96           HA       LYS  96  13.837   3.378   3.378
  780   1HB   LYS  96           HBR      LYS  96  15.159   1.194   1.194
  781   2HB   LYS  96           HBS      LYS  96  14.601   0.624   0.624
  782   1HG   LYS  96           HGR      LYS  96  15.571   3.048   3.048
  783   2HG   LYS  96           HGS      LYS  96  16.615   2.705   2.705
  784   1HD   LYS  96           HDS      LYS  96  17.636   1.983   1.983
  785   2HD   LYS  96           HDR      LYS  96  17.405   0.701   0.701
  786   1HE   LYS  96           HES      LYS  96  15.283   1.113   1.113
  787   2HE   LYS  96           HER      LYS  96  16.834   0.366   0.366
  788   1HZ   LYS  96           HZC      LYS  96  16.109  -0.870  -0.870
  789   2HZ   LYS  96           HZA      LYS  96  14.707  -0.745  -0.745
  790   3HZ   LYS  96           HZB      LYS  96  15.994  -1.486  -1.486
  791    H    ASP  97           HN       ASP  97  12.731   0.239   0.239
  792    HA   ASP  97           HA       ASP  97  11.086   1.775   1.775
  793   1HB   ASP  97           HBS      ASP  97  11.353   0.061   0.061
  794   2HB   ASP  97           HBR      ASP  97  12.955   0.289   0.289
  795    H    THR  98           HN       THR  98   9.238   0.217   0.217
  796    HA   THR  98           HA       THR  98   7.259  -0.262  -0.262
  797    HB   THR  98           HB       THR  98   7.626  -1.879  -1.879
  798    HG1  THR  98           HG1      THR  98   6.454   0.507   0.507
  799   1HG2  THR  98           HMG      THR  98   5.275  -1.283  -1.283
  800   2HG2  THR  98           HMG      THR  98   5.036  -1.522  -1.522
  801   3HG2  THR  98           HMG      THR  98   5.780  -2.809  -2.809
  802    H    LYS  99           HN       LYS  99   9.279  -2.777  -2.777
  803    HA   LYS  99           HA       LYS  99   8.043  -4.865  -4.865
  804   1HB   LYS  99           HBR      LYS  99   9.887  -6.290  -6.290
  805   2HB   LYS  99           HBS      LYS  99   9.308  -5.237  -5.237
  806   1HG   LYS  99           HGS      LYS  99  11.297  -4.184  -4.184
  807   2HG   LYS  99           HGR      LYS  99  11.564  -4.128  -4.128
  808   1HD   LYS  99           HDS      LYS  99  11.746  -6.782  -6.782
  809   2HD   LYS  99           HDR      LYS  99  12.956  -5.614  -5.614
  810   1HE   LYS  99           HER      LYS  99  13.605  -7.113  -7.113
  811   2HE   LYS  99           HES      LYS  99  13.750  -5.367  -5.367
  812   1HZ   LYS  99           HZA      LYS  99  11.261  -6.658  -6.658
  813   2HZ   LYS  99           HZB      LYS  99  12.557  -7.023  -7.023
  814   3HZ   LYS  99           HZC      LYS  99  12.073  -5.471  -5.471
  815    H    GLU 100           HN       GLU 100  10.545  -2.700  -2.700
  816    HA   GLU 100           HA       GLU 100  11.489  -4.252  -4.252
  817   1HB   GLU 100           HBR      GLU 100  12.658  -2.447  -2.447
  818   2HB   GLU 100           HBS      GLU 100  11.459  -1.367  -1.367
  819   1HG   GLU 100           HGR      GLU 100  13.064  -0.662  -0.662
  820   2HG   GLU 100           HGS      GLU 100  12.098  -1.763  -1.763
  821    H    ALA 101           HN       ALA 101   9.203  -1.502  -1.502
  822    HA   ALA 101           HA       ALA 101   8.232  -1.587  -1.587
  823   1HB   ALA 101           HMB      ALA 101   7.841   0.068   0.068
  824   2HB   ALA 101           HMB      ALA 101   6.321  -0.861  -0.861
  825   3HB   ALA 101           HMB      ALA 101   6.822   0.024   0.024
  826    H    LEU 102           HN       LEU 102   6.942  -2.934  -2.934
  827    HA   LEU 102           HA       LEU 102   4.739  -4.236  -4.236
  828   1HB   LEU 102           HBR      LEU 102   5.422  -3.622  -3.622
  829   2HB   LEU 102           HBS      LEU 102   6.115  -5.269  -5.269
  830    HG   LEU 102           HG       LEU 102   3.975  -6.258  -6.258
  831   1HD1  LEU 102           HMD      LEU 102   2.933  -3.420  -3.420
  832   2HD1  LEU 102           HMD      LEU 102   1.928  -4.889  -4.889
  833   3HD1  LEU 102           HMD      LEU 102   3.026  -4.652  -4.652
  834   1HD2  LEU 102           HMD      LEU 102   4.739  -4.799  -4.799
  835   2HD2  LEU 102           HMD      LEU 102   3.396  -5.969  -5.969
  836   3HD2  LEU 102           HMD      LEU 102   3.076  -4.231  -4.231
  837    H    ASP 103           HN       ASP 103   8.073  -5.016  -5.016
  838    HA   ASP 103           HA       ASP 103   7.666  -7.825  -7.825
  839   1HB   ASP 103           HBR      ASP 103   9.747  -7.047  -7.047
  840   2HB   ASP 103           HBS      ASP 103  10.113  -6.113  -6.113
  841    H    LYS 104           HN       LYS 104   8.573  -4.957  -4.957
  842    HA   LYS 104           HA       LYS 104   8.069  -5.996  -5.996
  843   1HB   LYS 104           HBR      LYS 104   8.897  -3.614  -3.614
  844   2HB   LYS 104           HBS      LYS 104   7.161  -3.226  -3.226
  845   1HG   LYS 104           HGS      LYS 104   7.510  -2.831  -2.831
  846   2HG   LYS 104           HGR      LYS 104   7.789  -4.584  -4.584
  847   1HD   LYS 104           HDR      LYS 104   9.953  -2.666  -2.666
  848   2HD   LYS 104           HDS      LYS 104   9.534  -2.858  -2.858
  849   1HE   LYS 104           HES      LYS 104  11.307  -4.328  -4.328
  850   2HE   LYS 104           HER      LYS 104   9.877  -5.386  -5.386
  851   1HZ   LYS 104           HZB      LYS 104  11.037  -4.159  -4.159
  852   2HZ   LYS 104           HZC      LYS 104  11.748  -5.481  -5.481
  853   3HZ   LYS 104           HZA      LYS 104  10.196  -5.552  -5.552
  854    H    ILE 105           HN       ILE 105   5.863  -4.930  -4.930
  855    HA   ILE 105           HA       ILE 105   3.621  -4.882  -4.882
  856    HB   ILE 105           HB       ILE 105   3.757  -4.140  -4.140
  857   1HG1  ILE 105           HG1      ILE 105   5.409  -3.042  -3.042
  858   2HG1  ILE 105           HG1      ILE 105   4.447  -1.986  -1.986
  859   1HG2  ILE 105           HMG      ILE 105   1.580  -4.091  -4.091
  860   2HG2  ILE 105           HMG      ILE 105   1.917  -2.474  -2.474
  861   3HG2  ILE 105           HMG      ILE 105   1.567  -3.839  -3.839
  862   1HD1  ILE 105           HMD      ILE 105   2.862  -1.998  -1.998
  863   2HD1  ILE 105           HMD      ILE 105   4.450  -2.258  -2.258
  864   3HD1  ILE 105           HMD      ILE 105   4.182  -0.826  -0.826
  865    H    GLU 106           HN       GLU 106   4.999  -6.976  -6.976
  866    HA   GLU 106           HA       GLU 106   2.707  -8.702  -8.702
  867   1HB   GLU 106           HBS      GLU 106   4.509  -8.721  -8.721
  868   2HB   GLU 106           HBR      GLU 106   5.683  -8.792  -8.792
  869   1HG   GLU 106           HGS      GLU 106   5.518 -10.693 -10.693
  870   2HG   GLU 106           HGR      GLU 106   5.286 -11.161 -11.161
  871    H    GLU 107           HN       GLU 107   5.461  -8.593  -8.593
  872    HA   GLU 107           HA       GLU 107   4.732 -10.673 -10.673
  873   1HB   GLU 107           HBR      GLU 107   6.719  -8.987  -8.987
  874   2HB   GLU 107           HBS      GLU 107   5.763  -7.975  -7.975
  875   1HG   GLU 107           HGS      GLU 107   6.335  -8.719  -8.719
  876   2HG   GLU 107           HGR      GLU 107   6.031 -10.428 -10.428
  877    H    GLU 108           HN       GLU 108   3.145  -7.693  -7.693
  878    HA   GLU 108           HA       GLU 108   1.400  -6.525  -6.525
  879   1HB   GLU 108           HBR      GLU 108   0.644  -8.974  -8.974
  880   2HB   GLU 108           HBS      GLU 108   1.274  -8.608  -8.608
  881   1HG   GLU 108           HGS      GLU 108  -0.240  -6.693  -6.693
  882   2HG   GLU 108           HGR      GLU 108  -1.155  -7.417  -7.417
  883    H    GLN 109           HN       GLN 109   4.362  -6.880  -6.880
  884    HA   GLN 109           HA       GLN 109   5.875  -5.952  -5.952
  885   1HB   GLN 109           HBR      GLN 109   5.226  -4.113  -4.113
  886   2HB   GLN 109           HBS      GLN 109   3.623  -4.013  -4.013
  887   1HG   GLN 109           HGS      GLN 109   5.302  -2.197  -2.197
  888   2HG   GLN 109           HGR      GLN 109   4.503  -2.982  -2.982
  889   1HE2  GLN 109           HE2      GLN 109   7.641  -3.087  -3.087
  890   2HE2  GLN 109           HE2      GLN 109   6.159  -2.203  -2.203
  891    H    ASN 110           HN       ASN 110   3.130  -4.533  -4.533
  892    HA   ASN 110           HA       ASN 110   4.305  -5.016  -5.016
  893   1HB   ASN 110           HBS      ASN 110   2.371  -4.148  -4.148
  894   2HB   ASN 110           HBR      ASN 110   2.633  -3.248  -3.248
  895   1HD2  ASN 110           HD2      ASN 110  -0.538  -5.900  -5.900
  896   2HD2  ASN 110           HD2      ASN 110   0.847  -6.070  -6.070
  897    H    LYS 111           HN       LYS 111   4.167  -6.555  -6.555
  898    HA   LYS 111           HA       LYS 111   4.316  -9.051  -9.051
  899   1HB   LYS 111           HBR      LYS 111   4.665  -7.938  -7.938
  900   2HB   LYS 111           HBS      LYS 111   3.875  -9.535  -9.535
  901   1HG   LYS 111           HGR      LYS 111   5.857 -10.521 -10.521
  902   2HG   LYS 111           HGS      LYS 111   5.996  -9.766  -9.766
  903   1HD   LYS 111           HDS      LYS 111   7.332  -8.083  -8.083
  904   2HD   LYS 111           HDR      LYS 111   6.641  -8.058  -8.058
  905   1HE   LYS 111           HES      LYS 111   7.800 -10.434 -10.434
  906   2HE   LYS 111           HER      LYS 111   8.842  -9.716  -9.716
  907   1HZ   LYS 111           HZB      LYS 111   8.272  -8.090  -8.090
  908   2HZ   LYS 111           HZC      LYS 111   9.265  -9.365  -9.365
  909   3HZ   LYS 111           HZA      LYS 111   9.648  -8.227  -8.227
  910    H    SER 112           HN       SER 112   2.897 -10.479 -10.479
  911    HA   SER 112           HA       SER 112   1.042 -11.651 -11.651
  912   1HB   SER 112           HBS      SER 112  -0.061  -9.290  -9.290
  913   2HB   SER 112           HBR      SER 112  -0.742 -10.512 -10.512
  914    HG   SER 112           HG       SER 112  -1.051 -11.838 -11.838
  915    H    LYS 113           HN       LYS 113   2.381 -13.267 -13.267
  916    HA   LYS 113           HA       LYS 113   1.839 -13.853 -13.853
  917   1HB   LYS 113           HBR      LYS 113   4.254 -13.710 -13.710
  918   2HB   LYS 113           HBS      LYS 113   4.069 -15.323 -15.323
  919   1HG   LYS 113           HGR      LYS 113   3.660 -14.084 -14.084
  920   2HG   LYS 113           HGS      LYS 113   4.250 -12.621 -12.621
  921   1HD   LYS 113           HDS      LYS 113   6.311 -13.184 -13.184
  922   2HD   LYS 113           HDR      LYS 113   6.136 -14.553 -14.553
  923   1HE   LYS 113           HES      LYS 113   6.800 -15.638 -15.638
  924   2HE   LYS 113           HER      LYS 113   5.027 -15.674 -15.674
  925   1HZ   LYS 113           HZA      LYS 113   6.333 -13.353 -13.353
  926   2HZ   LYS 113           HZB      LYS 113   6.744 -14.747 -14.747
  927   3HZ   LYS 113           HZC      LYS 113   5.176 -14.296 -14.296
  928    H    LYS 114           HN       LYS 114   2.314 -16.232 -16.232
  929    HA   LYS 114           HA       LYS 114   2.272 -18.241 -18.241
  930   1HB   LYS 114           HBR      LYS 114  -0.421 -17.261 -17.261
  931   2HB   LYS 114           HBS      LYS 114  -0.197 -19.016 -19.016
  932   1HG   LYS 114           HGR      LYS 114   0.869 -17.983 -17.983
  933   2HG   LYS 114           HGS      LYS 114  -0.903 -17.844 -17.844
  934   1HD   LYS 114           HDS      LYS 114  -1.030 -19.924 -19.924
  935   2HD   LYS 114           HDR      LYS 114  -0.486 -20.354 -20.354
  936   1HE   LYS 114           HES      LYS 114   1.905 -19.924 -19.924
  937   2HE   LYS 114           HER      LYS 114   0.935 -20.472 -20.472
  938   1HZ   LYS 114           HZB      LYS 114   0.783 -21.967 -21.967
  939   2HZ   LYS 114           HZC      LYS 114   2.104 -22.159 -22.159
  940   3HZ   LYS 114           HZA      LYS 114   0.619 -22.489 -22.489
  941    H    LYS 115           HN       LYS 115   0.119 -18.201 -18.201
  942    HA   LYS 115           HA       LYS 115   0.309 -19.066 -19.066
  943   1HB   LYS 115           HBR      LYS 115   3.018 -18.294 -18.294
  944   2HB   LYS 115           HBS      LYS 115   3.011 -19.866 -19.866
  945   1HG   LYS 115           HGR      LYS 115   1.187 -18.347 -18.347
  946   2HG   LYS 115           HGS      LYS 115   2.455 -17.166 -17.166
  947   1HD   LYS 115           HDS      LYS 115   4.024 -18.128 -18.128
  948   2HD   LYS 115           HDR      LYS 115   3.466 -19.744 -19.744
  949   1HE   LYS 115           HES      LYS 115   2.956 -19.628 -19.628
  950   2HE   LYS 115           HER      LYS 115   1.426 -19.057 -19.057
  951   1HZ   LYS 115           HZC      LYS 115   3.278 -16.961 -16.961
  952   2HZ   LYS 115           HZA      LYS 115   2.920 -17.733 -17.733
  953   3HZ   LYS 115           HZB      LYS 115   1.724 -17.090 -17.090
  954    H    ALA 116           HN       ALA 116  -0.082 -21.057 -21.057
  955    HA   ALA 116           HA       ALA 116   1.547 -23.284 -23.284
  956   1HB   ALA 116           HMB      ALA 116  -0.307 -22.822 -22.822
  957   2HB   ALA 116           HMB      ALA 116  -0.914 -24.213 -24.213
  958   3HB   ALA 116           HMB      ALA 116   0.736 -24.243 -24.243
  959    H    GLN 117           HN       GLN 117  -2.002 -23.371 -23.371
  960    HA   GLN 117           HA       GLN 117  -3.475 -24.216 -24.216
  961   1HB   GLN 117           HBR      GLN 117  -1.439 -23.488 -23.488
  962   2HB   GLN 117           HBS      GLN 117  -3.154 -23.918 -23.918
  963   1HG   GLN 117           HGS      GLN 117  -2.056 -21.474 -21.474
  964   2HG   GLN 117           HGR      GLN 117  -2.896 -21.529 -21.529
  965   1HE2  GLN 117           HE2      GLN 117  -4.975 -21.909 -21.909
  966   2HE2  GLN 117           HE2      GLN 117  -3.276 -22.237 -22.237
  967    H    GLN 118           HN       GLN 118  -3.292 -25.763 -25.763
  968    HA   GLN 118           HA       GLN 118  -2.002 -28.167 -28.167
  969   1HB   GLN 118           HBR      GLN 118  -4.594 -27.991 -27.991
  970   2HB   GLN 118           HBS      GLN 118  -4.131 -28.392 -28.392
  971   1HG   GLN 118           HGS      GLN 118  -2.707 -30.179 -30.179
  972   2HG   GLN 118           HGR      GLN 118  -4.354 -30.101 -30.101
  973   1HE2  GLN 118           HE2      GLN 118  -5.676 -32.249 -32.249
  974   2HE2  GLN 118           HE2      GLN 118  -5.719 -31.508 -31.508
  975    H    ALA 119           HN       ALA 119  -2.992 -26.911 -26.911
  976    HA   ALA 119           HA       ALA 119  -1.842 -26.714 -26.714
  977   1HB   ALA 119           HMB      ALA 119  -0.035 -25.862 -25.862
  978   2HB   ALA 119           HMB      ALA 119   0.780 -27.373 -27.373
  979   3HB   ALA 119           HMB      ALA 119   0.361 -26.156 -26.156
  980    H    ALA 120           HN       ALA 120  -2.981 -29.160 -29.160
  981    HA   ALA 120           HA       ALA 120  -3.268 -31.256 -31.256
  982   1HB   ALA 120           HMB      ALA 120  -2.108 -29.821 -29.821
  983   2HB   ALA 120           HMB      ALA 120  -1.062 -31.254 -31.254
  984   3HB   ALA 120           HMB      ALA 120  -2.813 -31.455 -31.455
  985    H    ALA 121           HN       ALA 121  -2.434 -33.318 -33.318
  986    HA   ALA 121           HA       ALA 121   0.352 -33.540 -33.540
  987   1HB   ALA 121           HMB      ALA 121  -2.262 -34.319 -34.319
  988   2HB   ALA 121           HMB      ALA 121  -0.771 -35.224 -35.224
  989   3HB   ALA 121           HMB      ALA 121  -0.859 -33.476 -33.476
  990    H    ASP 122           HN       ASP 122  -0.819 -34.179 -34.179
  991    HA   ASP 122           HA       ASP 122  -0.497 -35.769 -35.769
  992   1HB   ASP 122           HBS      ASP 122   1.136 -37.193 -37.193
  993   2HB   ASP 122           HBR      ASP 122   1.059 -37.594 -37.594
  994    H    THR 123           HN       THR 123  -0.531 -38.507 -38.507
  995    HA   THR 123           HA       THR 123  -3.369 -38.931 -38.931
  996    HB   THR 123           HB       THR 123  -3.050 -41.072 -41.072
  997    HG1  THR 123           HG1      THR 123  -1.545 -41.183 -41.183
  998   1HG2  THR 123           HMG      THR 123  -3.605 -38.376 -38.376
  999   2HG2  THR 123           HMG      THR 123  -2.719 -39.207 -39.207
 1000   3HG2  THR 123           HMG      THR 123  -4.231 -39.904 -39.904
 1001    H    GLY 124           HN       GLY 124  -0.693 -41.241 -41.241
 1002   1HA   GLY 124           HAR      GLY 124   0.603 -41.940 -41.940
 1003   2HA   GLY 124           HAS      GLY 124  -0.899 -41.886 -41.886
 1004    H    ASN 125           HN       ASN 125  -2.449 -43.047 -43.047
 1005    HA   ASN 125           HA       ASN 125  -2.472 -45.630 -45.630
 1006   1HB   ASN 125           HBS      ASN 125  -4.204 -46.141 -46.141
 1007   2HB   ASN 125           HBR      ASN 125  -4.368 -44.410 -44.410
 1008   1HD2  ASN 125           HD2      ASN 125  -3.448 -43.249 -43.249
 1009   2HD2  ASN 125           HD2      ASN 125  -3.250 -42.883 -42.883
 1010    H    ASN 126           HN       ASN 126  -1.948 -47.644 -47.644
 1011    HA   ASN 126           HA       ASN 126  -0.451 -49.163 -49.163
 1012   1HB   ASN 126           HBS      ASN 126  -0.423 -49.406 -49.406
 1013   2HB   ASN 126           HBR      ASN 126  -1.985 -48.641 -48.641
 1014   1HD2  ASN 126           HD2      ASN 126   0.808 -46.724 -46.724
 1015   2HD2  ASN 126           HD2      ASN 126   1.187 -48.192 -48.192
 1016    H    SER 127           HN       SER 127   1.545 -49.117 -49.117
 1017    HA   SER 127           HA       SER 127   3.804 -48.807 -48.807
 1018   1HB   SER 127           HBS      SER 127   2.843 -46.178 -46.178
 1019   2HB   SER 127           HBR      SER 127   4.274 -46.437 -46.437
 1020    HG   SER 127           HG       SER 127   5.447 -46.084 -46.084
 1021    H    GLN 128           HN       GLN 128   2.185 -49.909 -49.909
 1022    HA   GLN 128           HA       GLN 128   4.426 -50.555 -50.555
 1023   1HB   GLN 128           HBR      GLN 128   2.820 -48.360 -48.360
 1024   2HB   GLN 128           HBS      GLN 128   2.660 -49.767 -49.767
 1025   1HG   GLN 128           HGS      GLN 128   5.412 -49.142 -49.142
 1026   2HG   GLN 128           HGR      GLN 128   4.635 -47.905 -47.905
 1027   1HE2  GLN 128           HE2      GLN 128   4.838 -49.684 -49.684
 1028   2HE2  GLN 128           HE2      GLN 128   4.330 -48.257 -48.257
 1029    H    VAL 129           HN       VAL 129   4.201 -52.536 -52.536
 1030    HA   VAL 129           HA       VAL 129   2.134 -54.085 -54.085
 1031    HB   VAL 129           HB       VAL 129   3.934 -54.932 -54.932
 1032   1HG1  VAL 129           HMG      VAL 129   2.120 -56.324 -56.324
 1033   2HG1  VAL 129           HMG      VAL 129   3.781 -56.946 -56.946
 1034   3HG1  VAL 129           HMG      VAL 129   2.988 -56.911 -56.911
 1035   1HG2  VAL 129           HMG      VAL 129   4.647 -54.102 -54.102
 1036   2HG2  VAL 129           HMG      VAL 129   5.649 -54.261 -54.261
 1037   3HG2  VAL 129           HMG      VAL 129   5.276 -55.697 -55.697
 1038    H    SER 130           HN       SER 130   2.644 -52.974 -52.974
 1039    HA   SER 130           HA       SER 130  -0.067 -52.814 -52.814
 1040   1HB   SER 130           HBS      SER 130  -0.514 -54.658 -54.658
 1041   2HB   SER 130           HBR      SER 130  -0.064 -55.284 -55.284
 1042    HG   SER 130           HG       SER 130   1.234 -56.513 -56.513
 1043    H    GLN 131           HN       GLN 131  -0.239 -53.140 -53.140
 1044    HA   GLN 131           HA       GLN 131   1.433 -50.914 -50.914
 1045   1HB   GLN 131           HBR      GLN 131  -1.097 -51.234 -51.234
 1046   2HB   GLN 131           HBS      GLN 131  -0.568 -52.240 -52.240
 1047   1HG   GLN 131           HGS      GLN 131  -0.059 -50.457 -50.457
 1048   2HG   GLN 131           HGR      GLN 131   0.856 -49.705 -49.705
 1049   1HE2  GLN 131           HE2      GLN 131  -2.078 -47.613 -47.613
 1050   2HE2  GLN 131           HE2      GLN 131  -0.819 -48.417 -48.417
 1051    H    ASN 132           HN       ASN 132   3.396 -51.256 -51.256
 1052    HA   ASN 132           HA       ASN 132   5.179 -52.068 -52.068
 1053   1HB   ASN 132           HBS      ASN 132   3.380 -51.638 -51.638
 1054   2HB   ASN 132           HBR      ASN 132   3.403 -53.419 -53.419
 1055   1HD2  ASN 132           HD2      ASN 132   6.889 -51.325 -51.325
 1056   2HD2  ASN 132           HD2      ASN 132   5.831 -50.793 -50.793
 1057    H    TYR 133           HN       TYR 133   3.039 -54.784 -54.784
 1058    HA   TYR 133           HA       TYR 133   5.171 -56.569 -56.569
 1059   1HB   TYR 133           HBS      TYR 133   4.160 -58.251 -58.251
 1060   2HB   TYR 133           HBR      TYR 133   4.296 -56.742 -56.742
 1061    HD1  TYR 133           HD1      TYR 133   2.129 -55.273 -55.273
 1062    HD2  TYR 133           HD2      TYR 133   2.110 -59.354 -59.354
 1063    HE1  TYR 133           HE1      TYR 133  -0.259 -55.421 -55.421
 1064    HE2  TYR 133           HE2      TYR 133  -0.267 -59.524 -59.524
 1065    HH   TYR 133           HH       TYR 133  -1.655 -58.022 -58.022

  Start of MODEL    9
    1   1H    HIS   1           HN       HIS   1 -16.403  18.007  18.007
    2   2H    HIS   1           HNC      HIS   1 -16.856  19.560  19.560
    3   3H    HIS   1           HNB      HIS   1 -17.987  18.386  18.386
    4    HA   HIS   1           HA       HIS   1 -17.624  17.544  17.544
    5   1HB   HIS   1           HBS      HIS   1 -16.743  20.361  20.361
    6   2HB   HIS   1           HBR      HIS   1 -17.866  19.286  19.286
    7    HD1  HIS   1           HD1      HIS   1 -17.975  22.253  22.253
    8    HD2  HIS   1           HD2      HIS   1 -20.295  18.806  18.806
    9    HE1  HIS   1           HE1      HIS   1 -20.245  22.854  22.854
   10    HE2  HIS   1           HE2      HIS   1 -21.660  20.778  20.778
   11    H    MET   2           HN       MET   2 -14.901  18.949  18.949
   12    HA   MET   2           HA       MET   2 -13.097  17.821  17.821
   13   1HB   MET   2           HBS      MET   2 -11.635  19.708  19.708
   14   2HB   MET   2           HBR      MET   2 -13.261  20.241  20.241
   15   1HG   MET   2           HGR      MET   2 -12.451  20.228  20.228
   16   2HG   MET   2           HGS      MET   2 -11.912  21.559  21.559
   17   1HE   MET   2           HME      MET   2 -13.915  20.556  20.556
   18   2HE   MET   2           HME      MET   2 -15.007  21.958  21.958
   19   3HE   MET   2           HME      MET   2 -15.620  20.408  20.408
   20    H    GLY   3           HN       GLY   3 -10.759  17.871  17.871
   21   1HA   GLY   3           HAR      GLY   3  -9.815  18.122  18.122
   22   2HA   GLY   3           HAS      GLY   3 -10.701  16.589  16.589
   23    H    ALA   4           HN       ALA   4  -7.737  17.582  17.582
   24    HA   ALA   4           HA       ALA   4  -6.584  15.261  15.261
   25   1HB   ALA   4           HMB      ALA   4  -7.550  16.722  16.722
   26   2HB   ALA   4           HMB      ALA   4  -6.183  17.808  17.808
   27   3HB   ALA   4           HMB      ALA   4  -5.878  16.120  16.120
   28    H    ARG   5           HN       ARG   5  -6.112  18.753  18.753
   29    HA   ARG   5           HA       ARG   5  -4.631  19.860  19.860
   30   1HB   ARG   5           HBS      ARG   5  -4.720  17.118  17.118
   31   2HB   ARG   5           HBR      ARG   5  -3.395  18.202  18.202
   32   1HG   ARG   5           HGS      ARG   5  -5.352  18.267  18.267
   33   2HG   ARG   5           HGR      ARG   5  -4.983  19.851  19.851
   34   1HD   ARG   5           HDS      ARG   5  -6.839  19.831  19.831
   35   2HD   ARG   5           HDR      ARG   5  -6.925  18.048  18.048
   36    HE   ARG   5           HE       ARG   5  -7.514  18.465  18.465
   37   1HH1  ARG   5           HH1      ARG   5  -8.497  20.509  20.509
   38   2HH1  ARG   5           HH1      ARG   5 -10.058  20.837  20.837
   39   1HH2  ARG   5           HH2      ARG   5  -9.611  18.812  18.812
   40   2HH2  ARG   5           HH2      ARG   5 -10.688  19.878  19.878
   41    H    ALA   6           HN       ALA   6  -3.334  20.343  20.343
   42    HA   ALA   6           HA       ALA   6  -1.438  20.417  20.417
   43   1HB   ALA   6           HMB      ALA   6  -0.471  19.011  19.011
   44   2HB   ALA   6           HMB      ALA   6   0.540  18.952  18.952
   45   3HB   ALA   6           HMB      ALA   6   0.080  20.524  20.524
   46    H    SER   7           HN       SER   7  -0.708  17.172  17.172
   47    HA   SER   7           HA       SER   7  -1.847  15.959  15.959
   48   1HB   SER   7           HBS      SER   7   0.475  16.636  16.636
   49   2HB   SER   7           HBR      SER   7   1.000  15.669  15.669
   50    HG   SER   7           HG       SER   7   1.406  14.466  14.466
   51    H    VAL   8           HN       VAL   8  -0.783  13.463  13.463
   52    HA   VAL   8           HA       VAL   8  -2.105  12.212  12.212
   53    HB   VAL   8           HB       VAL   8   0.015  11.229  11.229
   54   1HG1  VAL   8           HMG      VAL   8  -1.052   9.987   9.987
   55   2HG1  VAL   8           HMG      VAL   8  -1.380   9.014   9.014
   56   3HG1  VAL   8           HMG      VAL   8   0.290   9.483   9.483
   57   1HG2  VAL   8           HMG      VAL   8  -2.931  11.403  11.403
   58   2HG2  VAL   8           HMG      VAL   8  -1.718  11.387  11.387
   59   3HG2  VAL   8           HMG      VAL   8  -2.220   9.862   9.862
   60    H    LEU   9           HN       LEU   9   1.358  12.679  12.679
   61    HA   LEU   9           HA       LEU   9   2.087  11.464  11.464
   62   1HB   LEU   9           HBR      LEU   9   3.567  12.701  12.701
   63   2HB   LEU   9           HBS      LEU   9   4.415  12.038  12.038
   64    HG   LEU   9           HG       LEU   9   2.471  10.275  10.275
   65   1HD1  LEU   9           HMD      LEU   9   4.993  11.372  11.372
   66   2HD1  LEU   9           HMD      LEU   9   4.701   9.623   9.623
   67   3HD1  LEU   9           HMD      LEU   9   3.515  10.791  10.791
   68   1HD2  LEU   9           HMD      LEU   9   4.153  10.024  10.024
   69   2HD2  LEU   9           HMD      LEU   9   3.632   8.667   8.667
   70   3HD2  LEU   9           HMD      LEU   9   5.204   9.454   9.454
   71    H    SER  10           HN       SER  10   4.300  12.690  12.690
   72    HA   SER  10           HA       SER  10   3.434  15.394  15.394
   73   1HB   SER  10           HBR      SER  10   4.896  15.249  15.249
   74   2HB   SER  10           HBS      SER  10   4.125  13.640  13.640
   75    HG   SER  10           HG       SER  10   6.383  13.591  13.591
   76    H    GLY  11           HN       GLY  11   5.753  16.608  16.608
   77   1HA   GLY  11           HAR      GLY  11   6.917  17.328  17.328
   78   2HA   GLY  11           HAS      GLY  11   7.614  17.643  17.643
   79    H    GLY  12           HN       GLY  12   8.253  15.338  15.338
   80   1HA   GLY  12           HAR      GLY  12  10.652  14.728  14.728
   81   2HA   GLY  12           HAS      GLY  12  10.074  13.939  13.939
   82    H    GLU  13           HN       GLU  13   7.651  12.882  12.882
   83    HA   GLU  13           HA       GLU  13   8.421  10.438  10.438
   84   1HB   GLU  13           HBR      GLU  13   5.692  11.700  11.700
   85   2HB   GLU  13           HBS      GLU  13   6.098  10.085  10.085
   86   1HG   GLU  13           HGS      GLU  13   6.704   9.825   9.825
   87   2HG   GLU  13           HGR      GLU  13   6.393  11.544  11.544
   88    H    LEU  14           HN       LEU  14   7.356  13.538  13.538
   89    HA   LEU  14           HA       LEU  14   7.110  12.805  12.805
   90   1HB   LEU  14           HBS      LEU  14   6.999  15.105  15.105
   91   2HB   LEU  14           HBR      LEU  14   8.257  15.413  15.413
   92    HG   LEU  14           HG       LEU  14   6.234  16.321  16.321
   93   1HD1  LEU  14           HMD      LEU  14   7.679  14.655  14.655
   94   2HD1  LEU  14           HMD      LEU  14   6.192  13.673  13.673
   95   3HD1  LEU  14           HMD      LEU  14   6.146  15.324  15.324
   96   1HD2  LEU  14           HMD      LEU  14   4.751  15.094  15.094
   97   2HD2  LEU  14           HMD      LEU  14   4.173  15.009  15.009
   98   3HD2  LEU  14           HMD      LEU  14   4.999  13.609  13.609
   99    H    ASP  15           HN       ASP  15   9.854  14.092  14.092
  100    HA   ASP  15           HA       ASP  15  11.629  14.145  14.145
  101   1HB   ASP  15           HBS      ASP  15  11.881  15.450  15.450
  102   2HB   ASP  15           HBR      ASP  15  12.362  13.959  13.959
  103    H    LYS  16           HN       LYS  16  10.494  11.498  11.498
  104    HA   LYS  16           HA       LYS  16  12.536   9.680   9.680
  105   1HB   LYS  16           HBR      LYS  16  11.275   9.422   9.422
  106   2HB   LYS  16           HBS      LYS  16   9.997   8.721   8.721
  107   1HG   LYS  16           HGS      LYS  16  12.860   7.753   7.753
  108   2HG   LYS  16           HGR      LYS  16  11.359   6.921   6.921
  109   1HD   LYS  16           HDS      LYS  16  11.686   5.807   5.807
  110   2HD   LYS  16           HDR      LYS  16  10.850   7.183   7.183
  111   1HE   LYS  16           HER      LYS  16  12.574   7.171   7.171
  112   2HE   LYS  16           HES      LYS  16  13.316   8.173   8.173
  113   1HZ   LYS  16           HZA      LYS  16  13.808   5.597   5.597
  114   2HZ   LYS  16           HZB      LYS  16  14.056   5.608   5.608
  115   3HZ   LYS  16           HZC      LYS  16  14.878   6.644   6.644
  116    H    TRP  17           HN       TRP  17   9.034  10.399  10.399
  117    HA   TRP  17           HA       TRP  17   8.426   8.492   8.492
  118   1HB   TRP  17           HBS      TRP  17   6.725   9.548   9.548
  119   2HB   TRP  17           HBR      TRP  17   7.037  11.121  11.121
  120    HD1  TRP  17           HD1      TRP  17   6.402  11.197  11.197
  121    HE1  TRP  17           HE1      TRP  17   4.888   9.742   9.742
  122    HE3  TRP  17           HE3      TRP  17   5.486   7.453   7.453
  123    HZ2  TRP  17           HZ2      TRP  17   3.371   7.400   7.400
  124    HZ3  TRP  17           HZ3      TRP  17   3.957   5.653   5.653
  125    HH2  TRP  17           HH2      TRP  17   2.922   5.613   5.613
  126    H    GLU  18           HN       GLU  18  10.183  11.404  11.404
  127    HA   GLU  18           HA       GLU  18   9.413  11.965  11.965
  128   1HB   GLU  18           HBR      GLU  18   9.830  13.592  13.592
  129   2HB   GLU  18           HBS      GLU  18  11.349  12.956  12.956
  130   1HG   GLU  18           HGR      GLU  18  11.480  15.133  15.133
  131   2HG   GLU  18           HGS      GLU  18  12.319  13.813  13.813
  132    H    LYS  19           HN       LYS  19  10.781   9.375   9.375
  133    HA   LYS  19           HA       LYS  19  11.759   9.305   9.305
  134   1HB   LYS  19           HBR      LYS  19  13.818  10.371  10.371
  135   2HB   LYS  19           HBS      LYS  19  14.273   8.673   8.673
  136   1HG   LYS  19           HGS      LYS  19  13.709   9.237   9.237
  137   2HG   LYS  19           HGR      LYS  19  13.855  10.938  10.938
  138   1HD   LYS  19           HDR      LYS  19  15.951   8.795   8.795
  139   2HD   LYS  19           HDS      LYS  19  15.907   9.863   9.863
  140   1HE   LYS  19           HES      LYS  19  16.854  11.539  11.539
  141   2HE   LYS  19           HER      LYS  19  15.761  11.286  11.286
  142   1HZ   LYS  19           HZC      LYS  19  17.785   9.284   9.284
  143   2HZ   LYS  19           HZA      LYS  19  18.342  10.757  10.757
  144   3HZ   LYS  19           HZB      LYS  19  17.252   9.986   9.986
  145    H    ILE  20           HN       ILE  20  10.203   7.628   7.628
  146    HA   ILE  20           HA       ILE  20  11.571   5.215   5.215
  147    HB   ILE  20           HB       ILE  20   8.649   6.035   6.035
  148   1HG1  ILE  20           HG1      ILE  20  10.447   4.713   4.713
  149   2HG1  ILE  20           HG1      ILE  20  10.288   6.481   6.481
  150   1HG2  ILE  20           HMG      ILE  20   8.693   3.772   3.772
  151   2HG2  ILE  20           HMG      ILE  20   9.533   3.173   3.173
  152   3HG2  ILE  20           HMG      ILE  20   7.888   3.848   3.848
  153   1HD1  ILE  20           HMD      ILE  20   7.663   5.471   5.471
  154   2HD1  ILE  20           HMD      ILE  20   8.626   4.660   4.660
  155   3HD1  ILE  20           HMD      ILE  20   8.572   6.441   6.441
  156    H    ARG  21           HN       ARG  21  12.360   4.022   4.022
  157    HA   ARG  21           HA       ARG  21  12.026   4.685   4.685
  158   1HB   ARG  21           HBS      ARG  21  14.003   3.528   3.528
  159   2HB   ARG  21           HBR      ARG  21  13.031   2.027   2.027
  160   1HG   ARG  21           HGS      ARG  21  12.937   1.980   1.980
  161   2HG   ARG  21           HGR      ARG  21  13.636   3.620   3.620
  162   1HD   ARG  21           HDR      ARG  21  15.466   2.342   2.342
  163   2HD   ARG  21           HDS      ARG  21  15.608   2.536   2.536
  164    HE   ARG  21           HE       ARG  21  14.122   0.209   0.209
  165   1HH1  ARG  21           HH1      ARG  21  17.408   1.411   1.411
  166   2HH1  ARG  21           HH1      ARG  21  18.094  -0.177  -0.177
  167   1HH2  ARG  21           HH2      ARG  21  15.038  -1.850  -1.850
  168   2HH2  ARG  21           HH2      ARG  21  16.754  -2.023  -2.023
  169    H    LEU  22           HN       LEU  22  10.679   4.077   4.077
  170    HA   LEU  22           HA       LEU  22   8.237   2.670   2.670
  171   1HB   LEU  22           HBR      LEU  22   9.240   3.593   3.593
  172   2HB   LEU  22           HBS      LEU  22   7.562   3.199   3.199
  173    HG   LEU  22           HG       LEU  22   8.748   5.346   5.346
  174   1HD1  LEU  22           HMD      LEU  22   9.617   5.484   5.484
  175   2HD1  LEU  22           HMD      LEU  22   8.002   6.206   6.206
  176   3HD1  LEU  22           HMD      LEU  22   9.154   6.920   6.920
  177   1HD2  LEU  22           HMD      LEU  22   6.309   4.396   4.396
  178   2HD2  LEU  22           HMD      LEU  22   6.591   6.126   6.126
  179   3HD2  LEU  22           HMD      LEU  22   6.337   5.561   5.561
  180    H    ARG  23           HN       ARG  23  10.329   2.094   2.094
  181    HA   ARG  23           HA       ARG  23   9.801  -0.819  -0.819
  182   1HB   ARG  23           HBR      ARG  23  10.399  -0.683  -0.683
  183   2HB   ARG  23           HBS      ARG  23   8.739  -0.430  -0.430
  184   1HG   ARG  23           HGS      ARG  23   8.719   1.773   1.773
  185   2HG   ARG  23           HGR      ARG  23  10.466   1.985   1.985
  186   1HD   ARG  23           HDS      ARG  23  11.067   1.185   1.185
  187   2HD   ARG  23           HDR      ARG  23   9.524   0.313   0.313
  188    HE   ARG  23           HE       ARG  23  10.067   3.118   3.118
  189   1HH1  ARG  23           HH1      ARG  23   7.677   0.544   0.544
  190   2HH1  ARG  23           HH1      ARG  23   6.409   1.490   1.490
  191   1HH2  ARG  23           HH2      ARG  23   8.353   4.367   4.367
  192   2HH2  ARG  23           HH2      ARG  23   6.791   3.653   3.653
  193    HA   PRO  24           HA       PRO  24  14.111  -1.645  -1.645
  194   1HB   PRO  24           HBR      PRO  24  13.996  -4.086  -4.086
  195   2HB   PRO  24           HBS      PRO  24  13.883  -3.775  -3.775
  196   1HG   PRO  24           HGS      PRO  24  11.856  -4.512  -4.512
  197   2HG   PRO  24           HGR      PRO  24  11.875  -4.626  -4.626
  198   1HD   PRO  24           HDS      PRO  24  10.524  -2.782  -2.782
  199   2HD   PRO  24           HDR      PRO  24  10.804  -2.724  -2.724
  200    H    GLY  25           HN       GLY  25  14.852  -0.044  -0.044
  201   1HA   GLY  25           HAS      GLY  25  16.643  -0.135  -0.135
  202   2HA   GLY  25           HAR      GLY  25  15.542  -1.065  -1.065
  203    H    GLY  26           HN       GLY  26  13.327   0.808   0.808
  204   1HA   GLY  26           HAS      GLY  26  13.038   2.243   2.243
  205   2HA   GLY  26           HAR      GLY  26  12.137   2.582   2.582
  206    H    LYS  27           HN       LYS  27  14.688   3.122   3.122
  207    HA   LYS  27           HA       LYS  27  15.948   4.935   4.935
  208   1HB   LYS  27           HBR      LYS  27  16.551   4.689   4.689
  209   2HB   LYS  27           HBS      LYS  27  15.845   6.329   6.329
  210   1HG   LYS  27           HGS      LYS  27  18.030   6.864   6.864
  211   2HG   LYS  27           HGR      LYS  27  17.486   6.556   6.556
  212   1HD   LYS  27           HDS      LYS  27  18.760   4.461   4.461
  213   2HD   LYS  27           HDR      LYS  27  19.696   5.568   5.568
  214   1HE   LYS  27           HES      LYS  27  19.397   4.395   4.395
  215   2HE   LYS  27           HER      LYS  27  17.630   4.359   4.359
  216   1HZ   LYS  27           HZB      LYS  27  18.485   2.635   2.635
  217   2HZ   LYS  27           HZC      LYS  27  19.606   2.392   2.392
  218   3HZ   LYS  27           HZA      LYS  27  18.019   2.209   2.209
  219    H    LYS  28           HN       LYS  28  12.898   4.847   4.847
  220    HA   LYS  28           HA       LYS  28  12.483   7.769   7.769
  221   1HB   LYS  28           HBR      LYS  28  10.403   5.661   5.661
  222   2HB   LYS  28           HBS      LYS  28  10.109   7.396   7.396
  223   1HG   LYS  28           HGS      LYS  28  11.021   8.047   8.047
  224   2HG   LYS  28           HGR      LYS  28  11.987   6.553   6.553
  225   1HD   LYS  28           HDR      LYS  28  10.416   5.676   5.676
  226   2HD   LYS  28           HDS      LYS  28   9.272   5.776   5.776
  227   1HE   LYS  28           HES      LYS  28   9.670   8.341   8.341
  228   2HE   LYS  28           HER      LYS  28   9.126   7.039   7.039
  229   1HZ   LYS  28           HZB      LYS  28   7.691   6.995   6.995
  230   2HZ   LYS  28           HZC      LYS  28   7.586   8.477   8.477
  231   3HZ   LYS  28           HZA      LYS  28   7.135   7.156   7.156
  232    H    GLN  29           HN       GLN  29  11.242   8.357   8.357
  233    HA   GLN  29           HA       GLN  29  11.185   6.308   6.308
  234   1HB   GLN  29           HBS      GLN  29  11.953   8.321   8.321
  235   2HB   GLN  29           HBR      GLN  29  13.138   7.344   7.344
  236   1HG   GLN  29           HGS      GLN  29  13.892   9.193   9.193
  237   2HG   GLN  29           HGR      GLN  29  12.293   9.433   9.433
  238   1HE2  GLN  29           HE2      GLN  29  11.227  11.428  11.428
  239   2HE2  GLN  29           HE2      GLN  29  10.815   9.850   9.850
  240    H    TYR  30           HN       TYR  30   9.706   6.545   6.545
  241    HA   TYR  30           HA       TYR  30   7.321   8.039   8.039
  242   1HB   TYR  30           HBS      TYR  30   8.676   6.776   6.776
  243   2HB   TYR  30           HBR      TYR  30   7.217   7.785   7.785
  244    HD1  TYR  30           HD2      TYR  30   7.697   5.556   5.556
  245    HD2  TYR  30           HD1      TYR  30   5.840   5.981   5.981
  246    HE1  TYR  30           HE2      TYR  30   6.661   3.348   3.348
  247    HE2  TYR  30           HE1      TYR  30   4.958   3.687   3.687
  248    HH   TYR  30           HH       TYR  30   5.609   1.657   1.657
  249    H    LYS  31           HN       LYS  31   6.774  10.042  10.042
  250    HA   LYS  31           HA       LYS  31   8.106  11.468  11.468
  251   1HB   LYS  31           HBR      LYS  31   7.955  12.303  12.303
  252   2HB   LYS  31           HBS      LYS  31   6.820  13.312  13.312
  253   1HG   LYS  31           HGR      LYS  31   8.570  14.048  14.048
  254   2HG   LYS  31           HGS      LYS  31   9.721  12.864  12.864
  255   1HD   LYS  31           HDS      LYS  31  10.448  14.611  14.611
  256   2HD   LYS  31           HDR      LYS  31   9.158  14.128  14.128
  257   1HE   LYS  31           HES      LYS  31   8.269  16.137  16.137
  258   2HE   LYS  31           HER      LYS  31   7.973  15.827  15.827
  259   1HZ   LYS  31           HZB      LYS  31  10.656  16.522  16.522
  260   2HZ   LYS  31           HZC      LYS  31   9.659  17.681  17.681
  261   3HZ   LYS  31           HZA      LYS  31   9.568  17.228  17.228
  262    H    LEU  32           HN       LEU  32   6.669  13.182  13.182
  263    HA   LEU  32           HA       LEU  32   4.228  12.134  12.134
  264   1HB   LEU  32           HBS      LEU  32   5.853  14.054  14.054
  265   2HB   LEU  32           HBR      LEU  32   4.687  15.097  15.097
  266    HG   LEU  32           HG       LEU  32   4.294  14.925  14.925
  267   1HD1  LEU  32           HMD      LEU  32   2.466  14.526  14.526
  268   2HD1  LEU  32           HMD      LEU  32   1.826  13.778  13.778
  269   3HD1  LEU  32           HMD      LEU  32   2.271  15.504  15.504
  270   1HD2  LEU  32           HMD      LEU  32   4.414  12.080  12.080
  271   2HD2  LEU  32           HMD      LEU  32   4.483  12.911  12.911
  272   3HD2  LEU  32           HMD      LEU  32   2.907  12.519  12.519
  273    H    LYS  33           HN       LYS  33   5.038  13.874  13.874
  274    HA   LYS  33           HA       LYS  33   2.492  14.806  14.806
  275   1HB   LYS  33           HBR      LYS  33   4.694  15.300  15.300
  276   2HB   LYS  33           HBS      LYS  33   4.596  13.678  13.678
  277   1HG   LYS  33           HGS      LYS  33   3.739  15.073  15.073
  278   2HG   LYS  33           HGR      LYS  33   2.266  14.466  14.466
  279   1HD   LYS  33           HDS      LYS  33   2.250  16.572  16.572
  280   2HD   LYS  33           HDR      LYS  33   3.641  17.118  17.118
  281   1HE   LYS  33           HES      LYS  33   2.164  16.703  16.703
  282   2HE   LYS  33           HER      LYS  33   0.830  16.792  16.792
  283   1HZ   LYS  33           HZB      LYS  33   1.812  18.929  18.929
  284   2HZ   LYS  33           HZC      LYS  33   2.836  18.857  18.857
  285   3HZ   LYS  33           HZA      LYS  33   1.226  18.940  18.940
  286    H    HIS  34           HN       DHI  34   4.021  11.618  11.618
  287    HA   HIS  34           HA       DHI  34   1.677  10.622  10.622
  288   1HB   HIS  34           HBS      DHI  34   3.596   8.539   8.539
  289   2HB   HIS  34           HBR      DHI  34   2.950   8.973   8.973
  290    HD2  HIS  34           HD2      DHI  34   4.341  11.999  11.999
  291    HE1  HIS  34           HE1      DHI  34   7.877   9.717   9.717
  292    HE2  HIS  34           HE2      DHI  34   6.851  11.961  11.961
  293    H    ILE  35           HN       ILE  35   2.875  10.632  10.632
  294    HA   ILE  35           HA       ILE  35   0.922   8.751   8.751
  295    HB   ILE  35           HB       ILE  35   2.951   9.986   9.986
  296   1HG1  ILE  35           HG1      ILE  35   0.354   9.213   9.213
  297   2HG1  ILE  35           HG1      ILE  35   1.547   8.071   8.071
  298   1HG2  ILE  35           HMG      ILE  35   0.753  11.957  11.957
  299   2HG2  ILE  35           HMG      ILE  35   1.589  11.451  11.451
  300   3HG2  ILE  35           HMG      ILE  35   2.520  12.149  12.149
  301   1HD1  ILE  35           HMD      ILE  35   3.139   9.556   9.556
  302   2HD1  ILE  35           HMD      ILE  35   1.603   9.606   9.606
  303   3HD1  ILE  35           HMD      ILE  35   2.342   8.037   8.037
  304    H    VAL  36           HN       VAL  36   0.864  12.131  12.131
  305    HA   VAL  36           HA       VAL  36  -1.615  12.778  12.778
  306    HB   VAL  36           HB       VAL  36  -0.057  14.130  14.130
  307   1HG1  VAL  36           HMG      VAL  36  -2.441  14.741  14.741
  308   2HG1  VAL  36           HMG      VAL  36  -2.397  15.280  15.280
  309   3HG1  VAL  36           HMG      VAL  36  -1.406  16.111  16.111
  310   1HG2  VAL  36           HMG      VAL  36   0.462  13.942  13.942
  311   2HG2  VAL  36           HMG      VAL  36   1.182  15.077  15.077
  312   3HG2  VAL  36           HMG      VAL  36  -0.246  15.561  15.561
  313    H    TRP  37           HN       TRP  37  -0.656  11.808  11.808
  314    HA   TRP  37           HA       TRP  37  -3.227  11.427  11.427
  315   1HB   TRP  37           HBR      TRP  37  -1.310  11.311  11.311
  316   2HB   TRP  37           HBS      TRP  37  -0.624   9.960   9.960
  317    HD1  TRP  37           HD1      TRP  37  -3.209  10.703  10.703
  318    HE1  TRP  37           HE1      TRP  37  -4.298   8.524   8.524
  319    HE3  TRP  37           HE3      TRP  37  -1.129   7.519   7.519
  320    HZ2  TRP  37           HZ2      TRP  37  -4.359   5.835   5.835
  321    HZ3  TRP  37           HZ3      TRP  37  -1.632   5.126   5.126
  322    HH2  TRP  37           HH2      TRP  37  -3.203   4.287   4.287
  323    H    ALA  38           HN       ALA  38  -1.255   9.390   9.390
  324    HA   ALA  38           HA       ALA  38  -2.682   6.914   6.914
  325   1HB   ALA  38           HMB      ALA  38  -0.817   7.988   7.988
  326   2HB   ALA  38           HMB      ALA  38  -1.482   6.333   6.333
  327   3HB   ALA  38           HMB      ALA  38  -0.428   6.854   6.854
  328    H    SER  39           HN       SER  39  -2.384   9.033   9.033
  329    HA   SER  39           HA       SER  39  -4.529   7.911   7.911
  330   1HB   SER  39           HBS      SER  39  -4.419   9.833   9.833
  331   2HB   SER  39           HBR      SER  39  -2.777   9.259   9.259
  332    HG   SER  39           HG       SER  39  -4.322  11.526  11.526
  333    H    ARG  40           HN       ARG  40  -4.540  10.115  10.115
  334    HA   ARG  40           HA       ARG  40  -7.256  11.089  11.089
  335   1HB   ARG  40           HBS      ARG  40  -7.117  12.371  12.371
  336   2HB   ARG  40           HBR      ARG  40  -5.383  12.222  12.222
  337   1HG   ARG  40           HGS      ARG  40  -4.914  11.053  11.053
  338   2HG   ARG  40           HGR      ARG  40  -6.535  10.308  10.308
  339   1HD   ARG  40           HDR      ARG  40  -6.145  13.258  13.258
  340   2HD   ARG  40           HDS      ARG  40  -5.873  12.109  12.109
  341    HE   ARG  40           HE       ARG  40  -8.440  12.804  12.804
  342   1HH1  ARG  40           HH1      ARG  40  -6.657  10.936  10.936
  343   2HH1  ARG  40           HH1      ARG  40  -8.092  10.314  10.314
  344   1HH2  ARG  40           HH2      ARG  40 -10.290  11.868  11.868
  345   2HH2  ARG  40           HH2      ARG  40 -10.149  10.842  10.842
  346    H    GLU  41           HN       GLU  41  -5.732   8.763   8.763
  347    HA   GLU  41           HA       GLU  41  -8.108   7.906   7.906
  348   1HB   GLU  41           HBR      GLU  41  -5.469   7.537   7.537
  349   2HB   GLU  41           HBS      GLU  41  -5.797   6.151   6.151
  350   1HG   GLU  41           HGR      GLU  41  -5.584   5.602   5.602
  351   2HG   GLU  41           HGS      GLU  41  -7.185   5.233   5.233
  352    H    LEU  42           HN       LEU  42  -6.663   7.079   7.079
  353    HA   LEU  42           HA       LEU  42  -8.140   4.625   4.625
  354   1HB   LEU  42           HBR      LEU  42  -6.061   5.121   5.121
  355   2HB   LEU  42           HBS      LEU  42  -6.731   6.675   6.675
  356    HG   LEU  42           HG       LEU  42  -8.526   4.741   4.741
  357   1HD1  LEU  42           HMD      LEU  42  -5.797   3.654   3.654
  358   2HD1  LEU  42           HMD      LEU  42  -6.471   3.578   3.578
  359   3HD1  LEU  42           HMD      LEU  42  -7.344   2.822   2.822
  360   1HD2  LEU  42           HMD      LEU  42  -6.617   6.678   6.678
  361   2HD2  LEU  42           HMD      LEU  42  -8.289   6.304   6.304
  362   3HD2  LEU  42           HMD      LEU  42  -6.940   5.314   5.314
  363    H    GLU  43           HN       GLU  43  -8.275   7.853   7.853
  364    HA   GLU  43           HA       GLU  43 -10.611   7.428   7.428
  365   1HB   GLU  43           HBS      GLU  43 -10.625   9.712   9.712
  366   2HB   GLU  43           HBR      GLU  43  -9.070   9.122   9.122
  367   1HG   GLU  43           HGR      GLU  43  -8.353  10.816  10.816
  368   2HG   GLU  43           HGS      GLU  43  -9.283  10.091  10.091
  369    H    ARG  44           HN       ARG  44 -10.125   8.411   8.411
  370    HA   ARG  44           HA       ARG  44 -12.964   9.019   9.019
  371   1HB   ARG  44           HBR      ARG  44 -10.445   9.411   9.411
  372   2HB   ARG  44           HBS      ARG  44 -11.933   9.164   9.164
  373   1HG   ARG  44           HGS      ARG  44 -12.072  11.135  11.135
  374   2HG   ARG  44           HGR      ARG  44 -11.083  11.583  11.583
  375   1HD   ARG  44           HDR      ARG  44 -13.276  12.402  12.402
  376   2HD   ARG  44           HDS      ARG  44 -13.031  11.004  11.004
  377    HE   ARG  44           HE       ARG  44 -14.677  11.009  11.009
  378   1HH1  ARG  44           HH1      ARG  44 -13.581   9.346   9.346
  379   2HH1  ARG  44           HH1      ARG  44 -14.967   8.310   8.310
  380   1HH2  ARG  44           HH2      ARG  44 -16.524   9.705   9.705
  381   2HH2  ARG  44           HH2      ARG  44 -16.626   8.503   8.503
  382    H    PHE  45           HN       PHE  45 -10.961   6.276   6.276
  383    HA   PHE  45           HA       PHE  45 -12.521   4.695   4.695
  384   1HB   PHE  45           HBS      PHE  45 -10.359   4.186   4.186
  385   2HB   PHE  45           HBR      PHE  45 -11.648   2.951   2.951
  386    HD1  PHE  45           HD2      PHE  45 -12.468   2.328   2.328
  387    HD2  PHE  45           HD1      PHE  45  -8.635   3.674   3.674
  388    HE1  PHE  45           HE2      PHE  45 -11.455   1.388   1.388
  389    HE2  PHE  45           HE1      PHE  45  -7.608   2.762   2.762
  390    HZ   PHE  45           HZ       PHE  45  -9.020   1.652   1.652
  391    H    ALA  46           HN       ALA  46 -12.329   4.687   4.687
  392    HA   ALA  46           HA       ALA  46 -15.234   4.474   4.474
  393   1HB   ALA  46           HMB      ALA  46 -13.376   2.200   2.200
  394   2HB   ALA  46           HMB      ALA  46 -14.497   2.070   2.070
  395   3HB   ALA  46           HMB      ALA  46 -15.133   2.315   2.315
  396    H    VAL  47           HN       VAL  47 -12.621   5.837   5.837
  397    HA   VAL  47           HA       VAL  47 -12.543   4.772   4.772
  398    HB   VAL  47           HB       VAL  47 -10.178   5.717   5.717
  399   1HG1  VAL  47           HMG      VAL  47 -10.486   4.273   4.273
  400   2HG1  VAL  47           HMG      VAL  47  -9.000   4.128   4.128
  401   3HG1  VAL  47           HMG      VAL  47  -9.533   5.725   5.725
  402   1HG2  VAL  47           HMG      VAL  47 -11.267   2.909   2.909
  403   2HG2  VAL  47           HMG      VAL  47 -11.096   3.891   3.891
  404   3HG2  VAL  47           HMG      VAL  47  -9.647   3.324   3.324
  405    H    ASN  48           HN       ASN  48 -11.240   6.284   6.284
  406    HA   ASN  48           HA       ASN  48 -11.705   9.125   9.125
  407   1HB   ASN  48           HBS      ASN  48 -13.249   8.557   8.557
  408   2HB   ASN  48           HBR      ASN  48 -11.940   7.864   7.864
  409   1HD2  ASN  48           HD2      ASN  48 -12.957  11.630  11.630
  410   2HD2  ASN  48           HD2      ASN  48 -13.943  10.404  10.404
  411    HA   PRO  49           HA       PRO  49  -7.579   9.643   9.643
  412   1HB   PRO  49           HBR      PRO  49  -7.386  12.292  12.292
  413   2HB   PRO  49           HBS      PRO  49  -7.747  11.563  11.563
  414   1HG   PRO  49           HGR      PRO  49  -9.468  12.953  12.953
  415   2HG   PRO  49           HGS      PRO  49  -9.652  12.596  12.596
  416   1HD   PRO  49           HDR      PRO  49 -10.917  11.354  11.354
  417   2HD   PRO  49           HDS      PRO  49 -10.852  10.818  10.818
  418    H    GLY  50           HN       GLY  50  -8.564  11.653  11.653
  419   1HA   GLY  50           HAR      GLY  50  -6.153  11.353  11.353
  420   2HA   GLY  50           HAS      GLY  50  -7.755  11.831  11.831
  421    H    LEU  51           HN       LEU  51  -8.971   9.375   9.375
  422    HA   LEU  51           HA       LEU  51  -8.756   7.556   7.556
  423   1HB   LEU  51           HBR      LEU  51 -10.612   8.135   8.135
  424   2HB   LEU  51           HBS      LEU  51  -9.796   6.842   6.842
  425    HG   LEU  51           HG       LEU  51 -11.228   6.636   6.636
  426   1HD1  LEU  51           HMD      LEU  51 -11.702   5.587   5.587
  427   2HD1  LEU  51           HMD      LEU  51 -12.457   4.853   4.853
  428   3HD1  LEU  51           HMD      LEU  51 -12.784   6.557   6.557
  429   1HD2  LEU  51           HMD      LEU  51  -9.016   5.326   5.326
  430   2HD2  LEU  51           HMD      LEU  51 -10.478   4.432   4.432
  431   3HD2  LEU  51           HMD      LEU  51  -9.909   4.357   4.357
  432    H    LEU  52           HN       LEU  52  -7.328   7.869   7.869
  433    HA   LEU  52           HA       LEU  52  -5.730   5.492   5.492
  434   1HB   LEU  52           HBS      LEU  52  -6.159   5.383   5.383
  435   2HB   LEU  52           HBR      LEU  52  -6.771   7.055   7.055
  436    HG   LEU  52           HG       LEU  52  -5.103   6.582   6.582
  437   1HD1  LEU  52           HMD      LEU  52  -5.422   8.859   8.859
  438   2HD1  LEU  52           HMD      LEU  52  -4.005   8.531   8.531
  439   3HD1  LEU  52           HMD      LEU  52  -3.828   8.572   8.572
  440   1HD2  LEU  52           HMD      LEU  52  -3.815   5.156   5.156
  441   2HD2  LEU  52           HMD      LEU  52  -3.084   5.697   5.697
  442   3HD2  LEU  52           HMD      LEU  52  -2.843   6.649   6.649
  443    H    GLU  53           HN       GLU  53  -5.388   8.849   8.849
  444    HA   GLU  53           HA       GLU  53  -2.526   9.124   9.124
  445   1HB   GLU  53           HBR      GLU  53  -4.491  10.797  10.797
  446   2HB   GLU  53           HBS      GLU  53  -4.572  10.304  10.304
  447   1HG   GLU  53           HGR      GLU  53  -2.009  11.091  11.091
  448   2HG   GLU  53           HGS      GLU  53  -2.802  12.145  12.145
  449    H    THR  54           HN       THR  54  -4.868   7.691   7.691
  450    HA   THR  54           HA       THR  54  -2.755   6.962   6.962
  451    HB   THR  54           HB       THR  54  -4.487   6.082   6.082
  452    HG1  THR  54           HG1      THR  54  -6.007   6.379   6.379
  453   1HG2  THR  54           HMG      THR  54  -5.626   8.471   8.471
  454   2HG2  THR  54           HMG      THR  54  -6.219   7.843   7.843
  455   3HG2  THR  54           HMG      THR  54  -4.561   8.483   8.483
  456    H    SER  55           HN       SER  55  -2.314   4.803   4.803
  457    HA   SER  55           HA       SER  55  -1.984   2.748   2.748
  458   1HB   SER  55           HBR      SER  55  -1.793   1.247   1.247
  459   2HB   SER  55           HBS      SER  55  -0.749   2.698   2.698
  460    HG   SER  55           HG       SER  55  -1.755   3.556   3.556
  461    H    GLU  56           HN       GLU  56  -4.707   3.537   3.537
  462    HA   GLU  56           HA       GLU  56  -5.827   0.919   0.919
  463   1HB   GLU  56           HBS      GLU  56  -6.089   3.203   3.203
  464   2HB   GLU  56           HBR      GLU  56  -7.393   3.465   3.465
  465   1HG   GLU  56           HGS      GLU  56  -8.701   2.173   2.173
  466   2HG   GLU  56           HGR      GLU  56  -7.477   0.902   0.902
  467    H    GLY  57           HN       GLY  57  -6.604   3.838   3.838
  468   1HA   GLY  57           HAR      GLY  57  -8.678   2.617   2.617
  469   2HA   GLY  57           HAS      GLY  57  -7.802   4.130   4.130
  470    H    CYS  58           HN       CYS  58  -5.173   3.216   3.216
  471    HA   CYS  58           HA       CYS  58  -4.915   2.307   2.307
  472   1HB   CYS  58           HBS      CYS  58  -3.260   3.541   3.541
  473   2HB   CYS  58           HBR      CYS  58  -2.713   1.878   1.878
  474    H    ARG  59           HN       ARG  59  -4.946   0.558   0.558
  475    HA   ARG  59           HA       ARG  59  -4.483  -1.990  -1.990
  476   1HB   ARG  59           HBS      ARG  59  -4.452  -1.219  -1.219
  477   2HB   ARG  59           HBR      ARG  59  -6.204  -1.560  -1.560
  478   1HG   ARG  59           HGR      ARG  59  -5.835  -3.728  -3.728
  479   2HG   ARG  59           HGS      ARG  59  -4.757  -3.791  -3.791
  480   1HD   ARG  59           HDS      ARG  59  -3.625  -2.543  -2.543
  481   2HD   ARG  59           HDR      ARG  59  -3.984  -4.289  -4.289
  482    HE   ARG  59           HE       ARG  59  -2.073  -3.012  -3.012
  483   1HH1  ARG  59           HH1      ARG  59  -3.679  -5.956  -5.956
  484   2HH1  ARG  59           HH1      ARG  59  -2.395  -6.986  -6.986
  485   1HH2  ARG  59           HH2      ARG  59  -0.358  -4.379  -4.379
  486   2HH2  ARG  59           HH2      ARG  59  -0.517  -6.094  -6.094
  487    H    GLN  60           HN       GLN  60  -7.427  -0.095  -0.095
  488    HA   GLN  60           HA       GLN  60  -9.250  -2.379  -2.379
  489   1HB   GLN  60           HBR      GLN  60  -9.861  -0.357  -0.357
  490   2HB   GLN  60           HBS      GLN  60  -9.928   0.564   0.564
  491   1HG   GLN  60           HGS      GLN  60 -11.674  -0.912  -0.912
  492   2HG   GLN  60           HGR      GLN  60 -11.584  -1.889  -1.889
  493   1HE2  GLN  60           HE2      GLN  60 -13.446   1.779   1.779
  494   2HE2  GLN  60           HE2      GLN  60 -12.402   1.265   1.265
  495    H    ILE  61           HN       ILE  61  -7.527   0.046   0.046
  496    HA   ILE  61           HA       ILE  61  -8.803  -0.645  -0.645
  497    HB   ILE  61           HB       ILE  61  -6.245   0.936   0.936
  498   1HG1  ILE  61           HG1      ILE  61  -7.952   2.204   2.204
  499   2HG1  ILE  61           HG1      ILE  61  -7.753   2.850   2.850
  500   1HG2  ILE  61           HMG      ILE  61  -6.482  -0.238  -0.238
  501   2HG2  ILE  61           HMG      ILE  61  -7.628   1.090   1.090
  502   3HG2  ILE  61           HMG      ILE  61  -5.943   1.458   1.458
  503   1HD1  ILE  61           HMD      ILE  61  -9.857   0.777   0.777
  504   2HD1  ILE  61           HMD      ILE  61 -10.133   2.515   2.515
  505   3HD1  ILE  61           HMD      ILE  61  -9.783   1.924   1.924
  506    H    LEU  62           HN       LEU  62  -5.475  -1.191  -1.191
  507    HA   LEU  62           HA       LEU  62  -4.623  -2.606  -2.606
  508   1HB   LEU  62           HBR      LEU  62  -3.431  -1.541  -1.541
  509   2HB   LEU  62           HBS      LEU  62  -3.552  -3.197  -3.197
  510    HG   LEU  62           HG       LEU  62  -2.120  -4.068  -4.068
  511   1HD1  LEU  62           HMD      LEU  62  -3.049  -1.882  -1.882
  512   2HD1  LEU  62           HMD      LEU  62  -1.282  -1.717  -1.717
  513   3HD1  LEU  62           HMD      LEU  62  -1.981  -3.224  -3.224
  514   1HD2  LEU  62           HMD      LEU  62  -1.320  -1.504  -1.504
  515   2HD2  LEU  62           HMD      LEU  62  -0.795  -3.175  -3.175
  516   3HD2  LEU  62           HMD      LEU  62  -0.172  -2.304  -2.304
  517    H    GLY  63           HN       GLY  63  -6.560  -3.634  -3.634
  518   1HA   GLY  63           HAR      GLY  63  -6.407  -6.472  -6.472
  519   2HA   GLY  63           HAS      GLY  63  -7.593  -5.653  -5.653
  520    H    GLN  64           HN       GLN  64  -8.988  -4.006  -4.006
  521    HA   GLN  64           HA       GLN  64 -10.653  -5.638  -5.638
  522   1HB   GLN  64           HBS      GLN  64 -10.906  -3.175  -3.175
  523   2HB   GLN  64           HBR      GLN  64 -10.848  -2.770  -2.770
  524   1HG   GLN  64           HGS      GLN  64 -12.787  -3.933  -3.933
  525   2HG   GLN  64           HGR      GLN  64 -12.632  -4.985  -4.985
  526   1HE2  GLN  64           HE2      GLN  64 -13.858  -1.100  -1.100
  527   2HE2  GLN  64           HE2      GLN  64 -12.479  -1.441  -1.441
  528    H    LEU  65           HN       LEU  65  -7.694  -4.175  -4.175
  529    HA   LEU  65           HA       LEU  65  -8.479  -3.465  -3.465
  530   1HB   LEU  65           HBR      LEU  65  -7.402  -1.973  -1.973
  531   2HB   LEU  65           HBS      LEU  65  -5.905  -2.913  -2.913
  532    HG   LEU  65           HG       LEU  65  -6.073  -2.209  -2.209
  533   1HD1  LEU  65           HMD      LEU  65  -8.433  -0.925  -0.925
  534   2HD1  LEU  65           HMD      LEU  65  -7.309   0.279   0.279
  535   3HD1  LEU  65           HMD      LEU  65  -7.893  -1.066  -1.066
  536   1HD2  LEU  65           HMD      LEU  65  -4.794  -1.230  -1.230
  537   2HD2  LEU  65           HMD      LEU  65  -4.599  -0.564  -0.564
  538   3HD2  LEU  65           HMD      LEU  65  -5.711   0.218   0.218
  539    H    GLN  66           HN       GLN  66  -6.087  -5.480  -5.480
  540    HA   GLN  66           HA       GLN  66  -4.675  -6.425  -6.425
  541   1HB   GLN  66           HBR      GLN  66  -5.044  -7.260  -7.260
  542   2HB   GLN  66           HBS      GLN  66  -5.090  -8.692  -8.692
  543   1HG   GLN  66           HGS      GLN  66  -2.947  -7.103  -7.103
  544   2HG   GLN  66           HGR      GLN  66  -2.839  -7.114  -7.114
  545   1HE2  GLN  66           HE2      GLN  66  -2.792 -10.827 -10.827
  546   2HE2  GLN  66           HE2      GLN  66  -3.871  -9.608  -9.608
  547    HA   PRO  67           HA       PRO  67  -8.310  -9.626  -9.626
  548   1HB   PRO  67           HBS      PRO  67 -10.543  -8.617  -8.617
  549   2HB   PRO  67           HBR      PRO  67  -9.814 -10.035 -10.035
  550   1HG   PRO  67           HGR      PRO  67  -9.797  -7.621  -7.621
  551   2HG   PRO  67           HGS      PRO  67  -9.389  -9.146  -9.146
  552   1HD   PRO  67           HDS      PRO  67  -7.643  -7.178  -7.178
  553   2HD   PRO  67           HDR      PRO  67  -7.252  -8.772  -8.772
  554    H    SER  68           HN       SER  68  -8.953  -6.248  -6.248
  555    HA   SER  68           HA       SER  68 -10.905  -6.218  -6.218
  556   1HB   SER  68           HBS      SER  68  -9.760  -4.170  -4.170
  557   2HB   SER  68           HBR      SER  68 -10.649  -3.655  -3.655
  558    HG   SER  68           HG       SER  68 -12.482  -4.359  -4.359
  559    H    LEU  69           HN       LEU  69  -7.538  -6.199  -6.199
  560    HA   LEU  69           HA       LEU  69  -7.004  -4.415  -4.415
  561   1HB   LEU  69           HBR      LEU  69  -5.499  -6.720  -6.720
  562   2HB   LEU  69           HBS      LEU  69  -4.822  -5.666  -5.666
  563    HG   LEU  69           HG       LEU  69  -5.768  -4.702  -4.702
  564   1HD1  LEU  69           HMD      LEU  69  -3.449  -6.173  -6.173
  565   2HD1  LEU  69           HMD      LEU  69  -2.928  -4.472  -4.472
  566   3HD1  LEU  69           HMD      LEU  69  -3.778  -5.216  -5.216
  567   1HD2  LEU  69           HMD      LEU  69  -5.229  -3.415  -3.415
  568   2HD2  LEU  69           HMD      LEU  69  -5.510  -2.670  -2.670
  569   3HD2  LEU  69           HMD      LEU  69  -3.853  -3.062  -3.062
  570    H    GLN  70           HN       GLN  70  -7.719  -7.878  -7.878
  571    HA   GLN  70           HA       GLN  70  -7.574  -8.488  -8.488
  572   1HB   GLN  70           HBR      GLN  70  -8.888 -10.389 -10.389
  573   2HB   GLN  70           HBS      GLN  70  -7.881 -10.148 -10.148
  574   1HG   GLN  70           HGR      GLN  70 -10.170  -8.811  -8.811
  575   2HG   GLN  70           HGS      GLN  70 -10.809 -10.138 -10.138
  576   1HE2  GLN  70           HE2      GLN  70 -10.973 -11.760 -11.760
  577   2HE2  GLN  70           HE2      GLN  70 -11.845 -10.772 -10.772
  578    H    THR  71           HN       THR  71  -9.703  -6.418  -6.418
  579    HA   THR  71           HA       THR  71 -11.739  -6.622  -6.622
  580    HB   THR  71           HB       THR  71 -13.395  -5.954  -5.954
  581    HG1  THR  71           HG1      THR  71 -12.629  -4.508  -4.508
  582   1HG2  THR  71           HMG      THR  71 -12.117  -8.295  -8.295
  583   2HG2  THR  71           HMG      THR  71 -11.828  -7.572  -7.572
  584   3HG2  THR  71           HMG      THR  71 -13.495  -7.778  -7.778
  585    H    GLY  72           HN       GLY  72  -9.309  -4.586  -4.586
  586   1HA   GLY  72           HAR      GLY  72 -10.783  -2.047  -2.047
  587   2HA   GLY  72           HAS      GLY  72  -9.222  -2.246  -2.246
  588    H    SER  73           HN       SER  73  -7.372  -2.929  -2.929
  589    HA   SER  73           HA       SER  73  -7.226  -3.154  -3.154
  590   1HB   SER  73           HBS      SER  73  -6.307  -0.949  -0.949
  591   2HB   SER  73           HBR      SER  73  -8.071  -0.997  -0.997
  592    HG   SER  73           HG       SER  73  -7.676   0.786   0.786
  593    H    GLU  74           HN       GLU  74  -4.983  -2.711  -2.711
  594    HA   GLU  74           HA       GLU  74  -2.775  -3.183  -3.183
  595   1HB   GLU  74           HBS      GLU  74  -3.272  -3.374  -3.374
  596   2HB   GLU  74           HBR      GLU  74  -2.682  -1.812  -1.812
  597   1HG   GLU  74           HGR      GLU  74  -0.485  -2.516  -2.516
  598   2HG   GLU  74           HGS      GLU  74  -1.107  -3.960  -3.960
  599    H    GLU  75           HN       GLU  75  -4.749  -0.496  -0.496
  600    HA   GLU  75           HA       GLU  75  -2.937   1.559   1.559
  601   1HB   GLU  75           HBR      GLU  75  -5.854   1.989   1.989
  602   2HB   GLU  75           HBS      GLU  75  -4.599   2.956   2.956
  603   1HG   GLU  75           HGR      GLU  75  -4.635   0.932   0.932
  604   2HG   GLU  75           HGS      GLU  75  -6.320   1.357   1.357
  605    H    LEU  76           HN       LEU  76  -5.462  -0.364  -0.364
  606    HA   LEU  76           HA       LEU  76  -5.355   1.000   1.000
  607   1HB   LEU  76           HBR      LEU  76  -6.865  -1.020  -1.020
  608   2HB   LEU  76           HBS      LEU  76  -5.957  -1.848  -1.848
  609    HG   LEU  76           HG       LEU  76  -8.060   0.300   0.300
  610   1HD1  LEU  76           HMD      LEU  76  -7.947  -2.531  -2.531
  611   2HD1  LEU  76           HMD      LEU  76  -8.208  -1.842  -1.842
  612   3HD1  LEU  76           HMD      LEU  76  -9.321  -1.434  -1.434
  613   1HD2  LEU  76           HMD      LEU  76  -6.173   0.952   0.952
  614   2HD2  LEU  76           HMD      LEU  76  -7.560   0.389   0.389
  615   3HD2  LEU  76           HMD      LEU  76  -6.152  -0.676  -0.676
  616    H    ARG  77           HN       ARG  77  -3.455  -1.294  -1.294
  617    HA   ARG  77           HA       ARG  77  -2.144  -2.573  -2.573
  618   1HB   ARG  77           HBS      ARG  77  -2.343  -3.368  -3.368
  619   2HB   ARG  77           HBR      ARG  77  -0.938  -2.300  -2.300
  620   1HG   ARG  77           HGS      ARG  77  -0.639  -4.134  -4.134
  621   2HG   ARG  77           HGR      ARG  77  -0.797  -4.940  -4.940
  622   1HD   ARG  77           HDR      ARG  77   0.934  -2.755  -2.755
  623   2HD   ARG  77           HDS      ARG  77   1.436  -3.558  -3.558
  624    HE   ARG  77           HE       ARG  77   1.829  -4.533  -4.533
  625   1HH1  ARG  77           HH1      ARG  77   1.298  -5.533  -5.533
  626   2HH1  ARG  77           HH1      ARG  77   1.833  -7.156  -7.156
  627   1HH2  ARG  77           HH2      ARG  77   2.402  -6.696  -6.696
  628   2HH2  ARG  77           HH2      ARG  77   2.459  -7.813  -7.813
  629    H    SER  78           HN       SER  78  -1.412   0.177   0.177
  630    HA   SER  78           HA       SER  78   0.978   1.041   1.041
  631   1HB   SER  78           HBR      SER  78  -0.787   2.027   2.027
  632   2HB   SER  78           HBS      SER  78  -0.521   3.302   3.302
  633    HG   SER  78           HG       SER  78   1.032   2.445   2.445
  634    H    LEU  79           HN       LEU  79  -2.479   1.793   1.793
  635    HA   LEU  79           HA       LEU  79  -2.198   3.390   3.390
  636   1HB   LEU  79           HBR      LEU  79  -4.194   2.744   2.744
  637   2HB   LEU  79           HBS      LEU  79  -4.471   1.454   1.454
  638    HG   LEU  79           HG       LEU  79  -5.053   2.975   2.975
  639   1HD1  LEU  79           HMD      LEU  79  -3.199   4.601   4.601
  640   2HD1  LEU  79           HMD      LEU  79  -4.161   5.261   5.261
  641   3HD1  LEU  79           HMD      LEU  79  -4.779   5.359   5.359
  642   1HD2  LEU  79           HMD      LEU  79  -6.112   3.461   3.461
  643   2HD2  LEU  79           HMD      LEU  79  -6.937   2.887   2.887
  644   3HD2  LEU  79           HMD      LEU  79  -6.583   4.623   4.623
  645    H    TYR  80           HN       TYR  80  -1.862  -0.049  -0.049
  646    HA   TYR  80           HA       TYR  80  -2.443  -0.713  -0.713
  647   1HB   TYR  80           HBS      TYR  80  -2.955  -2.298  -2.298
  648   2HB   TYR  80           HBR      TYR  80  -1.267  -2.302  -2.302
  649    HD1  TYR  80           HD1      TYR  80  -3.368  -3.222  -3.222
  650    HD2  TYR  80           HD2      TYR  80   0.285  -3.823  -3.823
  651    HE1  TYR  80           HE1      TYR  80  -2.837  -5.109  -5.109
  652    HE2  TYR  80           HE2      TYR  80   0.877  -5.640  -5.640
  653    HH   TYR  80           HH       TYR  80  -0.855  -7.384  -7.384
  654    H    ASN  81           HN       ASN  81   0.473  -0.147  -0.147
  655    HA   ASN  81           HA       ASN  81   2.205  -0.787  -0.787
  656   1HB   ASN  81           HBS      ASN  81   4.004   0.108   0.108
  657   2HB   ASN  81           HBR      ASN  81   2.959  -1.040  -1.040
  658   1HD2  ASN  81           HD2      ASN  81   3.356   1.319   1.319
  659   2HD2  ASN  81           HD2      ASN  81   3.860  -0.211  -0.211
  660    H    THR  82           HN       THR  82   0.895   2.273   2.273
  661    HA   THR  82           HA       THR  82   2.499   3.895   3.895
  662    HB   THR  82           HB       THR  82   0.072   5.313   5.313
  663    HG1  THR  82           HG1      THR  82   1.245   3.827   3.827
  664   1HG2  THR  82           HMG      THR  82   2.811   5.722   5.722
  665   2HG2  THR  82           HMG      THR  82   2.178   5.863   5.863
  666   3HG2  THR  82           HMG      THR  82   1.493   6.867   6.867
  667    H    ILE  83           HN       ILE  83  -0.639   2.341   2.341
  668    HA   ILE  83           HA       ILE  83  -1.227   3.370   3.370
  669    HB   ILE  83           HB       ILE  83  -2.270   1.247   1.247
  670   1HG1  ILE  83           HG1      ILE  83  -3.184   3.488   3.488
  671   2HG1  ILE  83           HG1      ILE  83  -4.377   2.233   2.233
  672   1HG2  ILE  83           HMG      ILE  83  -1.789   0.018   0.018
  673   2HG2  ILE  83           HMG      ILE  83  -3.172   0.980   0.980
  674   3HG2  ILE  83           HMG      ILE  83  -3.377  -0.125  -0.125
  675   1HD1  ILE  83           HMD      ILE  83  -3.901   2.676   2.676
  676   2HD1  ILE  83           HMD      ILE  83  -2.750   3.953   3.953
  677   3HD1  ILE  83           HMD      ILE  83  -4.488   4.141   4.141
  678    H    ALA  84           HN       ALA  84   0.329   0.319   0.319
  679    HA   ALA  84           HA       ALA  84   0.639  -0.656  -0.656
  680   1HB   ALA  84           HMB      ALA  84   2.158  -1.381  -1.381
  681   2HB   ALA  84           HMB      ALA  84   2.223  -2.284  -2.284
  682   3HB   ALA  84           HMB      ALA  84   0.685  -2.148  -2.148
  683    H    VAL  85           HN       VAL  85   2.759   1.326   1.326
  684    HA   VAL  85           HA       VAL  85   4.960   1.420   1.420
  685    HB   VAL  85           HB       VAL  85   4.051   3.252   3.252
  686   1HG1  VAL  85           HMG      VAL  85   5.341   4.405   4.405
  687   2HG1  VAL  85           HMG      VAL  85   6.749   3.537   3.537
  688   3HG1  VAL  85           HMG      VAL  85   5.846   4.676   4.676
  689   1HG2  VAL  85           HMG      VAL  85   5.128   0.864   0.864
  690   2HG2  VAL  85           HMG      VAL  85   5.575   2.226   2.226
  691   3HG2  VAL  85           HMG      VAL  85   6.634   1.765   1.765
  692    H    LEU  86           HN       LEU  86   2.219   3.655   3.655
  693    HA   LEU  86           HA       LEU  86   2.826   5.399   5.399
  694   1HB   LEU  86           HBS      LEU  86   1.166   5.494   5.494
  695   2HB   LEU  86           HBR      LEU  86  -0.006   4.888   4.888
  696    HG   LEU  86           HG       LEU  86   0.093   6.843   6.843
  697   1HD1  LEU  86           HMD      LEU  86   2.715   7.224   7.224
  698   2HD1  LEU  86           HMD      LEU  86   1.758   8.698   8.698
  699   3HD1  LEU  86           HMD      LEU  86   2.193   7.635   7.635
  700   1HD2  LEU  86           HMD      LEU  86  -0.035   7.098   7.098
  701   2HD2  LEU  86           HMD      LEU  86  -1.260   7.456   7.456
  702   3HD2  LEU  86           HMD      LEU  86   0.053   8.618   8.618
  703    H    TYR  87           HN       TYR  87   1.232   2.293   2.293
  704    HA   TYR  87           HA       TYR  87   0.602   2.331   2.331
  705   1HB   TYR  87           HBS      TYR  87  -0.195   0.674   0.674
  706   2HB   TYR  87           HBR      TYR  87   1.331  -0.207  -0.207
  707    HD1  TYR  87           HD1      TYR  87   1.795  -0.352  -0.352
  708    HD2  TYR  87           HD2      TYR  87  -2.045   0.197   0.197
  709    HE1  TYR  87           HE1      TYR  87   0.748  -1.172  -1.172
  710    HE2  TYR  87           HE2      TYR  87  -3.092  -0.297  -0.297
  711    HH   TYR  87           HH       TYR  87  -1.231  -1.981  -1.981
  712    H    CYS  88           HN       CYS  88   3.514   1.256   1.256
  713    HA   CYS  88           HA       CYS  88   5.108   0.400   0.400
  714   1HB   CYS  88           HBS      CYS  88   5.430   1.212   1.212
  715   2HB   CYS  88           HBR      CYS  88   6.776   1.765   1.765
  716    H    VAL  89           HN       VAL  89   4.648   3.604   3.604
  717    HA   VAL  89           HA       VAL  89   6.550   4.880   4.880
  718    HB   VAL  89           HB       VAL  89   4.268   6.265   6.265
  719   1HG1  VAL  89           HMG      VAL  89   7.061   7.060   7.060
  720   2HG1  VAL  89           HMG      VAL  89   6.190   7.906   7.906
  721   3HG1  VAL  89           HMG      VAL  89   5.511   7.866   7.866
  722   1HG2  VAL  89           HMG      VAL  89   6.185   4.514   4.514
  723   2HG2  VAL  89           HMG      VAL  89   4.862   5.447   5.447
  724   3HG2  VAL  89           HMG      VAL  89   6.469   6.187   6.187
  725    H    HIS  90           HN       HIS  90   3.033   4.482   4.482
  726    HA   HIS  90           HA       HIS  90   2.731   6.220   6.220
  727   1HB   HIS  90           HBS      HIS  90   0.855   4.079   4.079
  728   2HB   HIS  90           HBR      HIS  90   0.485   5.191   5.191
  729    HD1  HIS  90           HD1      HIS  90   1.859   7.736   7.736
  730    HD2  HIS  90           HD2      HIS  90  -0.899   5.065   5.065
  731    HE1  HIS  90           HE1      HIS  90   0.768   8.919   8.919
  732    HE2  HIS  90           HE2      HIS  90  -0.984   7.350   7.350
  733    H    GLN  91           HN       GLN  91   3.813   3.025   3.025
  734    HA   GLN  91           HA       GLN  91   2.834   1.987   1.987
  735   1HB   GLN  91           HBS      GLN  91   2.380   0.690   0.690
  736   2HB   GLN  91           HBR      GLN  91   4.130   0.541   0.541
  737   1HG   GLN  91           HGS      GLN  91   3.152  -1.485  -1.485
  738   2HG   GLN  91           HGR      GLN  91   4.446  -0.756  -0.756
  739   1HE2  GLN  91           HE2      GLN  91   2.507  -0.774  -0.774
  740   2HE2  GLN  91           HE2      GLN  91   4.057  -0.868  -0.868
  741    H    ARG  92           HN       ARG  92   5.519   3.612   3.612
  742    HA   ARG  92           HA       ARG  92   7.550   3.940   3.940
  743   1HB   ARG  92           HBS      ARG  92   7.111   1.433   1.433
  744   2HB   ARG  92           HBR      ARG  92   8.340   2.712   2.712
  745   1HG   ARG  92           HGR      ARG  92   5.342   2.897   2.897
  746   2HG   ARG  92           HGS      ARG  92   6.632   2.966   2.966
  747   1HD   ARG  92           HDR      ARG  92   6.897   5.133   5.133
  748   2HD   ARG  92           HDS      ARG  92   7.039   4.946   4.946
  749    HE   ARG  92           HE       ARG  92   4.943   5.869   5.869
  750   1HH1  ARG  92           HH1      ARG  92   5.228   4.219   4.219
  751   2HH1  ARG  92           HH1      ARG  92   3.555   4.433   4.433
  752   1HH2  ARG  92           HH2      ARG  92   2.735   6.019   6.019
  753   2HH2  ARG  92           HH2      ARG  92   2.144   5.453   5.453
  754    H    ILE  93           HN       ILE  93   6.916   2.312   2.312
  755    HA   ILE  93           HA       ILE  93   9.720   1.307   1.307
  756    HB   ILE  93           HB       ILE  93   7.323   0.388   0.388
  757   1HG1  ILE  93           HG1      ILE  93   7.557  -1.734  -1.734
  758   2HG1  ILE  93           HG1      ILE  93   8.424  -0.666  -0.666
  759   1HG2  ILE  93           HMG      ILE  93   9.560   0.052   0.052
  760   2HG2  ILE  93           HMG      ILE  93  10.005  -0.955  -0.955
  761   3HG2  ILE  93           HMG      ILE  93   8.679  -1.463  -1.463
  762   1HD1  ILE  93           HMD      ILE  93   5.935   0.535   0.535
  763   2HD1  ILE  93           HMD      ILE  93   5.666  -1.071  -1.071
  764   3HD1  ILE  93           HMD      ILE  93   6.526   0.191   0.191
  765    H    ASP  94           HN       ASP  94  10.954   1.979   1.979
  766    HA   ASP  94           HA       ASP  94   9.684   3.669   3.669
  767   1HB   ASP  94           HBS      ASP  94  11.536   5.148   5.148
  768   2HB   ASP  94           HBR      ASP  94  10.879   5.226   5.226
  769    H    VAL  95           HN       VAL  95  10.535   3.440   3.440
  770    HA   VAL  95           HA       VAL  95  12.189   0.994   0.994
  771    HB   VAL  95           HB       VAL  95  10.602   0.031   0.031
  772   1HG1  VAL  95           HMG      VAL  95   9.968   0.491   0.491
  773   2HG1  VAL  95           HMG      VAL  95   8.649   1.437   1.437
  774   3HG1  VAL  95           HMG      VAL  95   8.825  -0.292  -0.292
  775   1HG2  VAL  95           HMG      VAL  95   9.825   2.739   2.739
  776   2HG2  VAL  95           HMG      VAL  95   9.629   1.207   1.207
  777   3HG2  VAL  95           HMG      VAL  95   8.420   1.697   1.697
  778    H    LYS  96           HN       LYS  96  12.270   0.723   0.723
  779    HA   LYS  96           HA       LYS  96  13.990   3.044   3.044
  780   1HB   LYS  96           HBR      LYS  96  14.787   0.227   0.227
  781   2HB   LYS  96           HBS      LYS  96  15.754   1.728   1.728
  782   1HG   LYS  96           HGS      LYS  96  14.902   0.151   0.151
  783   2HG   LYS  96           HGR      LYS  96  16.556   0.362   0.362
  784   1HD   LYS  96           HDS      LYS  96  14.868   2.703   2.703
  785   2HD   LYS  96           HDR      LYS  96  15.693   1.715   1.715
  786   1HE   LYS  96           HES      LYS  96  17.740   2.479   2.479
  787   2HE   LYS  96           HER      LYS  96  17.344   2.616   2.616
  788   1HZ   LYS  96           HZB      LYS  96  16.113   4.435   4.435
  789   2HZ   LYS  96           HZC      LYS  96  17.642   4.716   4.716
  790   3HZ   LYS  96           HZA      LYS  96  16.426   4.658   4.658
  791    H    ASP  97           HN       ASP  97  12.586  -0.046  -0.046
  792    HA   ASP  97           HA       ASP  97  11.455   1.476   1.476
  793   1HB   ASP  97           HBS      ASP  97  11.840  -0.402  -0.402
  794   2HB   ASP  97           HBR      ASP  97  13.305  -0.176  -0.176
  795    H    THR  98           HN       THR  98   9.528   0.503   0.503
  796    HA   THR  98           HA       THR  98   7.300   0.050   0.050
  797    HB   THR  98           HB       THR  98   7.765  -1.222  -1.222
  798    HG1  THR  98           HG1      THR  98   8.222   0.471   0.471
  799   1HG2  THR  98           HMG      THR  98   5.494  -1.178  -1.178
  800   2HG2  THR  98           HMG      THR  98   5.169  -0.036  -0.036
  801   3HG2  THR  98           HMG      THR  98   5.604  -1.725  -1.725
  802    H    LYS  99           HN       LYS  99   9.268  -2.448  -2.448
  803    HA   LYS  99           HA       LYS  99   7.578  -4.569  -4.569
  804   1HB   LYS  99           HBS      LYS  99  10.558  -4.856  -4.856
  805   2HB   LYS  99           HBR      LYS  99   9.262  -6.044  -6.044
  806   1HG   LYS  99           HGS      LYS  99   8.652  -5.058  -5.058
  807   2HG   LYS  99           HGR      LYS  99   9.138  -3.423  -3.423
  808   1HD   LYS  99           HDR      LYS  99  11.001  -5.685  -5.685
  809   2HD   LYS  99           HDS      LYS  99  10.497  -4.447  -4.447
  810   1HE   LYS  99           HES      LYS  99  12.094  -4.078  -4.078
  811   2HE   LYS  99           HER      LYS  99  12.676  -3.939  -3.939
  812   1HZ   LYS  99           HZC      LYS  99  10.555  -2.231  -2.231
  813   2HZ   LYS  99           HZA      LYS  99  12.135  -1.822  -1.822
  814   3HZ   LYS  99           HZB      LYS  99  11.408  -2.020  -2.020
  815    H    GLU 100           HN       GLU 100  10.043  -2.963  -2.963
  816    HA   GLU 100           HA       GLU 100  10.153  -5.173  -5.173
  817   1HB   GLU 100           HBS      GLU 100  11.683  -2.888  -2.888
  818   2HB   GLU 100           HBR      GLU 100  11.860  -3.073  -3.073
  819   1HG   GLU 100           HGS      GLU 100  12.283  -5.461  -5.461
  820   2HG   GLU 100           HGR      GLU 100  13.415  -4.127  -4.127
  821    H    ALA 101           HN       ALA 101   8.753  -2.008  -2.008
  822    HA   ALA 101           HA       ALA 101   7.931  -1.853  -1.853
  823   1HB   ALA 101           HMB      ALA 101   7.769  -0.081  -0.081
  824   2HB   ALA 101           HMB      ALA 101   6.113  -0.721  -0.721
  825   3HB   ALA 101           HMB      ALA 101   6.897   0.046   0.046
  826    H    LEU 102           HN       LEU 102   6.571  -2.813  -2.813
  827    HA   LEU 102           HA       LEU 102   4.281  -4.085  -4.085
  828   1HB   LEU 102           HBR      LEU 102   5.298  -3.465  -3.465
  829   2HB   LEU 102           HBS      LEU 102   5.625  -5.221  -5.221
  830    HG   LEU 102           HG       LEU 102   3.188  -5.583  -5.583
  831   1HD1  LEU 102           HMD      LEU 102   3.279  -2.639  -2.639
  832   2HD1  LEU 102           HMD      LEU 102   2.010  -3.340  -3.340
  833   3HD1  LEU 102           HMD      LEU 102   2.072  -3.750  -3.750
  834   1HD2  LEU 102           HMD      LEU 102   4.526  -5.448  -5.448
  835   2HD2  LEU 102           HMD      LEU 102   2.750  -5.597  -5.597
  836   3HD2  LEU 102           HMD      LEU 102   3.511  -4.009  -4.009
  837    H    ASP 103           HN       ASP 103   7.594  -5.110  -5.110
  838    HA   ASP 103           HA       ASP 103   6.993  -7.798  -7.798
  839   1HB   ASP 103           HBR      ASP 103   9.189  -8.178  -8.178
  840   2HB   ASP 103           HBS      ASP 103   9.170  -6.654  -6.654
  841    H    LYS 104           HN       LYS 104   7.917  -4.925  -4.925
  842    HA   LYS 104           HA       LYS 104   7.836  -6.322  -6.322
  843   1HB   LYS 104           HBS      LYS 104   8.944  -4.008  -4.008
  844   2HB   LYS 104           HBR      LYS 104   7.392  -3.366  -3.366
  845   1HG   LYS 104           HGR      LYS 104   8.693  -3.272  -3.272
  846   2HG   LYS 104           HGS      LYS 104   7.918  -4.870  -4.870
  847   1HD   LYS 104           HDR      LYS 104  10.523  -4.698  -4.698
  848   2HD   LYS 104           HDS      LYS 104  10.532  -4.482  -4.482
  849   1HE   LYS 104           HER      LYS 104   9.434  -6.844  -6.844
  850   2HE   LYS 104           HES      LYS 104  10.957  -6.799  -6.799
  851   1HZ   LYS 104           HZB      LYS 104   9.427  -6.175  -6.175
  852   2HZ   LYS 104           HZC      LYS 104   8.212  -6.764  -6.764
  853   3HZ   LYS 104           HZA      LYS 104   9.450  -7.735  -7.735
  854    H    ILE 105           HN       ILE 105   5.496  -5.116  -5.116
  855    HA   ILE 105           HA       ILE 105   3.476  -4.864  -4.864
  856    HB   ILE 105           HB       ILE 105   3.384  -4.362  -4.362
  857   1HG1  ILE 105           HG1      ILE 105   5.112  -3.202  -3.202
  858   2HG1  ILE 105           HG1      ILE 105   4.201  -2.227  -2.227
  859   1HG2  ILE 105           HMG      ILE 105   1.392  -3.940  -3.940
  860   2HG2  ILE 105           HMG      ILE 105   1.591  -2.625  -2.625
  861   3HG2  ILE 105           HMG      ILE 105   1.159  -4.264  -4.264
  862   1HD1  ILE 105           HMD      ILE 105   2.602  -1.868  -1.868
  863   2HD1  ILE 105           HMD      ILE 105   4.093  -2.275  -2.275
  864   3HD1  ILE 105           HMD      ILE 105   4.076  -0.892  -0.892
  865    H    GLU 106           HN       GLU 106   4.360  -7.098  -7.098
  866    HA   GLU 106           HA       GLU 106   1.835  -8.632  -8.632
  867   1HB   GLU 106           HBR      GLU 106   3.713  -8.196  -8.196
  868   2HB   GLU 106           HBS      GLU 106   4.316  -9.586  -9.586
  869   1HG   GLU 106           HGR      GLU 106   3.244 -10.414 -10.414
  870   2HG   GLU 106           HGS      GLU 106   2.193 -10.709 -10.709
  871    H    GLU 107           HN       GLU 107   4.963  -8.388  -8.388
  872    HA   GLU 107           HA       GLU 107   5.025 -10.929 -10.929
  873   1HB   GLU 107           HBR      GLU 107   6.713  -8.949  -8.949
  874   2HB   GLU 107           HBS      GLU 107   5.874  -8.225  -8.225
  875   1HG   GLU 107           HGS      GLU 107   7.210  -8.949  -8.949
  876   2HG   GLU 107           HGR      GLU 107   6.568 -10.600 -10.600
  877    H    GLU 108           HN       GLU 108   2.972  -8.178  -8.178
  878    HA   GLU 108           HA       GLU 108   1.175  -7.528  -7.528
  879   1HB   GLU 108           HBR      GLU 108   1.297  -9.265  -9.265
  880   2HB   GLU 108           HBS      GLU 108   0.071  -8.925  -8.925
  881   1HG   GLU 108           HGS      GLU 108   1.337 -10.598 -10.598
  882   2HG   GLU 108           HGR      GLU 108   1.773 -11.277 -11.277
  883    H    GLN 109           HN       GLN 109   4.242  -7.298  -7.298
  884    HA   GLN 109           HA       GLN 109   5.631  -5.937  -5.937
  885   1HB   GLN 109           HBR      GLN 109   4.204  -4.483  -4.483
  886   2HB   GLN 109           HBS      GLN 109   2.874  -4.708  -4.708
  887   1HG   GLN 109           HGS      GLN 109   3.680  -3.131  -3.131
  888   2HG   GLN 109           HGR      GLN 109   5.384  -3.581  -3.581
  889   1HE2  GLN 109           HE2      GLN 109   3.478  -1.038  -1.038
  890   2HE2  GLN 109           HE2      GLN 109   2.570  -2.135  -2.135
  891    H    ASN 110           HN       ASN 110   4.286  -8.086  -8.086
  892    HA   ASN 110           HA       ASN 110   5.154  -6.887  -6.887
  893   1HB   ASN 110           HBS      ASN 110   2.530  -8.110  -8.110
  894   2HB   ASN 110           HBR      ASN 110   3.411  -8.738  -8.738
  895   1HD2  ASN 110           HD2      ASN 110   1.369  -5.358  -5.358
  896   2HD2  ASN 110           HD2      ASN 110   1.111  -6.605  -6.605
  897    H    LYS 111           HN       LYS 111   4.224 -10.020 -10.020
  898    HA   LYS 111           HA       LYS 111   6.811 -10.812 -10.812
  899   1HB   LYS 111           HBR      LYS 111   6.272 -11.139 -11.139
  900   2HB   LYS 111           HBS      LYS 111   6.385 -12.751 -12.751
  901   1HG   LYS 111           HGR      LYS 111   8.473 -10.542 -10.542
  902   2HG   LYS 111           HGS      LYS 111   8.576 -12.147 -12.147
  903   1HD   LYS 111           HDS      LYS 111   8.105 -12.128 -12.128
  904   2HD   LYS 111           HDR      LYS 111   9.644 -11.506 -11.506
  905   1HE   LYS 111           HES      LYS 111  10.280 -13.514 -13.514
  906   2HE   LYS 111           HER      LYS 111   8.608 -14.140 -14.140
  907   1HZ   LYS 111           HZA      LYS 111  10.175 -13.566 -13.566
  908   2HZ   LYS 111           HZB      LYS 111  10.114 -15.040 -15.040
  909   3HZ   LYS 111           HZC      LYS 111   8.755 -14.366 -14.366
  910    H    SER 112           HN       SER 112   6.840 -13.475 -13.475
  911    HA   SER 112           HA       SER 112   5.932 -15.479 -15.479
  912   1HB   SER 112           HBS      SER 112   4.118 -14.306 -14.306
  913   2HB   SER 112           HBR      SER 112   3.115 -14.856 -14.856
  914    HG   SER 112           HG       SER 112   4.442 -16.883 -16.883
  915    H    LYS 113           HN       LYS 113   5.847 -16.179 -16.179
  916    HA   LYS 113           HA       LYS 113   3.553 -16.051 -16.051
  917   1HB   LYS 113           HBR      LYS 113   4.132 -13.699 -13.699
  918   2HB   LYS 113           HBS      LYS 113   5.711 -14.219 -14.219
  919   1HG   LYS 113           HGR      LYS 113   4.696 -14.226 -14.226
  920   2HG   LYS 113           HGS      LYS 113   3.912 -15.737 -15.737
  921   1HD   LYS 113           HDS      LYS 113   2.371 -13.664 -13.664
  922   2HD   LYS 113           HDR      LYS 113   2.785 -13.128 -13.128
  923   1HE   LYS 113           HES      LYS 113   1.529 -15.794 -15.794
  924   2HE   LYS 113           HER      LYS 113   0.676 -14.338 -14.338
  925   1HZ   LYS 113           HZC      LYS 113   2.747 -14.750 -14.750
  926   2HZ   LYS 113           HZA      LYS 113   2.132 -16.241 -16.241
  927   3HZ   LYS 113           HZB      LYS 113   1.166 -15.041 -15.041
  928    H    LYS 114           HN       LYS 114   3.600 -17.726 -17.726
  929    HA   LYS 114           HA       LYS 114   6.249 -18.994 -18.994
  930   1HB   LYS 114           HBR      LYS 114   5.016 -20.046 -20.046
  931   2HB   LYS 114           HBS      LYS 114   3.639 -20.342 -20.342
  932   1HG   LYS 114           HGR      LYS 114   5.325 -21.642 -21.642
  933   2HG   LYS 114           HGS      LYS 114   6.392 -21.604 -21.604
  934   1HD   LYS 114           HDS      LYS 114   5.268 -23.187 -23.187
  935   2HD   LYS 114           HDR      LYS 114   3.737 -22.420 -22.420
  936   1HE   LYS 114           HES      LYS 114   4.395 -23.422 -23.422
  937   2HE   LYS 114           HER      LYS 114   5.005 -24.660 -24.660
  938   1HZ   LYS 114           HZC      LYS 114   2.334 -23.574 -23.574
  939   2HZ   LYS 114           HZA      LYS 114   2.567 -24.695 -24.695
  940   3HZ   LYS 114           HZB      LYS 114   2.921 -25.048 -25.048
  941    H    LYS 115           HN       LYS 115   2.901 -19.899 -19.899
  942    HA   LYS 115           HA       LYS 115   1.920 -20.500 -20.500
  943   1HB   LYS 115           HBR      LYS 115   3.481 -18.225 -18.225
  944   2HB   LYS 115           HBS      LYS 115   3.725 -19.480 -19.480
  945   1HG   LYS 115           HGR      LYS 115   0.913 -19.234 -19.234
  946   2HG   LYS 115           HGS      LYS 115   1.588 -17.676 -17.676
  947   1HD   LYS 115           HDS      LYS 115   1.165 -18.378 -18.378
  948   2HD   LYS 115           HDR      LYS 115   2.605 -19.340 -19.340
  949   1HE   LYS 115           HES      LYS 115   1.505 -21.285 -21.285
  950   2HE   LYS 115           HER      LYS 115   0.183 -20.602 -20.602
  951   1HZ   LYS 115           HZA      LYS 115   0.239 -19.567 -19.567
  952   2HZ   LYS 115           HZB      LYS 115   0.053 -21.190 -21.190
  953   3HZ   LYS 115           HZC      LYS 115  -0.997 -20.240 -20.240
  954    H    ALA 116           HN       ALA 116   2.459 -21.702 -21.702
  955    HA   ALA 116           HA       ALA 116   5.022 -22.605 -22.605
  956   1HB   ALA 116           HMB      ALA 116   3.592 -24.300 -24.300
  957   2HB   ALA 116           HMB      ALA 116   4.402 -25.134 -25.134
  958   3HB   ALA 116           HMB      ALA 116   5.335 -24.061 -24.061
  959    H    GLN 117           HN       GLN 117   2.237 -24.794 -24.794
  960    HA   GLN 117           HA       GLN 117   1.057 -25.871 -25.871
  961   1HB   GLN 117           HBR      GLN 117   1.126 -23.163 -23.163
  962   2HB   GLN 117           HBS      GLN 117   1.258 -24.319 -24.319
  963   1HG   GLN 117           HGS      GLN 117  -0.848 -24.567 -24.567
  964   2HG   GLN 117           HGR      GLN 117  -1.082 -23.572 -23.572
  965   1HE2  GLN 117           HE2      GLN 117  -1.573 -27.582 -27.582
  966   2HE2  GLN 117           HE2      GLN 117  -1.149 -26.693 -26.693
  967    H    GLN 118           HN       GLN 118   1.311 -26.650 -26.650
  968    HA   GLN 118           HA       GLN 118   3.950 -26.472 -26.472
  969   1HB   GLN 118           HBR      GLN 118   3.123 -29.098 -29.098
  970   2HB   GLN 118           HBS      GLN 118   4.220 -29.012 -29.012
  971   1HG   GLN 118           HGS      GLN 118   5.848 -28.900 -28.900
  972   2HG   GLN 118           HGR      GLN 118   5.350 -27.193 -27.193
  973   1HE2  GLN 118           HE2      GLN 118   5.465 -28.182 -28.182
  974   2HE2  GLN 118           HE2      GLN 118   6.408 -27.542 -27.542
  975    H    ALA 119           HN       ALA 119   1.891 -29.296 -29.296
  976    HA   ALA 119           HA       ALA 119   0.551 -30.002 -30.002
  977   1HB   ALA 119           HMB      ALA 119  -0.752 -27.948 -27.948
  978   2HB   ALA 119           HMB      ALA 119   0.299 -27.067 -27.067
  979   3HB   ALA 119           HMB      ALA 119  -0.716 -28.410 -28.410
  980    H    ALA 120           HN       ALA 120   1.213 -30.955 -30.955
  981    HA   ALA 120           HA       ALA 120   2.128 -29.604 -29.604
  982   1HB   ALA 120           HMB      ALA 120   4.304 -30.665 -30.665
  983   2HB   ALA 120           HMB      ALA 120   4.472 -30.788 -30.788
  984   3HB   ALA 120           HMB      ALA 120   4.250 -29.194 -29.194
  985    H    ALA 121           HN       ALA 121   2.741 -31.089 -31.089
  986    HA   ALA 121           HA       ALA 121   2.652 -33.025 -33.025
  987   1HB   ALA 121           HMB      ALA 121   4.368 -33.633 -33.633
  988   2HB   ALA 121           HMB      ALA 121   3.094 -34.311 -34.311
  989   3HB   ALA 121           HMB      ALA 121   3.412 -35.032 -35.032
  990    H    ASP 122           HN       ASP 122   0.790 -33.488 -33.488
  991    HA   ASP 122           HA       ASP 122  -0.639 -35.673 -35.673
  992   1HB   ASP 122           HBS      ASP 122  -2.839 -34.816 -34.816
  993   2HB   ASP 122           HBR      ASP 122  -1.612 -34.244 -34.244
  994    H    THR 123           HN       THR 123  -0.561 -36.565 -36.565
  995    HA   THR 123           HA       THR 123  -2.639 -36.084 -36.084
  996    HB   THR 123           HB       THR 123  -1.349 -34.025 -34.025
  997    HG1  THR 123           HG1      THR 123  -1.555 -34.373 -34.373
  998   1HG2  THR 123           HMG      THR 123   0.946 -35.183 -35.183
  999   2HG2  THR 123           HMG      THR 123   0.613 -35.831 -35.831
 1000   3HG2  THR 123           HMG      THR 123   0.684 -34.069 -34.069
 1001    H    GLY 124           HN       GLY 124  -2.370 -37.364 -37.364
 1002   1HA   GLY 124           HAR      GLY 124  -0.984 -38.869 -38.869
 1003   2HA   GLY 124           HAS      GLY 124  -0.291 -39.488 -39.488
 1004    H    ASN 125           HN       ASN 125  -2.354 -40.199 -40.199
 1005    HA   ASN 125           HA       ASN 125  -2.989 -42.655 -42.655
 1006   1HB   ASN 125           HBS      ASN 125  -4.893 -40.678 -40.678
 1007   2HB   ASN 125           HBR      ASN 125  -5.677 -41.884 -41.884
 1008   1HD2  ASN 125           HD2      ASN 125  -4.379 -44.570 -44.570
 1009   2HD2  ASN 125           HD2      ASN 125  -3.994 -44.106 -44.106
 1010    H    ASN 126           HN       ASN 126  -2.881 -43.907 -43.907
 1011    HA   ASN 126           HA       ASN 126  -3.329 -44.883 -44.883
 1012   1HB   ASN 126           HBS      ASN 126  -5.679 -42.993 -42.993
 1013   2HB   ASN 126           HBR      ASN 126  -5.457 -44.316 -44.316
 1014   1HD2  ASN 126           HD2      ASN 126  -6.970 -46.652 -46.652
 1015   2HD2  ASN 126           HD2      ASN 126  -6.607 -46.065 -46.065
 1016    H    SER 127           HN       SER 127  -2.271 -44.797 -44.797
 1017    HA   SER 127           HA       SER 127  -2.123 -42.606 -42.606
 1018   1HB   SER 127           HBS      SER 127   0.250 -41.960 -41.960
 1019   2HB   SER 127           HBR      SER 127  -0.970 -41.362 -41.362
 1020    HG   SER 127           HG       SER 127  -0.509 -43.394 -43.394
 1021    H    GLN 128           HN       GLN 128  -0.029 -45.096 -45.096
 1022    HA   GLN 128           HA       GLN 128   1.377 -45.518 -45.518
 1023   1HB   GLN 128           HBR      GLN 128   2.027 -45.938 -45.938
 1024   2HB   GLN 128           HBS      GLN 128   1.542 -47.599 -47.599
 1025   1HG   GLN 128           HGS      GLN 128   3.420 -47.933 -47.933
 1026   2HG   GLN 128           HGR      GLN 128   3.241 -46.391 -46.391
 1027   1HE2  GLN 128           HE2      GLN 128   5.292 -46.441 -46.441
 1028   2HE2  GLN 128           HE2      GLN 128   3.980 -47.536 -47.536
 1029    H    VAL 129           HN       VAL 129   1.803 -48.114 -48.114
 1030    HA   VAL 129           HA       VAL 129  -0.767 -49.427 -49.427
 1031    HB   VAL 129           HB       VAL 129  -0.637 -47.802 -47.802
 1032   1HG1  VAL 129           HMG      VAL 129   2.182 -48.759 -48.759
 1033   2HG1  VAL 129           HMG      VAL 129   1.287 -48.141 -48.141
 1034   3HG1  VAL 129           HMG      VAL 129   1.528 -47.104 -47.104
 1035   1HG2  VAL 129           HMG      VAL 129  -0.233 -50.678 -50.678
 1036   2HG2  VAL 129           HMG      VAL 129  -1.670 -49.643 -49.643
 1037   3HG2  VAL 129           HMG      VAL 129  -0.313 -49.478 -49.478
 1038    H    SER 130           HN       SER 130  -0.559 -51.551 -51.551
 1039    HA   SER 130           HA       SER 130   2.018 -52.744 -52.744
 1040   1HB   SER 130           HBS      SER 130  -0.758 -53.925 -53.925
 1041   2HB   SER 130           HBR      SER 130   0.766 -54.569 -54.569
 1042    HG   SER 130           HG       SER 130   0.858 -53.157 -53.157
 1043    H    GLN 131           HN       GLN 131  -0.816 -53.270 -53.270
 1044    HA   GLN 131           HA       GLN 131  -0.986 -54.110 -54.110
 1045   1HB   GLN 131           HBR      GLN 131   0.844 -52.602 -52.602
 1046   2HB   GLN 131           HBS      GLN 131   2.030 -53.844 -53.844
 1047   1HG   GLN 131           HGS      GLN 131   1.558 -55.202 -55.202
 1048   2HG   GLN 131           HGR      GLN 131  -0.003 -54.392 -54.392
 1049   1HE2  GLN 131           HE2      GLN 131   2.729 -53.430 -53.430
 1050   2HE2  GLN 131           HE2      GLN 131   2.268 -54.960 -54.960
 1051    H    ASN 132           HN       ASN 132   2.175 -55.580 -55.580
 1052    HA   ASN 132           HA       ASN 132   0.846 -58.217 -58.217
 1053   1HB   ASN 132           HBS      ASN 132   3.310 -57.106 -57.106
 1054   2HB   ASN 132           HBR      ASN 132   3.094 -58.866 -58.866
 1055   1HD2  ASN 132           HD2      ASN 132   0.176 -58.992 -58.992
 1056   2HD2  ASN 132           HD2      ASN 132   0.685 -59.544 -59.544
 1057    H    TYR 133           HN       TYR 133   0.739 -59.043 -59.043
 1058    HA   TYR 133           HA       TYR 133   2.489 -58.638 -58.638
 1059   1HB   TYR 133           HBS      TYR 133   1.471 -60.510 -60.510
 1060   2HB   TYR 133           HBR      TYR 133   0.218 -59.657 -59.657
 1061    HD1  TYR 133           HD1      TYR 133   0.671 -60.780 -60.780
 1062    HD2  TYR 133           HD2      TYR 133   0.657 -62.699 -62.699
 1063    HE1  TYR 133           HE1      TYR 133   0.091 -62.908 -62.908
 1064    HE2  TYR 133           HE2      TYR 133   0.103 -64.835 -64.835
 1065    HH   TYR 133           HH       TYR 133  -0.997 -65.615 -65.615

  Start of MODEL   10
    1   1H    HIS   1           HN       HIS   1  -5.114  17.511  17.511
    2   2H    HIS   1           HNB      HIS   1  -6.086  16.747  16.747
    3   3H    HIS   1           HNC      HIS   1  -6.289  18.341  18.341
    4    HA   HIS   1           HA       HIS   1  -4.352  18.967  18.967
    5   1HB   HIS   1           HBR      HIS   1  -4.508  17.697  17.697
    6   2HB   HIS   1           HBS      HIS   1  -5.883  18.709  18.709
    7    HD1  HIS   1           HD1      HIS   1  -4.877  15.054  15.054
    8    HD2  HIS   1           HD2      HIS   1  -8.228  17.368  17.368
    9    HE1  HIS   1           HE1      HIS   1  -6.861  13.540  13.540
   10    HE2  HIS   1           HE2      HIS   1  -8.894  14.941  14.941
   11    H    MET   2           HN       MET   2  -2.353  18.578  18.578
   12    HA   MET   2           HA       MET   2  -0.339  17.574  17.574
   13   1HB   MET   2           HBS      MET   2   0.513  16.428  16.428
   14   2HB   MET   2           HBR      MET   2  -0.546  17.761  17.761
   15   1HG   MET   2           HGS      MET   2  -2.320  16.215  16.215
   16   2HG   MET   2           HGR      MET   2  -1.466  14.870  14.870
   17   1HE   MET   2           HME      MET   2  -2.684  15.449  15.449
   18   2HE   MET   2           HME      MET   2  -1.869  13.889  13.889
   19   3HE   MET   2           HME      MET   2  -1.548  15.266  15.266
   20    H    GLY   3           HN       GLY   3  -2.477  16.361  16.361
   21   1HA   GLY   3           HAR      GLY   3  -1.902  13.469  13.469
   22   2HA   GLY   3           HAS      GLY   3  -2.953  14.393  14.393
   23    H    ALA   4           HN       ALA   4  -2.174  14.381  14.381
   24    HA   ALA   4           HA       ALA   4   0.152  15.854  15.854
   25   1HB   ALA   4           HMB      ALA   4   0.627  13.026  13.026
   26   2HB   ALA   4           HMB      ALA   4   0.910  13.538  13.538
   27   3HB   ALA   4           HMB      ALA   4   1.770  14.348  14.348
   28    H    ARG   5           HN       ARG   5  -0.778  13.057  13.057
   29    HA   ARG   5           HA       ARG   5  -1.975  12.838  12.838
   30   1HB   ARG   5           HBR      ARG   5  -3.229  15.548  15.548
   31   2HB   ARG   5           HBS      ARG   5  -3.868  14.094  14.094
   32   1HG   ARG   5           HGS      ARG   5  -3.659  13.169  13.169
   33   2HG   ARG   5           HGR      ARG   5  -3.979  14.898  14.898
   34   1HD   ARG   5           HDS      ARG   5  -5.697  13.989  13.989
   35   2HD   ARG   5           HDR      ARG   5  -5.797  12.855  12.855
   36    HE   ARG   5           HE       ARG   5  -6.724  15.610  15.610
   37   1HH1  ARG   5           HH1      ARG   5  -5.983  12.789  12.789
   38   2HH1  ARG   5           HH1      ARG   5  -6.736  13.447  13.447
   39   1HH2  ARG   5           HH2      ARG   5  -7.586  16.491  16.491
   40   2HH2  ARG   5           HH2      ARG   5  -7.645  15.542  15.542
   41    H    ALA   6           HN       ALA   6  -1.401  16.361  16.361
   42    HA   ALA   6           HA       ALA   6  -0.437  17.898  17.898
   43   1HB   ALA   6           HMB      ALA   6   1.157  15.494  15.494
   44   2HB   ALA   6           HMB      ALA   6   1.046  16.598  16.598
   45   3HB   ALA   6           HMB      ALA   6   1.648  17.198  17.198
   46    H    SER   7           HN       SER   7  -0.378  15.369  15.369
   47    HA   SER   7           HA       SER   7  -3.002  16.285  16.285
   48   1HB   SER   7           HBS      SER   7  -1.105  17.541  17.541
   49   2HB   SER   7           HBR      SER   7  -0.422  15.997  15.997
   50    HG   SER   7           HG       SER   7  -1.968  15.675  15.675
   51    H    VAL   8           HN       VAL   8  -0.852  14.277  14.277
   52    HA   VAL   8           HA       VAL   8  -2.145  11.797  11.797
   53    HB   VAL   8           HB       VAL   8  -0.209  12.425  12.425
   54   1HG1  VAL   8           HMG      VAL   8  -1.389   9.806   9.806
   55   2HG1  VAL   8           HMG      VAL   8  -0.982  10.081  10.081
   56   3HG1  VAL   8           HMG      VAL   8   0.282  10.204  10.204
   57   1HG2  VAL   8           HMG      VAL   8  -3.188  11.913  11.913
   58   2HG2  VAL   8           HMG      VAL   8  -2.313  13.373  13.373
   59   3HG2  VAL   8           HMG      VAL   8  -2.174  11.870  11.870
   60    H    LEU   9           HN       LEU   9   1.126  13.074  13.074
   61    HA   LEU   9           HA       LEU   9   2.230  10.742  10.742
   62   1HB   LEU   9           HBR      LEU   9   3.247  12.949  12.949
   63   2HB   LEU   9           HBS      LEU   9   4.361  11.797  11.797
   64    HG   LEU   9           HG       LEU   9   2.134  11.055  11.055
   65   1HD1  LEU   9           HMD      LEU   9   5.125  11.386  11.386
   66   2HD1  LEU   9           HMD      LEU   9   4.116  10.428  10.428
   67   3HD1  LEU   9           HMD      LEU   9   3.815  12.173  12.173
   68   1HD2  LEU   9           HMD      LEU   9   3.969   9.603   9.603
   69   2HD2  LEU   9           HMD      LEU   9   2.407   9.107   9.107
   70   3HD2  LEU   9           HMD      LEU   9   3.897   8.977   8.977
   71    H    SER  10           HN       SER  10   4.668  11.554  11.554
   72    HA   SER  10           HA       SER  10   4.157  13.650  13.650
   73   1HB   SER  10           HBS      SER  10   5.652  12.679  12.679
   74   2HB   SER  10           HBR      SER  10   4.699  11.299  11.299
   75    HG   SER  10           HG       SER  10   7.148  11.224  11.224
   76    H    GLY  11           HN       GLY  11   6.601  14.388  14.388
   77   1HA   GLY  11           HAR      GLY  11   7.735  15.877  15.877
   78   2HA   GLY  11           HAS      GLY  11   8.522  15.519  15.519
   79    H    GLY  12           HN       GLY  12   9.548  13.407  13.407
   80   1HA   GLY  12           HAR      GLY  12  11.477  13.078  13.078
   81   2HA   GLY  12           HAS      GLY  12  11.216  11.959  11.959
   82    H    GLU  13           HN       GLU  13   8.412  11.443  11.443
   83    HA   GLU  13           HA       GLU  13   8.748   9.239   9.239
   84   1HB   GLU  13           HBR      GLU  13   6.404  10.906  10.906
   85   2HB   GLU  13           HBS      GLU  13   6.212   9.658   9.658
   86   1HG   GLU  13           HGS      GLU  13   6.795   7.999   7.999
   87   2HG   GLU  13           HGR      GLU  13   7.260   9.139   9.139
   88    H    LEU  14           HN       LEU  14   7.739  12.580  12.580
   89    HA   LEU  14           HA       LEU  14   7.120  12.276  12.276
   90   1HB   LEU  14           HBR      LEU  14   6.818  14.193  14.193
   91   2HB   LEU  14           HBS      LEU  14   8.299  14.788  14.788
   92    HG   LEU  14           HG       LEU  14   6.455  15.910  15.910
   93   1HD1  LEU  14           HMD      LEU  14   8.207  14.320  14.320
   94   2HD1  LEU  14           HMD      LEU  14   6.610  13.948  13.948
   95   3HD1  LEU  14           HMD      LEU  14   7.185  15.634  15.634
   96   1HD2  LEU  14           HMD      LEU  14   4.954  13.862  13.862
   97   2HD2  LEU  14           HMD      LEU  14   4.436  14.955  14.955
   98   3HD2  LEU  14           HMD      LEU  14   5.156  13.372  13.372
   99    H    ASP  15           HN       ASP  15  10.037  13.482  13.482
  100    HA   ASP  15           HA       ASP  15  11.524  13.839  13.839
  101   1HB   ASP  15           HBR      ASP  15  12.382  13.561  13.561
  102   2HB   ASP  15           HBS      ASP  15  13.514  13.904  13.904
  103    H    LYS  16           HN       LYS  16  10.698  10.968  10.968
  104    HA   LYS  16           HA       LYS  16  12.720   9.432   9.432
  105   1HB   LYS  16           HBR      LYS  16  11.664   9.081   9.081
  106   2HB   LYS  16           HBS      LYS  16  10.599   8.021   8.021
  107   1HG   LYS  16           HGR      LYS  16  13.641   7.890   7.890
  108   2HG   LYS  16           HGS      LYS  16  12.555   6.824   6.824
  109   1HD   LYS  16           HDS      LYS  16  12.356   5.456   5.456
  110   2HD   LYS  16           HDR      LYS  16  11.648   6.733   6.733
  111   1HE   LYS  16           HES      LYS  16  14.542   5.935   5.935
  112   2HE   LYS  16           HER      LYS  16  13.430   5.931   5.931
  113   1HZ   LYS  16           HZB      LYS  16  13.367   8.329   8.329
  114   2HZ   LYS  16           HZC      LYS  16  14.424   8.314   8.314
  115   3HZ   LYS  16           HZA      LYS  16  14.894   7.803   7.803
  116    H    TRP  17           HN       TRP  17   9.328  10.273  10.273
  117    HA   TRP  17           HA       TRP  17   8.576   8.333   8.333
  118   1HB   TRP  17           HBS      TRP  17   6.943   9.308   9.308
  119   2HB   TRP  17           HBR      TRP  17   7.275  10.939  10.939
  120    HD1  TRP  17           HD1      TRP  17   6.580  11.247  11.247
  121    HE1  TRP  17           HE1      TRP  17   4.892  10.010  10.010
  122    HE3  TRP  17           HE3      TRP  17   5.485   7.395   7.395
  123    HZ2  TRP  17           HZ2      TRP  17   3.154   7.821   7.821
  124    HZ3  TRP  17           HZ3      TRP  17   3.764   5.785   5.785
  125    HH2  TRP  17           HH2      TRP  17   2.611   5.988   5.988
  126    H    GLU  18           HN       GLU  18  10.422  11.183  11.183
  127    HA   GLU  18           HA       GLU  18   9.486  12.499  12.499
  128   1HB   GLU  18           HBR      GLU  18  11.653  12.547  12.547
  129   2HB   GLU  18           HBS      GLU  18  12.399  12.149  12.149
  130   1HG   GLU  18           HGS      GLU  18  11.789  14.074  14.074
  131   2HG   GLU  18           HGR      GLU  18  10.854  14.669  14.669
  132    H    LYS  19           HN       LYS  19  10.965   9.401   9.401
  133    HA   LYS  19           HA       LYS  19  10.888   9.241   9.241
  134   1HB   LYS  19           HBR      LYS  19  13.613   9.829   9.829
  135   2HB   LYS  19           HBS      LYS  19  13.440   8.717   8.717
  136   1HG   LYS  19           HGS      LYS  19  13.576  10.554  10.554
  137   2HG   LYS  19           HGR      LYS  19  11.897  10.885  10.885
  138   1HD   LYS  19           HDS      LYS  19  12.573  12.760  12.760
  139   2HD   LYS  19           HDR      LYS  19  13.583  11.832  11.832
  140   1HE   LYS  19           HES      LYS  19  15.495  12.223  12.223
  141   2HE   LYS  19           HER      LYS  19  14.637  12.346  12.346
  142   1HZ   LYS  19           HZB      LYS  19  13.853  14.401  14.401
  143   2HZ   LYS  19           HZC      LYS  19  15.479  14.406  14.406
  144   3HZ   LYS  19           HZA      LYS  19  14.527  14.510  14.510
  145    H    ILE  20           HN       ILE  20   9.640   7.618   7.618
  146    HA   ILE  20           HA       ILE  20  11.262   5.323   5.323
  147    HB   ILE  20           HB       ILE  20   8.334   6.063   6.063
  148   1HG1  ILE  20           HG1      ILE  20  10.286   4.828   4.828
  149   2HG1  ILE  20           HG1      ILE  20  10.026   6.582   6.582
  150   1HG2  ILE  20           HMG      ILE  20   9.333   3.212   3.212
  151   2HG2  ILE  20           HMG      ILE  20   7.823   3.783   3.783
  152   3HG2  ILE  20           HMG      ILE  20   8.025   3.885   3.885
  153   1HD1  ILE  20           HMD      ILE  20   7.481   5.766   5.766
  154   2HD1  ILE  20           HMD      ILE  20   8.363   4.562   4.562
  155   3HD1  ILE  20           HMD      ILE  20   8.575   6.302   6.302
  156    H    ARG  21           HN       ARG  21  12.210   4.325   4.325
  157    HA   ARG  21           HA       ARG  21  11.619   4.781   4.781
  158   1HB   ARG  21           HBR      ARG  21  13.145   2.454   2.454
  159   2HB   ARG  21           HBS      ARG  21  13.133   2.884   2.884
  160   1HG   ARG  21           HGS      ARG  21  14.491   4.696   4.696
  161   2HG   ARG  21           HGR      ARG  21  13.905   5.009   5.009
  162   1HD   ARG  21           HDR      ARG  21  16.056   4.267   4.267
  163   2HD   ARG  21           HDS      ARG  21  15.076   2.793   2.793
  164    HE   ARG  21           HE       ARG  21  15.958   1.900   1.900
  165   1HH1  ARG  21           HH1      ARG  21  17.253   5.112   5.112
  166   2HH1  ARG  21           HH1      ARG  21  18.395   5.037   5.037
  167   1HH2  ARG  21           HH2      ARG  21  17.374   1.892   1.892
  168   2HH2  ARG  21           HH2      ARG  21  18.465   3.215   3.215
  169    H    LEU  22           HN       LEU  22  10.507   3.818   3.818
  170    HA   LEU  22           HA       LEU  22   8.210   2.206   2.206
  171   1HB   LEU  22           HBR      LEU  22   9.362   2.868   2.868
  172   2HB   LEU  22           HBS      LEU  22   7.698   2.341   2.341
  173    HG   LEU  22           HG       LEU  22   8.872   4.951   4.951
  174   1HD1  LEU  22           HMD      LEU  22   8.655   4.503   4.503
  175   2HD1  LEU  22           HMD      LEU  22   6.930   4.798   4.798
  176   3HD1  LEU  22           HMD      LEU  22   8.139   6.045   6.045
  177   1HD2  LEU  22           HMD      LEU  22   6.723   3.580   3.580
  178   2HD2  LEU  22           HMD      LEU  22   6.786   5.360   5.360
  179   3HD2  LEU  22           HMD      LEU  22   5.980   4.457   4.457
  180    H    ARG  23           HN       ARG  23  11.379   1.670   1.670
  181    HA   ARG  23           HA       ARG  23  11.420  -1.179  -1.179
  182   1HB   ARG  23           HBR      ARG  23  11.363  -1.425  -1.425
  183   2HB   ARG  23           HBS      ARG  23   9.905  -1.629  -1.629
  184   1HG   ARG  23           HGS      ARG  23   9.263   0.708   0.708
  185   2HG   ARG  23           HGR      ARG  23  10.689   0.851   0.851
  186   1HD   ARG  23           HDS      ARG  23   8.252  -0.880  -0.880
  187   2HD   ARG  23           HDR      ARG  23   8.886   0.379   0.379
  188    HE   ARG  23           HE       ARG  23  10.482  -1.144  -1.144
  189   1HH1  ARG  23           HH1      ARG  23   8.364  -2.605  -2.605
  190   2HH1  ARG  23           HH1      ARG  23   8.994  -4.198  -4.198
  191   1HH2  ARG  23           HH2      ARG  23  11.371  -3.218  -3.218
  192   2HH2  ARG  23           HH2      ARG  23  10.695  -4.546  -4.546
  193    HA   PRO  24           HA       PRO  24  15.570   0.354   0.354
  194   1HB   PRO  24           HBR      PRO  24  16.301  -2.238  -2.238
  195   2HB   PRO  24           HBS      PRO  24  16.713  -0.808  -0.808
  196   1HG   PRO  24           HGS      PRO  24  15.005  -2.551  -2.551
  197   2HG   PRO  24           HGR      PRO  24  15.121  -0.951  -0.951
  198   1HD   PRO  24           HDS      PRO  24  13.111  -2.178  -2.178
  199   2HD   PRO  24           HDR      PRO  24  13.082  -0.698  -0.698
  200    H    GLY  25           HN       GLY  25  15.398   0.705   0.705
  201   1HA   GLY  25           HAS      GLY  25  16.593   0.058   0.058
  202   2HA   GLY  25           HAR      GLY  25  16.212  -1.647  -1.647
  203    H    GLY  26           HN       GLY  26  13.683   0.612   0.612
  204   1HA   GLY  26           HAS      GLY  26  12.218  -0.315  -0.315
  205   2HA   GLY  26           HAR      GLY  26  11.537   0.487   0.487
  206    H    LYS  27           HN       LYS  27  11.555   2.728   2.728
  207    HA   LYS  27           HA       LYS  27  12.196   4.248   4.248
  208   1HB   LYS  27           HBS      LYS  27   9.460   4.026   4.026
  209   2HB   LYS  27           HBR      LYS  27   9.911   5.169   5.169
  210   1HG   LYS  27           HGS      LYS  27  10.646   2.844   2.844
  211   2HG   LYS  27           HGR      LYS  27   9.325   2.249   2.249
  212   1HD   LYS  27           HDR      LYS  27   8.718   4.718   4.718
  213   2HD   LYS  27           HDS      LYS  27   9.123   3.406   3.406
  214   1HE   LYS  27           HES      LYS  27   7.335   2.459   2.459
  215   2HE   LYS  27           HER      LYS  27   6.688   3.942   3.942
  216   1HZ   LYS  27           HZC      LYS  27   7.326   2.724   2.724
  217   2HZ   LYS  27           HZA      LYS  27   7.280   1.371   1.371
  218   3HZ   LYS  27           HZB      LYS  27   5.948   2.305   2.305
  219    H    LYS  28           HN       LYS  28  10.527   4.490   4.490
  220    HA   LYS  28           HA       LYS  28  11.964   6.992   6.992
  221   1HB   LYS  28           HBR      LYS  28   9.208   6.820   6.820
  222   2HB   LYS  28           HBS      LYS  28   9.388   7.760   7.760
  223   1HG   LYS  28           HGS      LYS  28  11.299   8.994   8.994
  224   2HG   LYS  28           HGR      LYS  28  10.664   8.253   8.253
  225   1HD   LYS  28           HDR      LYS  28   8.832   9.715   9.715
  226   2HD   LYS  28           HDS      LYS  28   9.931  10.657  10.657
  227   1HE   LYS  28           HES      LYS  28   8.483  10.522  10.522
  228   2HE   LYS  28           HER      LYS  28   8.771   8.760   8.760
  229   1HZ   LYS  28           HZB      LYS  28   6.855   9.976   9.976
  230   2HZ   LYS  28           HZC      LYS  28   6.428   9.523   9.523
  231   3HZ   LYS  28           HZA      LYS  28   6.976   8.410   8.410
  232    H    GLN  29           HN       GLN  29  10.367   7.933   7.933
  233    HA   GLN  29           HA       GLN  29  10.311   5.695   5.695
  234   1HB   GLN  29           HBS      GLN  29  11.229   8.405   8.405
  235   2HB   GLN  29           HBR      GLN  29  11.637   6.786   6.786
  236   1HG   GLN  29           HGS      GLN  29  12.680   6.703   6.703
  237   2HG   GLN  29           HGR      GLN  29  12.945   8.406   8.406
  238   1HE2  GLN  29           HE2      GLN  29  15.833   6.206   6.206
  239   2HE2  GLN  29           HE2      GLN  29  14.944   6.441   6.441
  240    H    TYR  30           HN       TYR  30   9.181   6.191   6.191
  241    HA   TYR  30           HA       TYR  30   6.637   7.485   7.485
  242   1HB   TYR  30           HBS      TYR  30   8.300   6.550   6.550
  243   2HB   TYR  30           HBR      TYR  30   6.806   7.496   7.496
  244    HD1  TYR  30           HD2      TYR  30   7.206   4.974   4.974
  245    HD2  TYR  30           HD1      TYR  30   5.546   5.783   5.783
  246    HE1  TYR  30           HE2      TYR  30   6.148   2.760   2.760
  247    HE2  TYR  30           HE1      TYR  30   4.597   3.516   3.516
  248    HH   TYR  30           HH       TYR  30   5.468   1.053   1.053
  249    H    LYS  31           HN       LYS  31   6.161   9.512   9.512
  250    HA   LYS  31           HA       LYS  31   7.858  11.457  11.457
  251   1HB   LYS  31           HBS      LYS  31   6.972  11.595  11.595
  252   2HB   LYS  31           HBR      LYS  31   5.820  12.618  12.618
  253   1HG   LYS  31           HGR      LYS  31   7.697  13.912  13.912
  254   2HG   LYS  31           HGS      LYS  31   8.853  12.883  12.883
  255   1HD   LYS  31           HDS      LYS  31   6.763  14.683  14.683
  256   2HD   LYS  31           HDR      LYS  31   8.457  15.049  15.049
  257   1HE   LYS  31           HER      LYS  31   8.827  14.161  14.161
  258   2HE   LYS  31           HES      LYS  31   8.425  12.564  12.564
  259   1HZ   LYS  31           HZA      LYS  31   6.053  13.268  13.268
  260   2HZ   LYS  31           HZB      LYS  31   6.699  14.394  14.394
  261   3HZ   LYS  31           HZC      LYS  31   6.984  12.809  12.809
  262    H    LEU  32           HN       LEU  32   6.395  13.420  13.420
  263    HA   LEU  32           HA       LEU  32   4.086  12.314  12.314
  264   1HB   LEU  32           HBS      LEU  32   6.044  13.306  13.306
  265   2HB   LEU  32           HBR      LEU  32   5.640  14.881  14.881
  266    HG   LEU  32           HG       LEU  32   3.318  14.484  14.484
  267   1HD1  LEU  32           HMD      LEU  32   3.903  12.195  12.195
  268   2HD1  LEU  32           HMD      LEU  32   5.186  12.896  12.896
  269   3HD1  LEU  32           HMD      LEU  32   3.479  13.297  13.297
  270   1HD2  LEU  32           HMD      LEU  32   5.932  15.521  15.521
  271   2HD2  LEU  32           HMD      LEU  32   4.382  16.362  16.362
  272   3HD2  LEU  32           HMD      LEU  32   4.630  15.377  15.377
  273    H    LYS  33           HN       LYS  33   4.789  14.232  14.232
  274    HA   LYS  33           HA       LYS  33   2.082  15.387  15.387
  275   1HB   LYS  33           HBS      LYS  33   4.200  16.106  16.106
  276   2HB   LYS  33           HBR      LYS  33   3.912  14.606  14.606
  277   1HG   LYS  33           HGS      LYS  33   2.158  15.486  15.486
  278   2HG   LYS  33           HGR      LYS  33   1.520  16.312  16.312
  279   1HD   LYS  33           HDR      LYS  33   2.064  18.018  18.018
  280   2HD   LYS  33           HDS      LYS  33   3.387  17.994  17.994
  281   1HE   LYS  33           HES      LYS  33   4.475  18.218  18.218
  282   2HE   LYS  33           HER      LYS  33   4.526  16.451  16.451
  283   1HZ   LYS  33           HZC      LYS  33   2.512  17.852  17.852
  284   2HZ   LYS  33           HZA      LYS  33   3.813  17.068  17.068
  285   3HZ   LYS  33           HZB      LYS  33   2.650  16.234  16.234
  286    H    HIS  34           HN       DHI  34   3.798  12.419  12.419
  287    HA   HIS  34           HA       DHI  34   1.838  11.134  11.134
  288   1HB   HIS  34           HBS      DHI  34   4.128  10.968  10.968
  289   2HB   HIS  34           HBR      DHI  34   4.667  10.504  10.504
  290    HD2  HIS  34           HD2      DHI  34   1.690   8.505   8.505
  291    HE1  HIS  34           HE1      DHI  34   5.067   5.989   5.989
  292    HE2  HIS  34           HE2      DHI  34   2.580   6.094   6.094
  293    H    ILE  35           HN       ILE  35   2.850  11.210  11.210
  294    HA   ILE  35           HA       ILE  35   1.128   9.030   9.030
  295    HB   ILE  35           HB       ILE  35   2.978  10.292  10.292
  296   1HG1  ILE  35           HG1      ILE  35   0.254   9.731   9.731
  297   2HG1  ILE  35           HG1      ILE  35   1.459   8.496   8.496
  298   1HG2  ILE  35           HMG      ILE  35   0.700  12.248  12.248
  299   2HG2  ILE  35           HMG      ILE  35   1.872  12.026  12.026
  300   3HG2  ILE  35           HMG      ILE  35   2.435  12.551  12.551
  301   1HD1  ILE  35           HMD      ILE  35   2.733  10.421  10.421
  302   2HD1  ILE  35           HMD      ILE  35   1.216   9.892   9.892
  303   3HD1  ILE  35           HMD      ILE  35   2.439   8.687   8.687
  304    H    VAL  36           HN       VAL  36   0.876  12.565  12.565
  305    HA   VAL  36           HA       VAL  36  -1.779  12.729  12.729
  306    HB   VAL  36           HB       VAL  36  -0.158  14.546  14.546
  307   1HG1  VAL  36           HMG      VAL  36  -2.965  14.825  14.825
  308   2HG1  VAL  36           HMG      VAL  36  -1.920  16.265  16.265
  309   3HG1  VAL  36           HMG      VAL  36  -2.184  15.414  15.414
  310   1HG2  VAL  36           HMG      VAL  36   0.169  13.979  13.979
  311   2HG2  VAL  36           HMG      VAL  36   0.718  15.454  15.454
  312   3HG2  VAL  36           HMG      VAL  36  -0.835  15.450  15.450
  313    H    TRP  37           HN       TRP  37  -0.388  11.976  11.976
  314    HA   TRP  37           HA       TRP  37  -2.784  11.627  11.627
  315   1HB   TRP  37           HBR      TRP  37  -0.711  11.529  11.529
  316   2HB   TRP  37           HBS      TRP  37  -0.118  10.213  10.213
  317    HD1  TRP  37           HD1      TRP  37  -2.550  10.820  10.820
  318    HE1  TRP  37           HE1      TRP  37  -3.288   8.565   8.565
  319    HE3  TRP  37           HE3      TRP  37  -0.278   7.758   7.758
  320    HZ2  TRP  37           HZ2      TRP  37  -3.018   5.851   5.851
  321    HZ3  TRP  37           HZ3      TRP  37  -0.462   5.333   5.333
  322    HH2  TRP  37           HH2      TRP  37  -1.769   4.387   4.387
  323    H    ALA  38           HN       ALA  38  -1.065   9.484   9.484
  324    HA   ALA  38           HA       ALA  38  -2.601   7.107   7.107
  325   1HB   ALA  38           HMB      ALA  38  -0.268   7.430   7.430
  326   2HB   ALA  38           HMB      ALA  38  -1.234   7.701   7.701
  327   3HB   ALA  38           HMB      ALA  38  -1.364   6.156   6.156
  328    H    SER  39           HN       SER  39  -2.392   9.130   9.130
  329    HA   SER  39           HA       SER  39  -4.540   7.926   7.926
  330   1HB   SER  39           HBS      SER  39  -2.869   9.204   9.204
  331   2HB   SER  39           HBR      SER  39  -3.371  10.701  10.701
  332    HG   SER  39           HG       SER  39  -4.087  10.126  10.126
  333    H    ARG  40           HN       ARG  40  -4.463  10.596  10.596
  334    HA   ARG  40           HA       ARG  40  -7.172  11.471  11.471
  335   1HB   ARG  40           HBR      ARG  40  -5.157  11.609  11.609
  336   2HB   ARG  40           HBS      ARG  40  -6.864  12.060  12.060
  337   1HG   ARG  40           HGR      ARG  40  -6.748  13.865  13.865
  338   2HG   ARG  40           HGS      ARG  40  -5.215  13.284  13.284
  339   1HD   ARG  40           HDR      ARG  40  -4.097  14.532  14.532
  340   2HD   ARG  40           HDS      ARG  40  -4.798  13.599  13.599
  341    HE   ARG  40           HE       ARG  40  -5.862  16.146  16.146
  342   1HH1  ARG  40           HH1      ARG  40  -6.076  13.561  13.561
  343   2HH1  ARG  40           HH1      ARG  40  -6.912  14.546  14.546
  344   1HH2  ARG  40           HH2      ARG  40  -6.842  17.440  17.440
  345   2HH2  ARG  40           HH2      ARG  40  -7.347  16.741  16.741
  346    H    GLU  41           HN       GLU  41  -5.636   9.154   9.154
  347    HA   GLU  41           HA       GLU  41  -7.991   8.473   8.473
  348   1HB   GLU  41           HBR      GLU  41  -5.351   8.034   8.034
  349   2HB   GLU  41           HBS      GLU  41  -5.764   6.612   6.612
  350   1HG   GLU  41           HGS      GLU  41  -6.015   7.309   7.309
  351   2HG   GLU  41           HGR      GLU  41  -5.827   5.702   5.702
  352    H    LEU  42           HN       LEU  42  -6.657   7.365   7.365
  353    HA   LEU  42           HA       LEU  42  -8.191   4.921   4.921
  354   1HB   LEU  42           HBR      LEU  42  -6.176   5.259   5.259
  355   2HB   LEU  42           HBS      LEU  42  -6.810   6.790   6.790
  356    HG   LEU  42           HG       LEU  42  -8.717   4.923   4.923
  357   1HD1  LEU  42           HMD      LEU  42  -6.546   3.390   3.390
  358   2HD1  LEU  42           HMD      LEU  42  -6.247   3.686   3.686
  359   3HD1  LEU  42           HMD      LEU  42  -7.775   2.935   2.935
  360   1HD2  LEU  42           HMD      LEU  42  -6.675   6.580   6.580
  361   2HD2  LEU  42           HMD      LEU  42  -8.402   6.359   6.359
  362   3HD2  LEU  42           HMD      LEU  42  -7.208   5.184   5.184
  363    H    GLU  43           HN       GLU  43  -8.409   8.080   8.080
  364    HA   GLU  43           HA       GLU  43 -10.698   7.553   7.553
  365   1HB   GLU  43           HBR      GLU  43 -10.329  10.305  10.305
  366   2HB   GLU  43           HBS      GLU  43 -10.751   9.736   9.736
  367   1HG   GLU  43           HGR      GLU  43  -8.813  10.034  10.034
  368   2HG   GLU  43           HGS      GLU  43  -8.112   8.983   8.983
  369    H    ARG  44           HN       ARG  44 -10.292   8.531   8.531
  370    HA   ARG  44           HA       ARG  44 -13.178   9.036   9.036
  371   1HB   ARG  44           HBS      ARG  44 -10.807  10.113  10.113
  372   2HB   ARG  44           HBR      ARG  44 -11.676   9.271   9.271
  373   1HG   ARG  44           HGR      ARG  44 -13.751  10.568  10.568
  374   2HG   ARG  44           HGS      ARG  44 -12.595  11.588  11.588
  375   1HD   ARG  44           HDS      ARG  44 -11.999  12.674  12.674
  376   2HD   ARG  44           HDR      ARG  44 -11.736  11.154  11.154
  377    HE   ARG  44           HE       ARG  44 -14.116  12.840  12.840
  378   1HH1  ARG  44           HH1      ARG  44 -12.970   9.535   9.535
  379   2HH1  ARG  44           HH1      ARG  44 -14.142   9.173   9.173
  380   1HH2  ARG  44           HH2      ARG  44 -15.545  12.373  12.373
  381   2HH2  ARG  44           HH2      ARG  44 -15.602  10.777  10.777
  382    H    PHE  45           HN       PHE  45 -10.996   6.467   6.467
  383    HA   PHE  45           HA       PHE  45 -12.456   4.858   4.858
  384   1HB   PHE  45           HBS      PHE  45 -10.358   4.374   4.374
  385   2HB   PHE  45           HBR      PHE  45 -11.601   3.096   3.096
  386    HD1  PHE  45           HD2      PHE  45 -12.235   3.219   3.219
  387    HD2  PHE  45           HD1      PHE  45  -8.563   3.325   3.325
  388    HE1  PHE  45           HE2      PHE  45 -11.033   2.437   2.437
  389    HE2  PHE  45           HE1      PHE  45  -7.363   2.471   2.471
  390    HZ   PHE  45           HZ       PHE  45  -8.577   2.129   2.129
  391    H    ALA  46           HN       ALA  46 -12.387   4.853   4.853
  392    HA   ALA  46           HA       ALA  46 -15.307   4.560   4.560
  393   1HB   ALA  46           HMB      ALA  46 -13.315   2.315   2.315
  394   2HB   ALA  46           HMB      ALA  46 -14.765   2.211   2.211
  395   3HB   ALA  46           HMB      ALA  46 -14.937   2.413   2.413
  396    H    VAL  47           HN       VAL  47 -12.748   5.978   5.978
  397    HA   VAL  47           HA       VAL  47 -12.763   4.854   4.854
  398    HB   VAL  47           HB       VAL  47 -10.377   5.801   5.801
  399   1HG1  VAL  47           HMG      VAL  47 -10.659   4.311   4.311
  400   2HG1  VAL  47           HMG      VAL  47  -9.156   4.315   4.315
  401   3HG1  VAL  47           HMG      VAL  47  -9.814   5.844   5.844
  402   1HG2  VAL  47           HMG      VAL  47 -11.545   3.888   3.888
  403   2HG2  VAL  47           HMG      VAL  47  -9.878   3.543   3.543
  404   3HG2  VAL  47           HMG      VAL  47 -11.253   2.937   2.937
  405    H    ASN  48           HN       ASN  48 -11.540   6.232   6.232
  406    HA   ASN  48           HA       ASN  48 -11.835   9.122   9.122
  407   1HB   ASN  48           HBS      ASN  48 -13.472   8.624   8.624
  408   2HB   ASN  48           HBR      ASN  48 -12.264   7.765   7.765
  409   1HD2  ASN  48           HD2      ASN  48 -12.886  11.693  11.693
  410   2HD2  ASN  48           HD2      ASN  48 -13.905  10.658  10.658
  411    HA   PRO  49           HA       PRO  49  -7.624   9.377   9.377
  412   1HB   PRO  49           HBR      PRO  49  -7.535  12.040  12.040
  413   2HB   PRO  49           HBS      PRO  49  -7.339  11.405  11.405
  414   1HG   PRO  49           HGR      PRO  49  -9.447  12.863  12.863
  415   2HG   PRO  49           HGS      PRO  49  -9.310  12.051  12.051
  416   1HD   PRO  49           HDR      PRO  49 -10.811  11.339  11.339
  417   2HD   PRO  49           HDS      PRO  49 -10.915  10.733  10.733
  418    H    GLY  50           HN       GLY  50  -9.033  11.033  11.033
  419   1HA   GLY  50           HAR      GLY  50  -6.764  10.804  10.804
  420   2HA   GLY  50           HAS      GLY  50  -8.460  11.078  11.078
  421    H    LEU  51           HN       LEU  51  -9.305   8.687   8.687
  422    HA   LEU  51           HA       LEU  51  -9.165   6.611   6.611
  423   1HB   LEU  51           HBR      LEU  51 -10.795   7.330   7.330
  424   2HB   LEU  51           HBS      LEU  51  -9.783   6.172   6.172
  425    HG   LEU  51           HG       LEU  51 -11.421   5.586   5.586
  426   1HD1  LEU  51           HMD      LEU  51 -11.944   5.384   5.384
  427   2HD1  LEU  51           HMD      LEU  51 -12.436   3.997   3.997
  428   3HD1  LEU  51           HMD      LEU  51 -13.066   5.624   5.624
  429   1HD2  LEU  51           HMD      LEU  51  -9.290   4.167   4.167
  430   2HD2  LEU  51           HMD      LEU  51  -9.944   3.910   3.910
  431   3HD2  LEU  51           HMD      LEU  51 -10.773   3.206   3.206
  432    H    LEU  52           HN       LEU  52  -7.679   7.119   7.119
  433    HA   LEU  52           HA       LEU  52  -5.869   4.961   4.961
  434   1HB   LEU  52           HBS      LEU  52  -6.122   4.896   4.896
  435   2HB   LEU  52           HBR      LEU  52  -6.964   6.463   6.463
  436    HG   LEU  52           HG       LEU  52  -5.216   6.294   6.294
  437   1HD1  LEU  52           HMD      LEU  52  -4.815   8.343   8.343
  438   2HD1  LEU  52           HMD      LEU  52  -3.975   8.391   8.391
  439   3HD1  LEU  52           HMD      LEU  52  -5.753   8.486   8.486
  440   1HD2  LEU  52           HMD      LEU  52  -3.760   4.921   4.921
  441   2HD2  LEU  52           HMD      LEU  52  -3.038   5.846   5.846
  442   3HD2  LEU  52           HMD      LEU  52  -3.068   6.536   6.536
  443    H    GLU  53           HN       GLU  53  -5.742   8.255   8.255
  444    HA   GLU  53           HA       GLU  53  -2.929   8.591   8.591
  445   1HB   GLU  53           HBS      GLU  53  -3.695  10.532  10.532
  446   2HB   GLU  53           HBR      GLU  53  -5.257  10.000  10.000
  447   1HG   GLU  53           HGR      GLU  53  -4.556  11.678  11.678
  448   2HG   GLU  53           HGS      GLU  53  -4.939  10.119  10.119
  449    H    THR  54           HN       THR  54  -5.175   7.240   7.240
  450    HA   THR  54           HA       THR  54  -3.031   6.528   6.528
  451    HB   THR  54           HB       THR  54  -4.703   5.302   5.302
  452    HG1  THR  54           HG1      THR  54  -6.230   5.867   5.867
  453   1HG2  THR  54           HMG      THR  54  -5.018   8.006   8.006
  454   2HG2  THR  54           HMG      THR  54  -6.656   7.346   7.346
  455   3HG2  THR  54           HMG      THR  54  -5.796   7.052   7.052
  456    H    SER  55           HN       SER  55  -2.157   4.495   4.495
  457    HA   SER  55           HA       SER  55  -1.814   2.695   2.695
  458   1HB   SER  55           HBR      SER  55  -1.672   2.417   2.417
  459   2HB   SER  55           HBS      SER  55  -1.467   1.008   1.008
  460    HG   SER  55           HG       SER  55   0.405   2.505   2.505
  461    H    GLU  56           HN       GLU  56  -4.421   2.903   2.903
  462    HA   GLU  56           HA       GLU  56  -5.292   0.190   0.190
  463   1HB   GLU  56           HBS      GLU  56  -5.641   2.185   2.185
  464   2HB   GLU  56           HBR      GLU  56  -7.004   2.546   2.546
  465   1HG   GLU  56           HGR      GLU  56  -6.831  -0.219  -0.219
  466   2HG   GLU  56           HGS      GLU  56  -6.838   1.126   1.126
  467    H    GLY  57           HN       GLY  57  -6.562   3.268   3.268
  468   1HA   GLY  57           HAR      GLY  57  -8.569   2.071   2.071
  469   2HA   GLY  57           HAS      GLY  57  -7.911   3.725   3.725
  470    H    CYS  58           HN       CYS  58  -5.149   2.976   2.976
  471    HA   CYS  58           HA       CYS  58  -4.833   2.457   2.457
  472   1HB   CYS  58           HBR      CYS  58  -3.222   3.265   3.265
  473   2HB   CYS  58           HBS      CYS  58  -2.619   1.607   1.607
  474    H    ARG  59           HN       ARG  59  -4.996   0.279   0.279
  475    HA   ARG  59           HA       ARG  59  -4.460  -2.064  -2.064
  476   1HB   ARG  59           HBR      ARG  59  -4.008  -1.664  -1.664
  477   2HB   ARG  59           HBS      ARG  59  -5.702  -2.202  -2.202
  478   1HG   ARG  59           HGS      ARG  59  -3.783  -3.863  -3.863
  479   2HG   ARG  59           HGR      ARG  59  -3.713  -3.919  -3.919
  480   1HD   ARG  59           HDR      ARG  59  -6.436  -4.062  -4.062
  481   2HD   ARG  59           HDS      ARG  59  -5.444  -5.302  -5.302
  482    HE   ARG  59           HE       ARG  59  -5.168  -6.388  -6.388
  483   1HH1  ARG  59           HH1      ARG  59  -6.869  -3.336  -3.336
  484   2HH1  ARG  59           HH1      ARG  59  -7.124  -3.616  -3.616
  485   1HH2  ARG  59           HH2      ARG  59  -5.409  -6.659  -6.659
  486   2HH2  ARG  59           HH2      ARG  59  -6.302  -5.497  -5.497
  487    H    GLN  60           HN       GLN  60  -7.203  -0.151  -0.151
  488    HA   GLN  60           HA       GLN  60  -9.194  -2.337  -2.337
  489   1HB   GLN  60           HBR      GLN  60  -9.805  -0.507  -0.507
  490   2HB   GLN  60           HBS      GLN  60  -9.527   0.672   0.672
  491   1HG   GLN  60           HGS      GLN  60 -11.866   0.359   0.359
  492   2HG   GLN  60           HGR      GLN  60 -11.335  -0.493  -0.493
  493   1HE2  GLN  60           HE2      GLN  60 -12.462  -2.670  -2.670
  494   2HE2  GLN  60           HE2      GLN  60 -11.771  -1.092  -1.092
  495    H    ILE  61           HN       ILE  61  -7.532   0.207   0.207
  496    HA   ILE  61           HA       ILE  61  -8.644  -0.495  -0.495
  497    HB   ILE  61           HB       ILE  61  -6.093   1.004   1.004
  498   1HG1  ILE  61           HG1      ILE  61  -7.745   2.385   2.385
  499   2HG1  ILE  61           HG1      ILE  61  -7.439   2.950   2.950
  500   1HG2  ILE  61           HMG      ILE  61  -5.741  -0.105  -0.105
  501   2HG2  ILE  61           HMG      ILE  61  -7.170   0.720   0.720
  502   3HG2  ILE  61           HMG      ILE  61  -5.763   1.674   1.674
  503   1HD1  ILE  61           HMD      ILE  61  -9.643   0.964   0.964
  504   2HD1  ILE  61           HMD      ILE  61  -9.874   2.679   2.679
  505   3HD1  ILE  61           HMD      ILE  61  -9.508   2.219   2.219
  506    H    LEU  62           HN       LEU  62  -5.448  -1.146  -1.146
  507    HA   LEU  62           HA       LEU  62  -4.512  -2.230  -2.230
  508   1HB   LEU  62           HBR      LEU  62  -3.117  -1.217  -1.217
  509   2HB   LEU  62           HBS      LEU  62  -3.446  -2.572  -2.572
  510    HG   LEU  62           HG       LEU  62  -2.173  -4.078  -4.078
  511   1HD1  LEU  62           HMD      LEU  62  -2.809  -2.213  -2.213
  512   2HD1  LEU  62           HMD      LEU  62  -1.034  -2.290  -2.290
  513   3HD1  LEU  62           HMD      LEU  62  -1.974  -3.777  -3.777
  514   1HD2  LEU  62           HMD      LEU  62  -1.166  -1.627  -1.627
  515   2HD2  LEU  62           HMD      LEU  62  -0.418  -3.244  -3.244
  516   3HD2  LEU  62           HMD      LEU  62  -0.146  -2.111  -2.111
  517    H    GLY  63           HN       GLY  63  -6.377  -3.683  -3.683
  518   1HA   GLY  63           HAR      GLY  63  -6.033  -6.378  -6.378
  519   2HA   GLY  63           HAS      GLY  63  -7.005  -5.927  -5.927
  520    H    GLN  64           HN       GLN  64  -8.494  -3.813  -3.813
  521    HA   GLN  64           HA       GLN  64 -10.555  -4.968  -4.968
  522   1HB   GLN  64           HBS      GLN  64  -9.615  -2.192  -2.192
  523   2HB   GLN  64           HBR      GLN  64 -10.710  -2.461  -2.461
  524   1HG   GLN  64           HGS      GLN  64 -11.616  -3.846  -3.846
  525   2HG   GLN  64           HGR      GLN  64 -11.429  -2.090  -2.090
  526   1HE2  GLN  64           HE2      GLN  64 -13.985  -3.306  -3.306
  527   2HE2  GLN  64           HE2      GLN  64 -12.437  -4.054  -4.054
  528    H    LEU  65           HN       LEU  65  -7.349  -4.096  -4.096
  529    HA   LEU  65           HA       LEU  65  -8.194  -3.382  -3.382
  530   1HB   LEU  65           HBR      LEU  65  -7.210  -1.795  -1.795
  531   2HB   LEU  65           HBS      LEU  65  -5.658  -2.651  -2.651
  532    HG   LEU  65           HG       LEU  65  -6.056  -2.010  -2.010
  533   1HD1  LEU  65           HMD      LEU  65  -8.069  -0.446  -0.446
  534   2HD1  LEU  65           HMD      LEU  65  -7.036   0.507   0.507
  535   3HD1  LEU  65           HMD      LEU  65  -7.987  -0.861  -0.861
  536   1HD2  LEU  65           HMD      LEU  65  -4.475  -1.170  -1.170
  537   2HD2  LEU  65           HMD      LEU  65  -4.421  -0.479  -0.479
  538   3HD2  LEU  65           HMD      LEU  65  -5.346   0.343   0.343
  539    H    GLN  66           HN       GLN  66  -5.814  -5.314  -5.314
  540    HA   GLN  66           HA       GLN  66  -4.304  -6.266  -6.266
  541   1HB   GLN  66           HBR      GLN  66  -4.530  -6.938  -6.938
  542   2HB   GLN  66           HBS      GLN  66  -5.105  -8.425  -8.425
  543   1HG   GLN  66           HGS      GLN  66  -2.449  -7.039  -7.039
  544   2HG   GLN  66           HGR      GLN  66  -2.720  -8.546  -8.546
  545   1HE2  GLN  66           HE2      GLN  66  -3.847 -10.204 -10.204
  546   2HE2  GLN  66           HE2      GLN  66  -4.691  -9.642  -9.642
  547    HA   PRO  67           HA       PRO  67  -7.773  -9.495  -9.495
  548   1HB   PRO  67           HBS      PRO  67 -10.076  -8.631  -8.631
  549   2HB   PRO  67           HBR      PRO  67  -9.399 -10.124 -10.124
  550   1HG   PRO  67           HGR      PRO  67  -9.505  -8.359  -8.359
  551   2HG   PRO  67           HGS      PRO  67  -8.520  -9.705  -9.705
  552   1HD   PRO  67           HDS      PRO  67  -7.828  -7.001  -7.001
  553   2HD   PRO  67           HDR      PRO  67  -6.852  -8.253  -8.253
  554    H    SER  68           HN       SER  68  -8.493  -6.179  -6.179
  555    HA   SER  68           HA       SER  68 -10.466  -6.103  -6.103
  556   1HB   SER  68           HBR      SER  68 -10.811  -4.839  -4.839
  557   2HB   SER  68           HBS      SER  68  -9.396  -3.826  -3.826
  558    HG   SER  68           HG       SER  68 -10.381  -3.349  -3.349
  559    H    LEU  69           HN       LEU  69  -7.140  -6.052  -6.052
  560    HA   LEU  69           HA       LEU  69  -6.607  -4.215  -4.215
  561   1HB   LEU  69           HBR      LEU  69  -5.141  -6.603  -6.603
  562   2HB   LEU  69           HBS      LEU  69  -4.450  -5.507  -5.507
  563    HG   LEU  69           HG       LEU  69  -5.355  -4.644  -4.644
  564   1HD1  LEU  69           HMD      LEU  69  -3.107  -6.169  -6.169
  565   2HD1  LEU  69           HMD      LEU  69  -2.504  -4.494  -4.494
  566   3HD1  LEU  69           HMD      LEU  69  -3.354  -5.187  -5.187
  567   1HD2  LEU  69           HMD      LEU  69  -4.914  -3.236  -3.236
  568   2HD2  LEU  69           HMD      LEU  69  -4.952  -2.566  -2.566
  569   3HD2  LEU  69           HMD      LEU  69  -3.398  -3.038  -3.038
  570    H    GLN  70           HN       GLN  70  -7.399  -7.665  -7.665
  571    HA   GLN  70           HA       GLN  70  -7.276  -8.160  -8.160
  572   1HB   GLN  70           HBR      GLN  70  -8.636 -10.054 -10.054
  573   2HB   GLN  70           HBS      GLN  70  -7.577  -9.901  -9.901
  574   1HG   GLN  70           HGS      GLN  70  -9.329  -9.921  -9.921
  575   2HG   GLN  70           HGR      GLN  70 -10.048  -8.525  -8.525
  576   1HE2  GLN  70           HE2      GLN  70 -10.987 -12.264 -12.264
  577   2HE2  GLN  70           HE2      GLN  70  -9.345 -11.814 -11.814
  578    H    THR  71           HN       THR  71  -9.364  -6.138  -6.138
  579    HA   THR  71           HA       THR  71 -11.384  -6.179  -6.179
  580    HB   THR  71           HB       THR  71 -13.031  -5.529  -5.529
  581    HG1  THR  71           HG1      THR  71 -12.237  -4.162  -4.162
  582   1HG2  THR  71           HMG      THR  71 -11.658  -7.907  -7.907
  583   2HG2  THR  71           HMG      THR  71 -11.698  -7.247  -7.247
  584   3HG2  THR  71           HMG      THR  71 -13.217  -7.488  -7.488
  585    H    GLY  72           HN       GLY  72  -8.890  -4.279  -4.279
  586   1HA   GLY  72           HAR      GLY  72 -10.266  -1.666  -1.666
  587   2HA   GLY  72           HAS      GLY  72  -8.718  -1.934  -1.934
  588    H    SER  73           HN       SER  73  -6.886  -2.662  -2.662
  589    HA   SER  73           HA       SER  73  -6.653  -2.785  -2.785
  590   1HB   SER  73           HBR      SER  73  -5.764  -0.528  -0.528
  591   2HB   SER  73           HBS      SER  73  -7.533  -0.657  -0.657
  592    HG   SER  73           HG       SER  73  -7.086   1.203   1.203
  593    H    GLU  74           HN       GLU  74  -4.400  -2.245  -2.245
  594    HA   GLU  74           HA       GLU  74  -2.231  -2.691  -2.691
  595   1HB   GLU  74           HBS      GLU  74  -2.269  -3.232  -3.232
  596   2HB   GLU  74           HBR      GLU  74  -2.512  -1.649  -1.649
  597   1HG   GLU  74           HGR      GLU  74  -0.328  -1.777  -1.777
  598   2HG   GLU  74           HGS      GLU  74  -0.187  -1.408  -1.408
  599    H    GLU  75           HN       GLU  75  -4.164  -0.012  -0.012
  600    HA   GLU  75           HA       GLU  75  -2.559   2.093   2.093
  601   1HB   GLU  75           HBR      GLU  75  -5.489   2.350   2.350
  602   2HB   GLU  75           HBS      GLU  75  -4.290   3.397   3.397
  603   1HG   GLU  75           HGR      GLU  75  -4.297   1.385   1.385
  604   2HG   GLU  75           HGS      GLU  75  -5.973   1.828   1.828
  605    H    LEU  76           HN       LEU  76  -4.971  -0.067  -0.067
  606    HA   LEU  76           HA       LEU  76  -4.815   1.141   1.141
  607   1HB   LEU  76           HBS      LEU  76  -6.486  -0.630  -0.630
  608   2HB   LEU  76           HBR      LEU  76  -5.543  -1.706  -1.706
  609    HG   LEU  76           HG       LEU  76  -7.396   0.555   0.555
  610   1HD1  LEU  76           HMD      LEU  76  -7.400  -2.393  -2.393
  611   2HD1  LEU  76           HMD      LEU  76  -7.917  -1.604  -1.604
  612   3HD1  LEU  76           HMD      LEU  76  -8.753  -1.233  -1.233
  613   1HD2  LEU  76           HMD      LEU  76  -5.079   0.388   0.388
  614   2HD2  LEU  76           HMD      LEU  76  -6.593   0.588   0.588
  615   3HD2  LEU  76           HMD      LEU  76  -5.840  -1.022  -1.022
  616    H    ARG  77           HN       ARG  77  -2.864  -0.973  -0.973
  617    HA   ARG  77           HA       ARG  77  -1.491  -2.337  -2.337
  618   1HB   ARG  77           HBR      ARG  77  -1.559  -2.881  -2.881
  619   2HB   ARG  77           HBS      ARG  77  -0.197  -1.728  -1.728
  620   1HG   ARG  77           HGS      ARG  77   1.249  -3.171  -3.171
  621   2HG   ARG  77           HGR      ARG  77   0.034  -3.802  -3.802
  622   1HD   ARG  77           HDS      ARG  77  -0.595  -5.458  -5.458
  623   2HD   ARG  77           HDR      ARG  77  -0.408  -4.461  -4.461
  624    HE   ARG  77           HE       ARG  77   1.607  -5.513  -5.513
  625   1HH1  ARG  77           HH1      ARG  77   0.851  -5.602  -5.602
  626   2HH1  ARG  77           HH1      ARG  77   2.389  -6.269  -6.269
  627   1HH2  ARG  77           HH2      ARG  77   3.655  -6.263  -6.263
  628   2HH2  ARG  77           HH2      ARG  77   3.977  -6.643  -6.643
  629    H    SER  78           HN       SER  78  -1.110   0.715   0.715
  630    HA   SER  78           HA       SER  78   1.200   1.527   1.527
  631   1HB   SER  78           HBR      SER  78  -0.747   2.843   2.843
  632   2HB   SER  78           HBS      SER  78   0.246   3.876   3.876
  633    HG   SER  78           HG       SER  78   2.126   3.091   3.091
  634    H    LEU  79           HN       LEU  79  -2.289   2.118   2.118
  635    HA   LEU  79           HA       LEU  79  -2.070   3.667   3.667
  636   1HB   LEU  79           HBS      LEU  79  -4.117   2.318   2.318
  637   2HB   LEU  79           HBR      LEU  79  -4.468   2.318   2.318
  638    HG   LEU  79           HG       LEU  79  -4.514   4.688   4.688
  639   1HD1  LEU  79           HMD      LEU  79  -3.450   4.542   4.542
  640   2HD1  LEU  79           HMD      LEU  79  -4.168   6.013   6.013
  641   3HD1  LEU  79           HMD      LEU  79  -2.696   5.311   5.311
  642   1HD2  LEU  79           HMD      LEU  79  -6.359   3.223   3.223
  643   2HD2  LEU  79           HMD      LEU  79  -6.472   5.001   5.001
  644   3HD2  LEU  79           HMD      LEU  79  -5.869   4.142   4.142
  645    H    TYR  80           HN       TYR  80  -1.803   0.272   0.272
  646    HA   TYR  80           HA       TYR  80  -2.248  -0.660  -0.660
  647   1HB   TYR  80           HBS      TYR  80  -2.642  -2.097  -2.097
  648   2HB   TYR  80           HBR      TYR  80  -0.928  -1.988  -1.988
  649    HD1  TYR  80           HD1      TYR  80  -3.076  -3.148  -3.148
  650    HD2  TYR  80           HD2      TYR  80   0.648  -3.505  -3.505
  651    HE1  TYR  80           HE1      TYR  80  -2.543  -5.134  -5.134
  652    HE2  TYR  80           HE2      TYR  80   1.194  -5.487  -5.487
  653    HH   TYR  80           HH       TYR  80  -0.759  -7.337  -7.337
  654    H    ASN  81           HN       ASN  81   0.741  -0.277  -0.277
  655    HA   ASN  81           HA       ASN  81   2.430  -1.286  -1.286
  656   1HB   ASN  81           HBS      ASN  81   4.298  -0.479  -0.479
  657   2HB   ASN  81           HBR      ASN  81   3.239  -1.725  -1.725
  658   1HD2  ASN  81           HD2      ASN  81   3.872   0.621   0.621
  659   2HD2  ASN  81           HD2      ASN  81   4.656  -0.657  -0.657
  660    H    THR  82           HN       THR  82   1.261   1.804   1.804
  661    HA   THR  82           HA       THR  82   2.835   3.206   3.206
  662    HB   THR  82           HB       THR  82   0.795   4.199   4.199
  663    HG1  THR  82           HG1      THR  82   2.406   3.254   3.254
  664   1HG2  THR  82           HMG      THR  82   1.041   5.740   5.740
  665   2HG2  THR  82           HMG      THR  82   2.772   5.874   5.874
  666   3HG2  THR  82           HMG      THR  82   1.541   6.428   6.428
  667    H    ILE  83           HN       ILE  83  -0.067   1.590   1.590
  668    HA   ILE  83           HA       ILE  83  -0.910   3.195   3.195
  669    HB   ILE  83           HB       ILE  83  -2.581   1.935   1.935
  670   1HG1  ILE  83           HG1      ILE  83  -4.032   1.400   1.400
  671   2HG1  ILE  83           HG1      ILE  83  -2.624   1.748   1.748
  672   1HG2  ILE  83           HMG      ILE  83  -1.333  -0.364  -0.364
  673   2HG2  ILE  83           HMG      ILE  83  -3.088  -0.371  -0.371
  674   3HG2  ILE  83           HMG      ILE  83  -1.945  -0.253  -0.253
  675   1HD1  ILE  83           HMD      ILE  83  -3.921   3.691   3.691
  676   2HD1  ILE  83           HMD      ILE  83  -4.150   3.681   3.681
  677   3HD1  ILE  83           HMD      ILE  83  -2.545   4.041   4.041
  678    H    ALA  84           HN       ALA  84   0.525   0.043   0.043
  679    HA   ALA  84           HA       ALA  84   0.988  -0.726  -0.726
  680   1HB   ALA  84           HMB      ALA  84   1.220  -1.880  -1.880
  681   2HB   ALA  84           HMB      ALA  84   2.818  -2.011  -2.011
  682   3HB   ALA  84           HMB      ALA  84   1.372  -2.662  -2.662
  683    H    VAL  85           HN       VAL  85   2.729   1.284   1.284
  684    HA   VAL  85           HA       VAL  85   5.084   1.565   1.565
  685    HB   VAL  85           HB       VAL  85   3.960   3.213   3.213
  686   1HG1  VAL  85           HMG      VAL  85   5.150   4.565   4.565
  687   2HG1  VAL  85           HMG      VAL  85   6.631   3.801   3.801
  688   3HG1  VAL  85           HMG      VAL  85   5.623   4.805   4.805
  689   1HG2  VAL  85           HMG      VAL  85   5.749   0.982   0.982
  690   2HG2  VAL  85           HMG      VAL  85   5.128   1.831   1.831
  691   3HG2  VAL  85           HMG      VAL  85   6.614   2.400   2.400
  692    H    LEU  86           HN       LEU  86   2.124   3.497   3.497
  693    HA   LEU  86           HA       LEU  86   2.725   5.315   5.315
  694   1HB   LEU  86           HBS      LEU  86   1.280   5.580   5.580
  695   2HB   LEU  86           HBR      LEU  86  -0.033   4.819   4.819
  696    HG   LEU  86           HG       LEU  86  -0.216   6.644   6.644
  697   1HD1  LEU  86           HMD      LEU  86   2.496   7.429   7.429
  698   2HD1  LEU  86           HMD      LEU  86   1.399   8.645   8.645
  699   3HD1  LEU  86           HMD      LEU  86   1.941   7.262   7.262
  700   1HD2  LEU  86           HMD      LEU  86   0.214   7.304   7.304
  701   2HD2  LEU  86           HMD      LEU  86  -1.293   7.253   7.253
  702   3HD2  LEU  86           HMD      LEU  86  -0.160   8.613   8.613
  703    H    TYR  87           HN       TYR  87   1.152   2.222   2.222
  704    HA   TYR  87           HA       TYR  87   0.426   2.410   2.410
  705   1HB   TYR  87           HBS      TYR  87  -0.252   0.547   0.547
  706   2HB   TYR  87           HBR      TYR  87   1.392  -0.132  -0.132
  707    HD1  TYR  87           HD1      TYR  87   2.130  -0.219  -0.219
  708    HD2  TYR  87           HD2      TYR  87  -1.909  -0.040  -0.040
  709    HE1  TYR  87           HE1      TYR  87   1.384  -0.957  -0.957
  710    HE2  TYR  87           HE2      TYR  87  -2.668  -0.497  -0.497
  711    HH   TYR  87           HH       TYR  87  -1.268  -2.353  -2.353
  712    H    CYS  88           HN       CYS  88   3.453   1.394   1.394
  713    HA   CYS  88           HA       CYS  88   4.989   0.787   0.787
  714   1HB   CYS  88           HBS      CYS  88   5.416   1.358   1.358
  715   2HB   CYS  88           HBR      CYS  88   6.730   1.958   1.958
  716    H    VAL  89           HN       VAL  89   4.532   3.819   3.819
  717    HA   VAL  89           HA       VAL  89   6.251   5.364   5.364
  718    HB   VAL  89           HB       VAL  89   3.917   6.448   6.448
  719   1HG1  VAL  89           HMG      VAL  89   6.619   7.540   7.540
  720   2HG1  VAL  89           HMG      VAL  89   5.640   8.251   8.251
  721   3HG1  VAL  89           HMG      VAL  89   5.000   8.190   8.190
  722   1HG2  VAL  89           HMG      VAL  89   5.883   4.730   4.730
  723   2HG2  VAL  89           HMG      VAL  89   4.702   5.723   5.723
  724   3HG2  VAL  89           HMG      VAL  89   6.320   6.372   6.372
  725    H    HIS  90           HN       HIS  90   2.765   4.709   4.709
  726    HA   HIS  90           HA       HIS  90   2.206   6.561   6.561
  727   1HB   HIS  90           HBS      HIS  90   0.645   4.179   4.179
  728   2HB   HIS  90           HBR      HIS  90   0.116   5.172   5.172
  729    HD1  HIS  90           HD1      HIS  90   1.080   7.957   7.957
  730    HD2  HIS  90           HD2      HIS  90  -1.231   4.975   4.975
  731    HE1  HIS  90           HE1      HIS  90  -0.152   9.045   9.045
  732    HE2  HIS  90           HE2      HIS  90  -1.559   7.245   7.245
  733    H    GLN  91           HN       GLN  91   3.730   3.520   3.520
  734    HA   GLN  91           HA       GLN  91   2.877   2.606   2.606
  735   1HB   GLN  91           HBS      GLN  91   2.359   1.199   1.199
  736   2HB   GLN  91           HBR      GLN  91   4.108   1.026   1.026
  737   1HG   GLN  91           HGR      GLN  91   3.091  -0.913  -0.913
  738   2HG   GLN  91           HGS      GLN  91   4.444  -0.158  -0.158
  739   1HE2  GLN  91           HE2      GLN  91   0.622   0.599   0.599
  740   2HE2  GLN  91           HE2      GLN  91   0.966   0.607   0.607
  741    H    ARG  92           HN       ARG  92   5.309   4.392   4.392
  742    HA   ARG  92           HA       ARG  92   7.137   5.026   5.026
  743   1HB   ARG  92           HBR      ARG  92   6.481   3.679   3.679
  744   2HB   ARG  92           HBS      ARG  92   7.243   2.247   2.247
  745   1HG   ARG  92           HGR      ARG  92   8.639   3.393   3.393
  746   2HG   ARG  92           HGS      ARG  92   9.418   3.248   3.248
  747   1HD   ARG  92           HDR      ARG  92   9.690   5.447   5.447
  748   2HD   ARG  92           HDS      ARG  92   9.063   5.514   5.514
  749    HE   ARG  92           HE       ARG  92   6.915   6.089   6.089
  750   1HH1  ARG  92           HH1      ARG  92   9.197   5.495   5.495
  751   2HH1  ARG  92           HH1      ARG  92   8.311   6.457   6.457
  752   1HH2  ARG  92           HH2      ARG  92   5.851   7.438   7.438
  753   2HH2  ARG  92           HH2      ARG  92   6.413   7.551   7.551
  754    H    ILE  93           HN       ILE  93   6.746   2.417   2.417
  755    HA   ILE  93           HA       ILE  93   9.645   1.923   1.923
  756    HB   ILE  93           HB       ILE  93   7.320   0.946   0.946
  757   1HG1  ILE  93           HG1      ILE  93   7.708  -1.263  -1.263
  758   2HG1  ILE  93           HG1      ILE  93   8.518  -0.256  -0.256
  759   1HG2  ILE  93           HMG      ILE  93  10.176  -0.005  -0.005
  760   2HG2  ILE  93           HMG      ILE  93   8.897  -0.848  -0.848
  761   3HG2  ILE  93           HMG      ILE  93   9.423   0.783   0.783
  762   1HD1  ILE  93           HMD      ILE  93   5.936   0.850   0.850
  763   2HD1  ILE  93           HMD      ILE  93   5.791  -0.836  -0.836
  764   3HD1  ILE  93           HMD      ILE  93   6.583   0.373   0.373
  765    H    ASP  94           HN       ASP  94  10.764   2.791   2.791
  766    HA   ASP  94           HA       ASP  94   9.198   3.978   3.978
  767   1HB   ASP  94           HBR      ASP  94  11.620   5.471   5.471
  768   2HB   ASP  94           HBS      ASP  94  10.702   5.810   5.810
  769    H    VAL  95           HN       VAL  95  10.081   3.683   3.683
  770    HA   VAL  95           HA       VAL  95  12.012   1.428   1.428
  771    HB   VAL  95           HB       VAL  95  10.640   0.242   0.242
  772   1HG1  VAL  95           HMG      VAL  95   9.562   1.272   1.272
  773   2HG1  VAL  95           HMG      VAL  95   8.234   1.034   1.034
  774   3HG1  VAL  95           HMG      VAL  95   9.319  -0.320  -0.320
  775   1HG2  VAL  95           HMG      VAL  95   9.494   2.858   2.858
  776   2HG2  VAL  95           HMG      VAL  95   9.769   1.394   1.394
  777   3HG2  VAL  95           HMG      VAL  95   8.339   1.508   1.508
  778    H    LYS  96           HN       LYS  96  12.263   0.915   0.915
  779    HA   LYS  96           HA       LYS  96  13.973   3.235   3.235
  780   1HB   LYS  96           HBS      LYS  96  15.335   1.223   1.223
  781   2HB   LYS  96           HBR      LYS  96  14.476   0.316   0.316
  782   1HG   LYS  96           HGS      LYS  96  16.143   0.951   0.951
  783   2HG   LYS  96           HGR      LYS  96  15.384   2.569   2.569
  784   1HD   LYS  96           HDS      LYS  96  16.916   2.526   2.526
  785   2HD   LYS  96           HDR      LYS  96  17.864   1.561   1.561
  786   1HE   LYS  96           HES      LYS  96  18.285   3.282   3.282
  787   2HE   LYS  96           HER      LYS  96  16.789   4.147   4.147
  788   1HZ   LYS  96           HZC      LYS  96  18.700   3.838   3.838
  789   2HZ   LYS  96           HZA      LYS  96  19.206   4.784   4.784
  790   3HZ   LYS  96           HZB      LYS  96  17.826   5.146   5.146
  791    H    ASP  97           HN       ASP  97  12.697   0.212   0.212
  792    HA   ASP  97           HA       ASP  97  11.071   1.895   1.895
  793   1HB   ASP  97           HBS      ASP  97  11.378   0.329   0.329
  794   2HB   ASP  97           HBR      ASP  97  12.967   0.485   0.485
  795    H    THR  98           HN       THR  98   9.250   0.355   0.355
  796    HA   THR  98           HA       THR  98   7.294  -0.362  -0.362
  797    HB   THR  98           HB       THR  98   7.846  -1.439  -1.439
  798    HG1  THR  98           HG1      THR  98   6.726  -0.067  -0.067
  799   1HG2  THR  98           HMG      THR  98   5.422  -1.900  -1.900
  800   2HG2  THR  98           HMG      THR  98   5.409  -2.061  -2.061
  801   3HG2  THR  98           HMG      THR  98   6.457  -3.114  -3.114
  802    H    LYS  99           HN       LYS  99   9.830  -2.429  -2.429
  803    HA   LYS  99           HA       LYS  99   8.822  -4.855  -4.855
  804   1HB   LYS  99           HBS      LYS  99  11.601  -3.978  -3.978
  805   2HB   LYS  99           HBR      LYS  99  11.289  -5.617  -5.617
  806   1HG   LYS  99           HGS      LYS  99  10.012  -4.379  -4.379
  807   2HG   LYS  99           HGR      LYS  99  11.311  -5.607  -5.607
  808   1HD   LYS  99           HDR      LYS  99   9.124  -6.494  -6.494
  809   2HD   LYS  99           HDS      LYS  99   8.462  -5.919  -5.919
  810   1HE   LYS  99           HES      LYS  99   8.992  -8.334  -8.334
  811   2HE   LYS  99           HER      LYS  99   9.881  -7.411  -7.411
  812   1HZ   LYS  99           HZA      LYS  99  10.994  -8.151  -8.151
  813   2HZ   LYS  99           HZB      LYS  99  11.253  -8.989  -8.989
  814   3HZ   LYS  99           HZC      LYS  99  11.793  -7.453  -7.453
  815    H    GLU 100           HN       GLU 100  10.841  -2.426  -2.426
  816    HA   GLU 100           HA       GLU 100  11.533  -4.016  -4.016
  817   1HB   GLU 100           HBS      GLU 100  11.767  -1.360  -1.360
  818   2HB   GLU 100           HBR      GLU 100  11.559  -1.235  -1.235
  819   1HG   GLU 100           HGS      GLU 100  13.563  -3.135  -3.135
  820   2HG   GLU 100           HGR      GLU 100  13.883  -1.673  -1.673
  821    H    ALA 101           HN       ALA 101   9.135  -1.383  -1.383
  822    HA   ALA 101           HA       ALA 101   7.984  -1.540  -1.540
  823   1HB   ALA 101           HMB      ALA 101   7.614  -0.042  -0.042
  824   2HB   ALA 101           HMB      ALA 101   6.049  -0.795  -0.795
  825   3HB   ALA 101           HMB      ALA 101   6.885   0.217   0.217
  826    H    LEU 102           HN       LEU 102   6.956  -2.883  -2.883
  827    HA   LEU 102           HA       LEU 102   4.657  -4.206  -4.206
  828   1HB   LEU 102           HBS      LEU 102   6.023  -3.749  -3.749
  829   2HB   LEU 102           HBR      LEU 102   5.969  -5.528  -5.528
  830    HG   LEU 102           HG       LEU 102   3.564  -5.500  -5.500
  831   1HD1  LEU 102           HMD      LEU 102   4.001  -2.666  -2.666
  832   2HD1  LEU 102           HMD      LEU 102   2.805  -2.931  -2.931
  833   3HD1  LEU 102           HMD      LEU 102   2.570  -3.686  -3.686
  834   1HD2  LEU 102           HMD      LEU 102   5.121  -4.293  -4.293
  835   2HD2  LEU 102           HMD      LEU 102   3.964  -5.648  -5.648
  836   3HD2  LEU 102           HMD      LEU 102   3.371  -3.969  -3.969
  837    H    ASP 103           HN       ASP 103   8.023  -5.068  -5.068
  838    HA   ASP 103           HA       ASP 103   7.467  -7.735  -7.735
  839   1HB   ASP 103           HBS      ASP 103   9.645  -6.723  -6.723
  840   2HB   ASP 103           HBR      ASP 103  10.010  -6.328  -6.328
  841    H    LYS 104           HN       LYS 104   8.428  -4.770  -4.770
  842    HA   LYS 104           HA       LYS 104   8.069  -5.794  -5.794
  843   1HB   LYS 104           HBR      LYS 104   8.883  -3.393  -3.393
  844   2HB   LYS 104           HBS      LYS 104   7.279  -2.986  -2.986
  845   1HG   LYS 104           HGS      LYS 104   9.544  -4.309  -4.309
  846   2HG   LYS 104           HGR      LYS 104   9.137  -2.570  -2.570
  847   1HD   LYS 104           HDS      LYS 104   7.729  -3.002  -3.002
  848   2HD   LYS 104           HDR      LYS 104   6.750  -3.900  -3.900
  849   1HE   LYS 104           HER      LYS 104   8.895  -5.579  -5.579
  850   2HE   LYS 104           HES      LYS 104   8.158  -4.871  -4.871
  851   1HZ   LYS 104           HZA      LYS 104   5.999  -5.541  -5.541
  852   2HZ   LYS 104           HZB      LYS 104   6.953  -6.591  -6.591
  853   3HZ   LYS 104           HZC      LYS 104   6.850  -6.670  -6.670
  854    H    ILE 105           HN       ILE 105   5.832  -5.021  -5.021
  855    HA   ILE 105           HA       ILE 105   3.640  -4.695  -4.695
  856    HB   ILE 105           HB       ILE 105   3.866  -4.260  -4.260
  857   1HG1  ILE 105           HG1      ILE 105   5.251  -2.874  -2.874
  858   2HG1  ILE 105           HG1      ILE 105   4.263  -2.002  -2.002
  859   1HG2  ILE 105           HMG      ILE 105   1.499  -4.272  -4.272
  860   2HG2  ILE 105           HMG      ILE 105   1.782  -2.672  -2.672
  861   3HG2  ILE 105           HMG      ILE 105   1.661  -4.120  -4.120
  862   1HD1  ILE 105           HMD      ILE 105   2.517  -1.905  -1.905
  863   2HD1  ILE 105           HMD      ILE 105   3.957  -2.185  -2.185
  864   3HD1  ILE 105           HMD      ILE 105   3.886  -0.763  -0.763
  865    H    GLU 106           HN       GLU 106   4.502  -6.726  -6.726
  866    HA   GLU 106           HA       GLU 106   2.565  -8.734  -8.734
  867   1HB   GLU 106           HBR      GLU 106   4.298  -8.531  -8.531
  868   2HB   GLU 106           HBS      GLU 106   5.488  -8.672  -8.672
  869   1HG   GLU 106           HGS      GLU 106   5.671 -10.533 -10.533
  870   2HG   GLU 106           HGR      GLU 106   4.853 -11.043 -11.043
  871    H    GLU 107           HN       GLU 107   5.655  -8.398  -8.398
  872    HA   GLU 107           HA       GLU 107   5.569 -10.992 -10.992
  873   1HB   GLU 107           HBR      GLU 107   7.337  -8.958  -8.958
  874   2HB   GLU 107           HBS      GLU 107   6.911  -8.680  -8.680
  875   1HG   GLU 107           HGS      GLU 107   8.580  -9.776  -9.776
  876   2HG   GLU 107           HGR      GLU 107   7.593 -11.241 -11.241
  877    H    GLU 108           HN       GLU 108   3.854  -8.121  -8.121
  878    HA   GLU 108           HA       GLU 108   3.007  -8.988  -8.988
  879   1HB   GLU 108           HBR      GLU 108   5.464  -7.754  -7.754
  880   2HB   GLU 108           HBS      GLU 108   4.447  -6.444  -6.444
  881   1HG   GLU 108           HGS      GLU 108   5.509  -6.950  -6.950
  882   2HG   GLU 108           HGR      GLU 108   3.742  -7.114  -7.114
  883    H    GLN 109           HN       GLN 109   3.603  -5.954  -5.954
  884    HA   GLN 109           HA       GLN 109   1.162  -4.908  -4.908
  885   1HB   GLN 109           HBR      GLN 109   3.360  -3.623  -3.623
  886   2HB   GLN 109           HBS      GLN 109   1.921  -2.753  -2.753
  887   1HG   GLN 109           HGS      GLN 109   2.734  -2.613  -2.613
  888   2HG   GLN 109           HGR      GLN 109   3.304  -4.306  -4.306
  889   1HE2  GLN 109           HE2      GLN 109   6.369  -2.531  -2.531
  890   2HE2  GLN 109           HE2      GLN 109   5.085  -3.367  -3.367
  891    H    ASN 110           HN       ASN 110   0.696  -6.914  -6.914
  892    HA   ASN 110           HA       ASN 110  -1.234  -5.245  -5.245
  893   1HB   ASN 110           HBS      ASN 110   0.206  -6.284  -6.284
  894   2HB   ASN 110           HBR      ASN 110  -0.137  -7.894  -7.894
  895   1HD2  ASN 110           HD2      ASN 110  -3.496  -6.093  -6.093
  896   2HD2  ASN 110           HD2      ASN 110  -2.579  -5.360  -5.360
  897    H    LYS 111           HN       LYS 111  -0.827  -8.656  -8.656
  898    HA   LYS 111           HA       LYS 111  -1.963  -9.938  -9.938
  899   1HB   LYS 111           HBR      LYS 111  -1.274  -7.760  -7.760
  900   2HB   LYS 111           HBS      LYS 111  -3.032  -7.442  -7.442
  901   1HG   LYS 111           HGR      LYS 111  -3.280  -8.780  -8.780
  902   2HG   LYS 111           HGS      LYS 111  -2.666 -10.153 -10.153
  903   1HD   LYS 111           HDS      LYS 111  -0.371  -8.785  -8.785
  904   2HD   LYS 111           HDR      LYS 111  -1.377  -8.580  -8.580
  905   1HE   LYS 111           HES      LYS 111  -1.590 -11.300 -11.300
  906   2HE   LYS 111           HER      LYS 111   0.134 -10.834 -10.834
  907   1HZ   LYS 111           HZB      LYS 111  -0.968  -9.760  -9.760
  908   2HZ   LYS 111           HZC      LYS 111  -1.689 -11.221 -11.221
  909   3HZ   LYS 111           HZA      LYS 111  -0.059 -11.116 -11.116
  910    H    SER 112           HN       SER 112  -3.613 -11.039 -11.039
  911    HA   SER 112           HA       SER 112  -6.173 -10.347 -10.347
  912   1HB   SER 112           HBS      SER 112  -7.356 -10.303 -10.303
  913   2HB   SER 112           HBR      SER 112  -6.510  -8.812  -8.812
  914    HG   SER 112           HG       SER 112  -4.624  -9.613  -9.613
  915    H    LYS 113           HN       LYS 113  -4.367 -12.136 -12.136
  916    HA   LYS 113           HA       LYS 113  -4.444 -14.328 -14.328
  917   1HB   LYS 113           HBR      LYS 113  -5.206 -14.543 -14.543
  918   2HB   LYS 113           HBS      LYS 113  -6.322 -15.546 -15.546
  919   1HG   LYS 113           HGR      LYS 113  -3.676 -16.010 -16.010
  920   2HG   LYS 113           HGS      LYS 113  -3.625 -16.111 -16.111
  921   1HD   LYS 113           HDS      LYS 113  -5.926 -17.497 -17.497
  922   2HD   LYS 113           HDR      LYS 113  -4.811 -17.904 -17.904
  923   1HE   LYS 113           HES      LYS 113  -3.221 -18.147 -18.147
  924   2HE   LYS 113           HER      LYS 113  -4.818 -18.710 -18.710
  925   1HZ   LYS 113           HZC      LYS 113  -4.643 -19.928 -19.928
  926   2HZ   LYS 113           HZA      LYS 113  -3.054 -19.874 -19.874
  927   3HZ   LYS 113           HZB      LYS 113  -4.109 -20.592 -20.592
  928    H    LYS 114           HN       LYS 114  -5.602 -14.995 -14.995
  929    HA   LYS 114           HA       LYS 114  -7.726 -13.427 -13.427
  930   1HB   LYS 114           HBR      LYS 114  -8.098 -15.396 -15.396
  931   2HB   LYS 114           HBS      LYS 114  -6.601 -14.424 -14.424
  932   1HG   LYS 114           HGR      LYS 114  -5.410 -16.185 -16.185
  933   2HG   LYS 114           HGS      LYS 114  -6.909 -17.157 -17.157
  934   1HD   LYS 114           HDS      LYS 114  -6.375 -18.088 -18.088
  935   2HD   LYS 114           HDR      LYS 114  -6.582 -16.540 -16.540
  936   1HE   LYS 114           HES      LYS 114  -4.009 -16.552 -16.552
  937   2HE   LYS 114           HER      LYS 114  -4.223 -18.054 -18.054
  938   1HZ   LYS 114           HZA      LYS 114  -5.036 -16.526 -16.526
  939   2HZ   LYS 114           HZB      LYS 114  -4.407 -15.287 -15.287
  940   3HZ   LYS 114           HZC      LYS 114  -3.434 -16.481 -16.481
  941    H    LYS 115           HN       LYS 115  -9.452 -13.315 -13.315
  942    HA   LYS 115           HA       LYS 115 -11.261 -15.608 -15.608
  943   1HB   LYS 115           HBR      LYS 115  -9.641 -14.982 -14.982
  944   2HB   LYS 115           HBS      LYS 115 -11.357 -14.627 -14.627
  945   1HG   LYS 115           HGR      LYS 115 -10.166 -17.270 -17.270
  946   2HG   LYS 115           HGS      LYS 115 -10.891 -16.896 -16.896
  947   1HD   LYS 115           HDS      LYS 115 -12.648 -16.413 -16.413
  948   2HD   LYS 115           HDR      LYS 115 -12.149 -18.070 -18.070
  949   1HE   LYS 115           HES      LYS 115 -12.852 -17.125 -17.125
  950   2HE   LYS 115           HER      LYS 115 -14.131 -16.642 -16.642
  951   1HZ   LYS 115           HZA      LYS 115 -13.078 -19.364 -19.364
  952   2HZ   LYS 115           HZB      LYS 115 -14.225 -18.935 -18.935
  953   3HZ   LYS 115           HZC      LYS 115 -14.528 -18.817 -18.817
  954    H    ALA 116           HN       ALA 116 -12.455 -14.205 -14.205
  955    HA   ALA 116           HA       ALA 116 -13.030 -11.498 -11.498
  956   1HB   ALA 116           HMB      ALA 116 -12.671 -12.649 -12.649
  957   2HB   ALA 116           HMB      ALA 116 -14.447 -12.527 -12.527
  958   3HB   ALA 116           HMB      ALA 116 -13.442 -11.071 -11.071
  959    H    GLN 117           HN       GLN 117 -14.548 -14.618 -14.618
  960    HA   GLN 117           HA       GLN 117 -16.615 -15.384 -15.384
  961   1HB   GLN 117           HBR      GLN 117 -17.503 -14.536 -14.536
  962   2HB   GLN 117           HBS      GLN 117 -15.725 -14.415 -14.415
  963   1HG   GLN 117           HGS      GLN 117 -17.159 -12.006 -12.006
  964   2HG   GLN 117           HGR      GLN 117 -17.423 -12.452 -12.452
  965   1HE2  GLN 117           HE2      GLN 117 -14.584 -10.090 -10.090
  966   2HE2  GLN 117           HE2      GLN 117 -16.239 -10.076 -10.076
  967    H    GLN 118           HN       GLN 118 -16.421 -13.282 -13.282
  968    HA   GLN 118           HA       GLN 118 -17.819 -12.159 -12.159
  969   1HB   GLN 118           HBR      GLN 118 -19.842 -13.694 -13.694
  970   2HB   GLN 118           HBS      GLN 118 -20.382 -12.291 -12.291
  971   1HG   GLN 118           HGS      GLN 118 -19.683 -13.265 -13.265
  972   2HG   GLN 118           HGR      GLN 118 -18.669 -14.476 -14.476
  973   1HE2  GLN 118           HE2      GLN 118 -22.058 -15.727 -15.727
  974   2HE2  GLN 118           HE2      GLN 118 -20.981 -14.548 -14.548
  975    H    ALA 119           HN       ALA 119 -19.794 -11.878 -11.878
  976    HA   ALA 119           HA       ALA 119 -20.275 -10.105 -10.105
  977   1HB   ALA 119           HMB      ALA 119 -17.509  -9.800  -9.800
  978   2HB   ALA 119           HMB      ALA 119 -18.265  -8.195  -8.195
  979   3HB   ALA 119           HMB      ALA 119 -18.467  -9.123  -9.123
  980    H    ALA 120           HN       ALA 120 -18.646  -8.366  -8.366
  981    HA   ALA 120           HA       ALA 120 -20.541  -6.315  -6.315
  982   1HB   ALA 120           HMB      ALA 120 -18.169  -6.329  -6.329
  983   2HB   ALA 120           HMB      ALA 120 -18.835  -7.088  -7.088
  984   3HB   ALA 120           HMB      ALA 120 -19.393  -5.470  -5.470
  985    H    ALA 121           HN       ALA 121 -22.245  -5.773  -5.773
  986    HA   ALA 121           HA       ALA 121 -23.753  -8.108  -8.108
  987   1HB   ALA 121           HMB      ALA 121 -24.429  -5.212  -5.212
  988   2HB   ALA 121           HMB      ALA 121 -25.597  -6.371  -6.371
  989   3HB   ALA 121           HMB      ALA 121 -24.895  -6.660  -6.660
  990    H    ASP 122           HN       ASP 122 -22.908  -4.894  -4.894
  991    HA   ASP 122           HA       ASP 122 -24.097  -5.443  -5.443
  992   1HB   ASP 122           HBS      ASP 122 -22.359  -3.251  -3.251
  993   2HB   ASP 122           HBR      ASP 122 -22.694  -3.406  -3.406
  994    H    THR 123           HN       THR 123 -23.408  -7.158  -7.158
  995    HA   THR 123           HA       THR 123 -20.748  -7.187  -7.187
  996    HB   THR 123           HB       THR 123 -20.281  -8.209  -8.209
  997    HG1  THR 123           HG1      THR 123 -19.117  -8.485  -8.485
  998   1HG2  THR 123           HMG      THR 123 -22.369  -9.443  -9.443
  999   2HG2  THR 123           HMG      THR 123 -21.972 -10.513 -10.513
 1000   3HG2  THR 123           HMG      THR 123 -20.947 -10.514 -10.514
 1001    H    GLY 124           HN       GLY 124 -23.775  -8.908  -8.908
 1002   1HA   GLY 124           HAR      GLY 124 -23.417 -10.610 -10.610
 1003   2HA   GLY 124           HAS      GLY 124 -24.673 -10.766 -10.766
 1004    H    ASN 125           HN       ASN 125 -24.115  -7.590  -7.590
 1005    HA   ASN 125           HA       ASN 125 -26.315  -7.892  -7.892
 1006   1HB   ASN 125           HBS      ASN 125 -26.981  -5.589  -5.589
 1007   2HB   ASN 125           HBR      ASN 125 -27.172  -6.619  -6.619
 1008   1HD2  ASN 125           HD2      ASN 125 -25.705  -3.274  -3.274
 1009   2HD2  ASN 125           HD2      ASN 125 -27.113  -3.770  -3.770
 1010    H    ASN 126           HN       ASN 126 -26.075  -6.971  -6.971
 1011    HA   ASN 126           HA       ASN 126 -23.395  -7.058  -7.058
 1012   1HB   ASN 126           HBS      ASN 126 -26.035  -6.622  -6.622
 1013   2HB   ASN 126           HBR      ASN 126 -24.537  -6.251  -6.251
 1014   1HD2  ASN 126           HD2      ASN 126 -25.095 -10.155 -10.155
 1015   2HD2  ASN 126           HD2      ASN 126 -25.556  -8.831  -8.831
 1016    H    SER 127           HN       SER 127 -25.655  -4.348  -4.348
 1017    HA   SER 127           HA       SER 127 -23.281  -2.602  -2.602
 1018   1HB   SER 127           HBS      SER 127 -24.743  -1.092  -1.092
 1019   2HB   SER 127           HBR      SER 127 -24.677  -2.722  -2.722
 1020    HG   SER 127           HG       SER 127 -26.634  -3.289  -3.289
 1021    H    GLN 128           HN       GLN 128 -23.384  -0.426  -0.426
 1022    HA   GLN 128           HA       GLN 128 -24.437  -0.101  -0.101
 1023   1HB   GLN 128           HBR      GLN 128 -23.989   2.396   2.396
 1024   2HB   GLN 128           HBS      GLN 128 -22.632   1.256   1.256
 1025   1HG   GLN 128           HGS      GLN 128 -23.641   1.591   1.591
 1026   2HG   GLN 128           HGR      GLN 128 -22.807   2.995   2.995
 1027   1HE2  GLN 128           HE2      GLN 128 -19.622   1.735   1.735
 1028   2HE2  GLN 128           HE2      GLN 128 -20.676   3.054   3.054
 1029    H    VAL 129           HN       VAL 129 -25.645   2.271   2.271
 1030    HA   VAL 129           HA       VAL 129 -28.331   1.864   1.864
 1031    HB   VAL 129           HB       VAL 129 -27.092   4.460   4.460
 1032   1HG1  VAL 129           HMG      VAL 129 -29.884   3.426   3.426
 1033   2HG1  VAL 129           HMG      VAL 129 -29.503   4.552   4.552
 1034   3HG1  VAL 129           HMG      VAL 129 -29.215   5.035   5.035
 1035   1HG2  VAL 129           HMG      VAL 129 -28.025   2.120   2.120
 1036   2HG2  VAL 129           HMG      VAL 129 -26.431   2.912   2.912
 1037   3HG2  VAL 129           HMG      VAL 129 -27.852   3.774   3.774
 1038    H    SER 130           HN       SER 130 -29.469   2.919   2.919
 1039    HA   SER 130           HA       SER 130 -27.865   4.274   4.274
 1040   1HB   SER 130           HBS      SER 130 -29.365   1.724   1.724
 1041   2HB   SER 130           HBR      SER 130 -29.483   2.944   2.944
 1042    HG   SER 130           HG       SER 130 -27.825   1.744   1.744
 1043    H    GLN 131           HN       GLN 131 -31.217   3.071   3.071
 1044    HA   GLN 131           HA       GLN 131 -32.128   5.838   5.838
 1045   1HB   GLN 131           HBR      GLN 131 -33.699   3.388   3.388
 1046   2HB   GLN 131           HBS      GLN 131 -33.797   5.052   5.052
 1047   1HG   GLN 131           HGS      GLN 131 -32.358   4.580   4.580
 1048   2HG   GLN 131           HGR      GLN 131 -31.164   3.960   3.960
 1049   1HE2  GLN 131           HE2      GLN 131 -33.555   1.472   1.472
 1050   2HE2  GLN 131           HE2      GLN 131 -33.781   3.190   3.190
 1051    H    ASN 132           HN       ASN 132 -32.288   3.169   3.169
 1052    HA   ASN 132           HA       ASN 132 -33.456   2.757   2.757
 1053   1HB   ASN 132           HBS      ASN 132 -34.623   5.519   5.519
 1054   2HB   ASN 132           HBR      ASN 132 -34.828   4.453   4.453
 1055   1HD2  ASN 132           HD2      ASN 132 -31.748   6.962   6.962
 1056   2HD2  ASN 132           HD2      ASN 132 -33.201   7.089   7.089
 1057    H    TYR 133           HN       TYR 133 -35.378   1.793   1.793
 1058    HA   TYR 133           HA       TYR 133 -37.765   2.278   2.278
 1059   1HB   TYR 133           HBS      TYR 133 -38.133   0.021   0.021
 1060   2HB   TYR 133           HBR      TYR 133 -36.616   0.664   0.664
 1061    HD1  TYR 133           HD2      TYR 133 -34.608   0.178   0.178
 1062    HD2  TYR 133           HD1      TYR 133 -37.912  -2.301  -2.301
 1063    HE1  TYR 133           HE2      TYR 133 -33.399  -1.773  -1.773
 1064    HE2  TYR 133           HE1      TYR 133 -36.700  -4.268  -4.268
 1065    HH   TYR 133           HH       TYR 133 -35.062  -4.735  -4.735

  Start of MODEL   11
    1   1H    HIS   1           HNB      HIS   1  -2.016  16.313  16.313
    2   2H    HIS   1           HNC      HIS   1  -3.270  15.267  15.267
    3   3H    HIS   1           HN       HIS   1  -3.275  16.555  16.555
    4    HA   HIS   1           HA       HIS   1  -2.037  15.636  15.636
    5   1HB   HIS   1           HBS      HIS   1  -3.428  13.513  13.513
    6   2HB   HIS   1           HBR      HIS   1  -1.959  12.919  12.919
    7    HD1  HIS   1           HD1      HIS   1  -5.183  14.855  14.855
    8    HD2  HIS   1           HD2      HIS   1  -2.234  12.541  12.541
    9    HE1  HIS   1           HE1      HIS   1  -5.846  14.625  14.625
   10    HE2  HIS   1           HE2      HIS   1  -4.054  13.245  13.245
   11    H    MET   2           HN       MET   2  -1.172  13.378  13.378
   12    HA   MET   2           HA       MET   2   1.692  13.757  13.757
   13   1HB   MET   2           HBS      MET   2   0.056  11.683  11.683
   14   2HB   MET   2           HBR      MET   2   1.464  12.121  12.121
   15   1HG   MET   2           HGR      MET   2   2.990  11.681  11.681
   16   2HG   MET   2           HGS      MET   2   1.667  11.509  11.509
   17   1HE   MET   2           HME      MET   2   4.054  10.112  10.112
   18   2HE   MET   2           HME      MET   2   3.908   8.653   8.653
   19   3HE   MET   2           HME      MET   2   3.551   8.567   8.567
   20    H    GLY   3           HN       GLY   3   1.719  15.985  15.985
   21   1HA   GLY   3           HAS      GLY   3   2.491  17.577  17.577
   22   2HA   GLY   3           HAR      GLY   3   1.985  16.492  16.492
   23    H    ALA   4           HN       ALA   4   1.373  19.303  19.303
   24    HA   ALA   4           HA       ALA   4  -1.426  19.644  19.644
   25   1HB   ALA   4           HMB      ALA   4   0.741  21.187  21.187
   26   2HB   ALA   4           HMB      ALA   4  -0.910  21.539  21.539
   27   3HB   ALA   4           HMB      ALA   4  -0.511  21.692  21.692
   28    H    ARG   5           HN       ARG   5   0.436  18.432  18.432
   29    HA   ARG   5           HA       ARG   5  -1.817  16.964  16.964
   30   1HB   ARG   5           HBS      ARG   5  -1.483  19.538  19.538
   31   2HB   ARG   5           HBR      ARG   5  -1.208  18.212  18.212
   32   1HG   ARG   5           HGS      ARG   5  -3.384  17.680  17.680
   33   2HG   ARG   5           HGR      ARG   5  -3.575  17.813  17.813
   34   1HD   ARG   5           HDS      ARG   5  -3.137  20.413  20.413
   35   2HD   ARG   5           HDR      ARG   5  -4.400  19.610  19.610
   36    HE   ARG   5           HE       ARG   5  -5.258  19.074  19.074
   37   1HH1  ARG   5           HH1      ARG   5  -4.337  22.065  22.065
   38   2HH1  ARG   5           HH1      ARG   5  -5.219  23.064  23.064
   39   1HH2  ARG   5           HH2      ARG   5  -6.298  20.423  20.423
   40   2HH2  ARG   5           HH2      ARG   5  -6.332  22.137  22.137
   41    H    ALA   6           HN       ALA   6   0.818  18.417  18.417
   42    HA   ALA   6           HA       ALA   6   2.428  17.460  17.460
   43   1HB   ALA   6           HMB      ALA   6   2.268  15.508  15.508
   44   2HB   ALA   6           HMB      ALA   6   2.980  14.939  14.939
   45   3HB   ALA   6           HMB      ALA   6   3.668  16.358  16.358
   46    H    SER   7           HN       SER   7  -0.093  17.593  17.593
   47    HA   SER   7           HA       SER   7  -1.911  16.644  16.644
   48   1HB   SER   7           HBS      SER   7  -0.372  17.429  17.429
   49   2HB   SER   7           HBR      SER   7   0.846  16.202  16.202
   50    HG   SER   7           HG       SER   7  -1.672  15.927  15.927
   51    H    VAL   8           HN       VAL   8  -0.954  14.096  14.096
   52    HA   VAL   8           HA       VAL   8  -2.077  11.900  11.900
   53    HB   VAL   8           HB       VAL   8   0.097  12.241  12.241
   54   1HG1  VAL   8           HMG      VAL   8  -1.152   9.729   9.729
   55   2HG1  VAL   8           HMG      VAL   8  -0.637   9.795   9.795
   56   3HG1  VAL   8           HMG      VAL   8   0.545  10.079  10.079
   57   1HG2  VAL   8           HMG      VAL   8  -2.285  13.049  13.049
   58   2HG2  VAL   8           HMG      VAL   8  -1.523  11.992  11.992
   59   3HG2  VAL   8           HMG      VAL   8  -2.726  11.327  11.327
   60    H    LEU   9           HN       LEU   9   1.281  13.044  13.044
   61    HA   LEU   9           HA       LEU   9   2.114  10.670  10.670
   62   1HB   LEU   9           HBR      LEU   9   3.287  12.627  12.627
   63   2HB   LEU   9           HBS      LEU   9   4.390  11.645  11.645
   64    HG   LEU   9           HG       LEU   9   2.274  10.541  10.541
   65   1HD1  LEU   9           HMD      LEU   9   5.270  10.903  10.903
   66   2HD1  LEU   9           HMD      LEU   9   4.303   9.808   9.808
   67   3HD1  LEU   9           HMD      LEU   9   3.983  11.561  11.561
   68   1HD2  LEU   9           HMD      LEU   9   4.202   9.431   9.431
   69   2HD2  LEU   9           HMD      LEU   9   2.587   8.853   8.853
   70   3HD2  LEU   9           HMD      LEU   9   3.995   8.538   8.538
   71    H    SER  10           HN       SER  10   4.649  11.458  11.458
   72    HA   SER  10           HA       SER  10   4.105  13.597  13.597
   73   1HB   SER  10           HBS      SER  10   5.349  12.588  12.588
   74   2HB   SER  10           HBR      SER  10   4.332  11.266  11.266
   75    HG   SER  10           HG       SER  10   6.454  10.598  10.598
   76    H    GLY  11           HN       GLY  11   5.987  14.850  14.850
   77   1HA   GLY  11           HAR      GLY  11   7.115  15.893  15.893
   78   2HA   GLY  11           HAS      GLY  11   7.757  16.199  16.199
   79    H    GLY  12           HN       GLY  12   8.672  13.660  13.660
   80   1HA   GLY  12           HAR      GLY  12  11.172  13.403  13.403
   81   2HA   GLY  12           HAS      GLY  12  10.529  12.297  12.297
   82    H    GLU  13           HN       GLU  13   8.156  11.475  11.475
   83    HA   GLU  13           HA       GLU  13   8.870   9.423   9.423
   84   1HB   GLU  13           HBR      GLU  13   6.282  10.771  10.771
   85   2HB   GLU  13           HBS      GLU  13   6.330   9.563   9.563
   86   1HG   GLU  13           HGS      GLU  13   6.894   7.900   7.900
   87   2HG   GLU  13           HGR      GLU  13   7.270   8.986   8.986
   88    H    LEU  14           HN       LEU  14   8.195  12.746  12.746
   89    HA   LEU  14           HA       LEU  14   7.320  12.286  12.286
   90   1HB   LEU  14           HBS      LEU  14   6.582  13.980  13.980
   91   2HB   LEU  14           HBR      LEU  14   7.863  14.990  14.990
   92    HG   LEU  14           HG       LEU  14   6.718  15.114  15.114
   93   1HD1  LEU  14           HMD      LEU  14   5.187  12.804  12.804
   94   2HD1  LEU  14           HMD      LEU  14   4.321  13.941  13.941
   95   3HD1  LEU  14           HMD      LEU  14   5.780  13.105  13.105
   96   1HD2  LEU  14           HMD      LEU  14   5.775  16.118  16.118
   97   2HD2  LEU  14           HMD      LEU  14   5.181  16.578  16.578
   98   3HD2  LEU  14           HMD      LEU  14   4.320  15.336  15.336
   99    H    ASP  15           HN       ASP  15  10.080  13.914  13.914
  100    HA   ASP  15           HA       ASP  15  11.714  14.136  14.136
  101   1HB   ASP  15           HBS      ASP  15  12.169  15.166  15.166
  102   2HB   ASP  15           HBR      ASP  15  12.681  13.554  13.554
  103    H    LYS  16           HN       LYS  16  10.513  11.408  11.408
  104    HA   LYS  16           HA       LYS  16  12.204   9.516   9.516
  105   1HB   LYS  16           HBS      LYS  16  10.396   9.344   9.344
  106   2HB   LYS  16           HBR      LYS  16   9.565   8.538   8.538
  107   1HG   LYS  16           HGR      LYS  16  12.274   7.852   7.852
  108   2HG   LYS  16           HGS      LYS  16  10.788   6.862   6.862
  109   1HD   LYS  16           HDR      LYS  16  11.153   6.013   6.013
  110   2HD   LYS  16           HDS      LYS  16  11.532   7.552   7.552
  111   1HE   LYS  16           HES      LYS  16  13.786   7.122   7.122
  112   2HE   LYS  16           HER      LYS  16  13.281   5.449   5.449
  113   1HZ   LYS  16           HZA      LYS  16  13.000   6.757   6.757
  114   2HZ   LYS  16           HZB      LYS  16  14.358   7.430   7.430
  115   3HZ   LYS  16           HZC      LYS  16  14.267   5.812   5.812
  116    H    TRP  17           HN       TRP  17   8.818  10.666  10.666
  117    HA   TRP  17           HA       TRP  17   8.139   8.731   8.731
  118   1HB   TRP  17           HBS      TRP  17   6.458   9.749   9.749
  119   2HB   TRP  17           HBR      TRP  17   6.781  11.358  11.358
  120    HD1  TRP  17           HD1      TRP  17   6.132  11.574  11.574
  121    HE1  TRP  17           HE1      TRP  17   4.619  10.197  10.197
  122    HE3  TRP  17           HE3      TRP  17   5.226   7.657   7.657
  123    HZ2  TRP  17           HZ2      TRP  17   3.086   7.853   7.853
  124    HZ3  TRP  17           HZ3      TRP  17   3.722   5.877   5.877
  125    HH2  TRP  17           HH2      TRP  17   2.664   5.966   5.966
  126    H    GLU  18           HN       GLU  18   9.811  11.700  11.700
  127    HA   GLU  18           HA       GLU  18   8.912  12.204  12.204
  128   1HB   GLU  18           HBR      GLU  18  10.995  13.280  13.280
  129   2HB   GLU  18           HBS      GLU  18  10.969  13.792  13.792
  130   1HG   GLU  18           HGR      GLU  18   8.367  14.251  14.251
  131   2HG   GLU  18           HGS      GLU  18   9.486  14.706  14.706
  132    H    LYS  19           HN       LYS  19  10.429   9.634   9.634
  133    HA   LYS  19           HA       LYS  19  11.082   9.514   9.514
  134   1HB   LYS  19           HBS      LYS  19  13.092  10.860  10.860
  135   2HB   LYS  19           HBR      LYS  19  13.646   9.670   9.670
  136   1HG   LYS  19           HGR      LYS  19  13.141   8.224   8.224
  137   2HG   LYS  19           HGS      LYS  19  14.033   9.698   9.698
  138   1HD   LYS  19           HDR      LYS  19  14.879   7.783   7.783
  139   2HD   LYS  19           HDS      LYS  19  15.450   7.705   7.705
  140   1HE   LYS  19           HER      LYS  19  17.118   8.834   8.834
  141   2HE   LYS  19           HES      LYS  19  16.216  10.137  10.137
  142   1HZ   LYS  19           HZA      LYS  19  15.378   9.394   9.394
  143   2HZ   LYS  19           HZB      LYS  19  16.772  10.234  10.234
  144   3HZ   LYS  19           HZC      LYS  19  15.381  10.858  10.858
  145    H    ILE  20           HN       ILE  20   9.651   7.822   7.822
  146    HA   ILE  20           HA       ILE  20  11.227   5.488   5.488
  147    HB   ILE  20           HB       ILE  20   8.294   6.182   6.182
  148   1HG1  ILE  20           HG1      ILE  20  10.338   4.988   4.988
  149   2HG1  ILE  20           HG1      ILE  20  10.131   6.745   6.745
  150   1HG2  ILE  20           HMG      ILE  20   9.421   3.380   3.380
  151   2HG2  ILE  20           HMG      ILE  20   7.852   3.919   3.919
  152   3HG2  ILE  20           HMG      ILE  20   8.145   3.954   3.954
  153   1HD1  ILE  20           HMD      ILE  20   7.559   5.850   5.850
  154   2HD1  ILE  20           HMD      ILE  20   8.574   4.883   4.883
  155   3HD1  ILE  20           HMD      ILE  20   8.647   6.664   6.664
  156    H    ARG  21           HN       ARG  21  11.974   4.410   4.410
  157    HA   ARG  21           HA       ARG  21  11.080   4.603   4.603
  158   1HB   ARG  21           HBR      ARG  21  13.097   3.142   3.142
  159   2HB   ARG  21           HBS      ARG  21  12.283   2.064   2.064
  160   1HG   ARG  21           HGS      ARG  21  13.086   3.198   3.198
  161   2HG   ARG  21           HGR      ARG  21  13.168   4.758   4.758
  162   1HD   ARG  21           HDS      ARG  21  14.939   2.797   2.797
  163   2HD   ARG  21           HDR      ARG  21  15.260   3.014   3.014
  164    HE   ARG  21           HE       ARG  21  14.987   5.569   5.569
  165   1HH1  ARG  21           HH1      ARG  21  17.237   2.862   2.862
  166   2HH1  ARG  21           HH1      ARG  21  18.596   3.812   3.812
  167   1HH2  ARG  21           HH2      ARG  21  16.762   6.746   6.746
  168   2HH2  ARG  21           HH2      ARG  21  18.329   6.010   6.010
  169    H    LEU  22           HN       LEU  22   9.882   3.315   3.315
  170    HA   LEU  22           HA       LEU  22   7.579   2.111   2.111
  171   1HB   LEU  22           HBR      LEU  22   7.938   2.270   2.270
  172   2HB   LEU  22           HBS      LEU  22   6.458   2.402   2.402
  173    HG   LEU  22           HG       LEU  22   8.313   4.597   4.597
  174   1HD1  LEU  22           HMD      LEU  22   7.193   4.216   4.216
  175   2HD1  LEU  22           HMD      LEU  22   7.942   5.704   5.704
  176   3HD1  LEU  22           HMD      LEU  22   8.915   4.223   4.223
  177   1HD2  LEU  22           HMD      LEU  22   5.673   4.056   4.056
  178   2HD2  LEU  22           HMD      LEU  22   6.350   5.704   5.704
  179   3HD2  LEU  22           HMD      LEU  22   5.644   4.972   4.972
  180    H    ARG  23           HN       ARG  23  10.518   1.171   1.171
  181    HA   ARG  23           HA       ARG  23   9.806  -1.685  -1.685
  182   1HB   ARG  23           HBR      ARG  23  10.942  -1.763  -1.763
  183   2HB   ARG  23           HBS      ARG  23   9.176  -1.601  -1.601
  184   1HG   ARG  23           HGS      ARG  23   9.249   0.738   0.738
  185   2HG   ARG  23           HGR      ARG  23  11.034   0.757   0.757
  186   1HD   ARG  23           HDS      ARG  23  11.007   0.463   0.463
  187   2HD   ARG  23           HDR      ARG  23  10.428  -1.197  -1.197
  188    HE   ARG  23           HE       ARG  23   8.392  -0.584  -0.584
  189   1HH1  ARG  23           HH1      ARG  23   9.900   2.324   2.324
  190   2HH1  ARG  23           HH1      ARG  23   8.739   3.384   3.384
  191   1HH2  ARG  23           HH2      ARG  23   6.969   0.843   0.843
  192   2HH2  ARG  23           HH2      ARG  23   7.078   2.547   2.547
  193    HA   PRO  24           HA       PRO  24  14.008  -2.184  -2.184
  194   1HB   PRO  24           HBS      PRO  24  14.230  -4.596  -4.596
  195   2HB   PRO  24           HBR      PRO  24  14.164  -4.361  -4.361
  196   1HG   PRO  24           HGS      PRO  24  12.260  -5.476  -5.476
  197   2HG   PRO  24           HGR      PRO  24  12.049  -4.939  -4.939
  198   1HD   PRO  24           HDS      PRO  24  11.187  -3.742  -3.742
  199   2HD   PRO  24           HDR      PRO  24  10.638  -3.479  -3.479
  200    H    GLY  25           HN       GLY  25  13.047  -2.371  -2.371
  201   1HA   GLY  25           HAS      GLY  25  15.664  -2.514  -2.514
  202   2HA   GLY  25           HAR      GLY  25  14.148  -2.000  -2.000
  203    H    GLY  26           HN       GLY  26  13.613   0.018   0.018
  204   1HA   GLY  26           HAR      GLY  26  14.223   2.109   2.109
  205   2HA   GLY  26           HAS      GLY  26  15.890   1.770   1.770
  206    H    LYS  27           HN       LYS  27  12.855   1.791   1.791
  207    HA   LYS  27           HA       LYS  27  13.913   3.537   3.537
  208   1HB   LYS  27           HBR      LYS  27  11.868   1.776   1.776
  209   2HB   LYS  27           HBS      LYS  27  10.974   3.291   3.291
  210   1HG   LYS  27           HGS      LYS  27  12.737   2.645   2.645
  211   2HG   LYS  27           HGR      LYS  27  10.966   2.879   2.879
  212   1HD   LYS  27           HDR      LYS  27  11.471   5.218   5.218
  213   2HD   LYS  27           HDS      LYS  27  13.145   4.927   4.927
  214   1HE   LYS  27           HES      LYS  27  11.648   4.190   4.190
  215   2HE   LYS  27           HER      LYS  27  10.979   5.731   5.731
  216   1HZ   LYS  27           HZB      LYS  27  13.213   6.612   6.612
  217   2HZ   LYS  27           HZC      LYS  27  13.809   5.206   5.206
  218   3HZ   LYS  27           HZA      LYS  27  12.785   6.096   6.096
  219    H    LYS  28           HN       LYS  28  11.043   3.993   3.993
  220    HA   LYS  28           HA       LYS  28  11.785   6.861   6.861
  221   1HB   LYS  28           HBS      LYS  28   9.586   5.856   5.856
  222   2HB   LYS  28           HBR      LYS  28   8.938   6.609   6.609
  223   1HG   LYS  28           HGS      LYS  28   9.118   8.164   8.164
  224   2HG   LYS  28           HGR      LYS  28   9.997   8.707   8.707
  225   1HD   LYS  28           HDS      LYS  28  11.566   7.070   7.070
  226   2HD   LYS  28           HDR      LYS  28  10.944   8.544   8.544
  227   1HE   LYS  28           HER      LYS  28  12.812   8.213   8.213
  228   2HE   LYS  28           HES      LYS  28  13.031   9.154   9.154
  229   1HZ   LYS  28           HZC      LYS  28  11.091  10.493  10.493
  230   2HZ   LYS  28           HZA      LYS  28  11.390   9.804   9.804
  231   3HZ   LYS  28           HZB      LYS  28  12.540  10.709  10.709
  232    H    GLN  29           HN       GLN  29  10.267   7.893   7.893
  233    HA   GLN  29           HA       GLN  29  10.319   6.073   6.073
  234   1HB   GLN  29           HBR      GLN  29  11.230   8.132   8.132
  235   2HB   GLN  29           HBS      GLN  29  12.332   7.197   7.197
  236   1HG   GLN  29           HGS      GLN  29  11.031   9.298   9.298
  237   2HG   GLN  29           HGR      GLN  29  11.826   9.963   9.963
  238   1HE2  GLN  29           HE2      GLN  29  15.076   8.574   8.574
  239   2HE2  GLN  29           HE2      GLN  29  14.009   8.464   8.464
  240    H    TYR  30           HN       TYR  30   8.818   6.303   6.303
  241    HA   TYR  30           HA       TYR  30   6.528   7.780   7.780
  242   1HB   TYR  30           HBS      TYR  30   8.106   6.809   6.809
  243   2HB   TYR  30           HBR      TYR  30   6.634   7.790   7.790
  244    HD1  TYR  30           HD2      TYR  30   6.875   5.386   5.386
  245    HD2  TYR  30           HD1      TYR  30   5.516   5.960   5.960
  246    HE1  TYR  30           HE2      TYR  30   5.793   3.183   3.183
  247    HE2  TYR  30           HE1      TYR  30   4.672   3.643   3.643
  248    HH   TYR  30           HH       TYR  30   3.808   2.389   2.389
  249    H    LYS  31           HN       LYS  31   5.834   9.753   9.753
  250    HA   LYS  31           HA       LYS  31   7.528  11.666  11.666
  251   1HB   LYS  31           HBR      LYS  31   7.105  11.819  11.819
  252   2HB   LYS  31           HBS      LYS  31   5.810  12.860  12.860
  253   1HG   LYS  31           HGR      LYS  31   7.267  14.449  14.449
  254   2HG   LYS  31           HGS      LYS  31   8.520  13.253  13.253
  255   1HD   LYS  31           HDR      LYS  31   9.462  14.449  14.449
  256   2HD   LYS  31           HDS      LYS  31   8.974  12.942  12.942
  257   1HE   LYS  31           HES      LYS  31   7.636  13.983  13.983
  258   2HE   LYS  31           HER      LYS  31   6.889  14.957  14.957
  259   1HZ   LYS  31           HZB      LYS  31   9.522  15.553  15.553
  260   2HZ   LYS  31           HZC      LYS  31   8.136  16.227  16.227
  261   3HZ   LYS  31           HZA      LYS  31   8.634  16.498  16.498
  262    H    LEU  32           HN       LEU  32   6.115  13.723  13.723
  263    HA   LEU  32           HA       LEU  32   3.903  12.671  12.671
  264   1HB   LEU  32           HBR      LEU  32   5.954  14.728  14.728
  265   2HB   LEU  32           HBS      LEU  32   4.350  15.372  15.372
  266    HG   LEU  32           HG       LEU  32   5.988  13.232  13.232
  267   1HD1  LEU  32           HMD      LEU  32   5.372  16.015  16.015
  268   2HD1  LEU  32           HMD      LEU  32   4.720  15.082  15.082
  269   3HD1  LEU  32           HMD      LEU  32   6.448  14.959  14.959
  270   1HD2  LEU  32           HMD      LEU  32   3.025  13.796  13.796
  271   2HD2  LEU  32           HMD      LEU  32   3.823  12.242  12.242
  272   3HD2  LEU  32           HMD      LEU  32   4.000  12.994  12.994
  273    H    LYS  33           HN       LYS  33   4.350  14.479  14.479
  274    HA   LYS  33           HA       LYS  33   1.591  15.546  15.546
  275   1HB   LYS  33           HBR      LYS  33   3.902  16.105  16.105
  276   2HB   LYS  33           HBS      LYS  33   2.991  15.004  15.004
  277   1HG   LYS  33           HGS      LYS  33   2.137  17.017  17.017
  278   2HG   LYS  33           HGR      LYS  33   0.981  16.635  16.635
  279   1HD   LYS  33           HDR      LYS  33   1.694  18.943  18.943
  280   2HD   LYS  33           HDS      LYS  33   2.156  18.098  18.098
  281   1HE   LYS  33           HES      LYS  33   3.873  19.667  19.667
  282   2HE   LYS  33           HER      LYS  33   4.429  17.991  17.991
  283   1HZ   LYS  33           HZC      LYS  33   4.026  17.589  17.589
  284   2HZ   LYS  33           HZA      LYS  33   3.609  19.152  19.152
  285   3HZ   LYS  33           HZB      LYS  33   5.132  18.770  18.770
  286    H    HIS  34           HN       DHI  34   3.491  12.693  12.693
  287    HA   HIS  34           HA       DHI  34   1.577  11.367  11.367
  288   1HB   HIS  34           HBR      DHI  34   3.875  11.184  11.184
  289   2HB   HIS  34           HBS      DHI  34   4.383  10.768  10.768
  290    HD2  HIS  34           HD2      DHI  34   1.544   8.765   8.765
  291    HE1  HIS  34           HE1      DHI  34   4.753   6.171   6.171
  292    HE2  HIS  34           HE2      DHI  34   2.403   6.325   6.325
  293    H    ILE  35           HN       ILE  35   2.538  11.401  11.401
  294    HA   ILE  35           HA       ILE  35   0.851   9.195   9.195
  295    HB   ILE  35           HB       ILE  35   2.691  10.522  10.522
  296   1HG1  ILE  35           HG1      ILE  35   0.079   9.809   9.809
  297   2HG1  ILE  35           HG1      ILE  35   1.214   8.610   8.610
  298   1HG2  ILE  35           HMG      ILE  35   0.364  12.385  12.385
  299   2HG2  ILE  35           HMG      ILE  35   1.383  12.082  12.082
  300   3HG2  ILE  35           HMG      ILE  35   2.117  12.719  12.719
  301   1HD1  ILE  35           HMD      ILE  35   2.621  10.460  10.460
  302   2HD1  ILE  35           HMD      ILE  35   1.242   9.735   9.735
  303   3HD1  ILE  35           HMD      ILE  35   2.476   8.686   8.686
  304    H    VAL  36           HN       VAL  36   0.472  12.718  12.718
  305    HA   VAL  36           HA       VAL  36  -2.154  12.802  12.802
  306    HB   VAL  36           HB       VAL  36  -0.676  14.652  14.652
  307   1HG1  VAL  36           HMG      VAL  36  -3.464  14.767  14.767
  308   2HG1  VAL  36           HMG      VAL  36  -2.522  16.249  16.249
  309   3HG1  VAL  36           HMG      VAL  36  -2.657  15.591  15.591
  310   1HG2  VAL  36           HMG      VAL  36  -0.187  14.135  14.135
  311   2HG2  VAL  36           HMG      VAL  36   0.247  15.626  15.626
  312   3HG2  VAL  36           HMG      VAL  36  -1.255  15.556  15.556
  313    H    TRP  37           HN       TRP  37  -0.853  12.117  12.117
  314    HA   TRP  37           HA       TRP  37  -3.287  11.673  11.673
  315   1HB   TRP  37           HBS      TRP  37  -1.272  11.689  11.689
  316   2HB   TRP  37           HBR      TRP  37  -0.557  10.400  10.400
  317    HD1  TRP  37           HD1      TRP  37  -3.117  10.887  10.887
  318    HE1  TRP  37           HE1      TRP  37  -3.786   8.599   8.599
  319    HE3  TRP  37           HE3      TRP  37  -0.627   7.933   7.933
  320    HZ2  TRP  37           HZ2      TRP  37  -3.377   5.900   5.900
  321    HZ3  TRP  37           HZ3      TRP  37  -0.764   5.500   5.500
  322    HH2  TRP  37           HH2      TRP  37  -1.980   4.499   4.499
  323    H    ALA  38           HN       ALA  38  -1.415   9.610   9.610
  324    HA   ALA  38           HA       ALA  38  -2.789   7.144   7.144
  325   1HB   ALA  38           HMB      ALA  38  -1.092   7.964   7.964
  326   2HB   ALA  38           HMB      ALA  38  -1.620   6.303   6.303
  327   3HB   ALA  38           HMB      ALA  38  -0.512   7.158   7.158
  328    H    SER  39           HN       SER  39  -2.596   8.988   8.988
  329    HA   SER  39           HA       SER  39  -4.935   7.832   7.832
  330   1HB   SER  39           HBR      SER  39  -3.486   8.640   8.640
  331   2HB   SER  39           HBS      SER  39  -3.258  10.205  10.205
  332    HG   SER  39           HG       SER  39  -5.112  11.015  11.015
  333    H    ARG  40           HN       ARG  40  -4.615  10.200  10.200
  334    HA   ARG  40           HA       ARG  40  -7.342  11.221  11.221
  335   1HB   ARG  40           HBR      ARG  40  -5.153  11.227  11.227
  336   2HB   ARG  40           HBS      ARG  40  -6.833  11.318  11.318
  337   1HG   ARG  40           HGS      ARG  40  -7.241  13.328  13.328
  338   2HG   ARG  40           HGR      ARG  40  -5.644  13.207  13.207
  339   1HD   ARG  40           HDS      ARG  40  -5.653  14.855  14.855
  340   2HD   ARG  40           HDR      ARG  40  -4.543  13.501  13.501
  341    HE   ARG  40           HE       ARG  40  -7.255  13.400  13.400
  342   1HH1  ARG  40           HH1      ARG  40  -3.864  14.235  14.235
  343   2HH1  ARG  40           HH1      ARG  40  -3.922  13.934  13.934
  344   1HH2  ARG  40           HH2      ARG  40  -7.257  12.890  12.890
  345   2HH2  ARG  40           HH2      ARG  40  -5.843  13.177  13.177
  346    H    GLU  41           HN       GLU  41  -5.748   8.883   8.883
  347    HA   GLU  41           HA       GLU  41  -8.117   8.026   8.026
  348   1HB   GLU  41           HBS      GLU  41  -5.489   7.768   7.768
  349   2HB   GLU  41           HBR      GLU  41  -5.745   6.243   6.243
  350   1HG   GLU  41           HGR      GLU  41  -5.624   5.896   5.896
  351   2HG   GLU  41           HGS      GLU  41  -7.373   5.947   5.947
  352    H    LEU  42           HN       LEU  42  -6.567   7.006   7.006
  353    HA   LEU  42           HA       LEU  42  -8.118   4.598   4.598
  354   1HB   LEU  42           HBR      LEU  42  -6.046   4.914   4.914
  355   2HB   LEU  42           HBS      LEU  42  -6.547   6.533   6.533
  356    HG   LEU  42           HG       LEU  42  -8.476   4.725   4.725
  357   1HD1  LEU  42           HMD      LEU  42  -5.866   3.467   3.467
  358   2HD1  LEU  42           HMD      LEU  42  -6.341   3.594   3.594
  359   3HD1  LEU  42           HMD      LEU  42  -7.411   2.772   2.772
  360   1HD2  LEU  42           HMD      LEU  42  -6.348   6.505   6.505
  361   2HD2  LEU  42           HMD      LEU  42  -8.103   6.478   6.478
  362   3HD2  LEU  42           HMD      LEU  42  -7.040   5.303   5.303
  363    H    GLU  43           HN       GLU  43  -8.175   7.824   7.824
  364    HA   GLU  43           HA       GLU  43 -10.508   7.449   7.449
  365   1HB   GLU  43           HBS      GLU  43 -10.392   9.631   9.631
  366   2HB   GLU  43           HBR      GLU  43  -8.799   9.141   9.141
  367   1HG   GLU  43           HGS      GLU  43  -8.978  11.283  11.283
  368   2HG   GLU  43           HGR      GLU  43  -8.746  10.336  10.336
  369    H    ARG  44           HN       ARG  44 -10.039   8.324   8.324
  370    HA   ARG  44           HA       ARG  44 -12.880   8.953   8.953
  371   1HB   ARG  44           HBR      ARG  44 -10.455   9.718   9.718
  372   2HB   ARG  44           HBS      ARG  44 -11.415   8.831   8.831
  373   1HG   ARG  44           HGR      ARG  44 -12.271  11.274  11.274
  374   2HG   ARG  44           HGS      ARG  44 -11.892  11.196  11.196
  375   1HD   ARG  44           HDR      ARG  44 -13.856  10.237  10.237
  376   2HD   ARG  44           HDS      ARG  44 -13.949   9.323   9.323
  377    HE   ARG  44           HE       ARG  44 -14.320  12.218  12.218
  378   1HH1  ARG  44           HH1      ARG  44 -15.763   9.001   9.001
  379   2HH1  ARG  44           HH1      ARG  44 -17.323   9.574   9.574
  380   1HH2  ARG  44           HH2      ARG  44 -16.405  12.945  12.945
  381   2HH2  ARG  44           HH2      ARG  44 -17.686  11.804  11.804
  382    H    PHE  45           HN       PHE  45 -10.898   6.198   6.198
  383    HA   PHE  45           HA       PHE  45 -12.514   4.580   4.580
  384   1HB   PHE  45           HBS      PHE  45 -10.346   4.084   4.084
  385   2HB   PHE  45           HBR      PHE  45 -11.656   2.873   2.873
  386    HD1  PHE  45           HD2      PHE  45 -10.005   4.712   4.712
  387    HD2  PHE  45           HD1      PHE  45 -11.212   1.031   1.031
  388    HE1  PHE  45           HE2      PHE  45  -9.122   3.486   3.486
  389    HE2  PHE  45           HE1      PHE  45 -10.355  -0.207  -0.207
  390    HZ   PHE  45           HZ       PHE  45  -9.259   1.012   1.012
  391    H    ALA  46           HN       ALA  46 -12.283   4.712   4.712
  392    HA   ALA  46           HA       ALA  46 -15.193   4.577   4.577
  393   1HB   ALA  46           HMB      ALA  46 -13.315   2.221   2.221
  394   2HB   ALA  46           HMB      ALA  46 -14.794   2.235   2.235
  395   3HB   ALA  46           HMB      ALA  46 -14.911   2.392   2.392
  396    H    VAL  47           HN       VAL  47 -12.536   5.914   5.914
  397    HA   VAL  47           HA       VAL  47 -12.450   4.903   4.903
  398    HB   VAL  47           HB       VAL  47 -10.121   5.722   5.722
  399   1HG1  VAL  47           HMG      VAL  47 -10.338   4.455   4.455
  400   2HG1  VAL  47           HMG      VAL  47  -8.912   4.180   4.180
  401   3HG1  VAL  47           HMG      VAL  47  -9.347   5.834   5.834
  402   1HG2  VAL  47           HMG      VAL  47 -11.322   2.988   2.988
  403   2HG2  VAL  47           HMG      VAL  47 -11.116   3.867   3.867
  404   3HG2  VAL  47           HMG      VAL  47  -9.689   3.270   3.270
  405    H    ASN  48           HN       ASN  48 -11.094   6.350   6.350
  406    HA   ASN  48           HA       ASN  48 -11.460   9.212   9.212
  407   1HB   ASN  48           HBS      ASN  48 -13.016   8.637   8.637
  408   2HB   ASN  48           HBR      ASN  48 -11.741   7.849   7.849
  409   1HD2  ASN  48           HD2      ASN  48 -12.424  11.860  11.860
  410   2HD2  ASN  48           HD2      ASN  48 -13.349  10.806  10.806
  411    HA   PRO  49           HA       PRO  49  -7.260   9.548   9.548
  412   1HB   PRO  49           HBR      PRO  49  -7.146  12.260  12.260
  413   2HB   PRO  49           HBS      PRO  49  -7.203  11.390  11.390
  414   1HG   PRO  49           HGR      PRO  49  -9.166  12.987  12.987
  415   2HG   PRO  49           HGS      PRO  49  -9.220  12.061  12.061
  416   1HD   PRO  49           HDR      PRO  49 -10.419  11.545  11.545
  417   2HD   PRO  49           HDS      PRO  49 -10.673  10.774  10.774
  418    H    GLY  50           HN       GLY  50  -8.487  11.667  11.667
  419   1HA   GLY  50           HAR      GLY  50  -6.237  11.558  11.558
  420   2HA   GLY  50           HAS      GLY  50  -7.928  11.887  11.887
  421    H    LEU  51           HN       LEU  51  -8.844   9.361   9.361
  422    HA   LEU  51           HA       LEU  51  -8.585   7.723   7.723
  423   1HB   LEU  51           HBR      LEU  51 -10.650   7.756   7.756
  424   2HB   LEU  51           HBS      LEU  51  -9.972   7.632   7.632
  425    HG   LEU  51           HG       LEU  51 -11.336   5.684   5.684
  426   1HD1  LEU  51           HMD      LEU  51  -9.480   5.698   5.698
  427   2HD1  LEU  51           HMD      LEU  51  -8.505   4.827   4.827
  428   3HD1  LEU  51           HMD      LEU  51 -10.045   4.135   4.135
  429   1HD2  LEU  51           HMD      LEU  51  -8.958   5.465   5.465
  430   2HD2  LEU  51           HMD      LEU  51 -10.695   5.467   5.467
  431   3HD2  LEU  51           HMD      LEU  51  -9.972   4.064   4.064
  432    H    LEU  52           HN       LEU  52  -7.477   7.289   7.289
  433    HA   LEU  52           HA       LEU  52  -5.789   5.072   5.072
  434   1HB   LEU  52           HBR      LEU  52  -5.917   4.812   4.812
  435   2HB   LEU  52           HBS      LEU  52  -6.791   6.352   6.352
  436    HG   LEU  52           HG       LEU  52  -5.011   6.140   6.140
  437   1HD1  LEU  52           HMD      LEU  52  -4.656   8.254   8.254
  438   2HD1  LEU  52           HMD      LEU  52  -3.674   8.215   8.215
  439   3HD1  LEU  52           HMD      LEU  52  -5.451   8.369   8.369
  440   1HD2  LEU  52           HMD      LEU  52  -3.618   4.757   4.757
  441   2HD2  LEU  52           HMD      LEU  52  -2.811   5.732   5.732
  442   3HD2  LEU  52           HMD      LEU  52  -2.935   6.353   6.353
  443    H    GLU  53           HN       GLU  53  -5.521   8.469   8.469
  444    HA   GLU  53           HA       GLU  53  -2.699   8.719   8.719
  445   1HB   GLU  53           HBS      GLU  53  -3.670  10.630  10.630
  446   2HB   GLU  53           HBR      GLU  53  -5.077  10.208  10.208
  447   1HG   GLU  53           HGS      GLU  53  -4.082  10.794  10.794
  448   2HG   GLU  53           HGR      GLU  53  -2.532  11.173  11.173
  449    H    THR  54           HN       THR  54  -4.976   7.811   7.811
  450    HA   THR  54           HA       THR  54  -2.829   7.211   7.211
  451    HB   THR  54           HB       THR  54  -4.517   6.171   6.171
  452    HG1  THR  54           HG1      THR  54  -6.073   6.592   6.592
  453   1HG2  THR  54           HMG      THR  54  -4.612   8.765   8.765
  454   2HG2  THR  54           HMG      THR  54  -6.198   8.388   8.388
  455   3HG2  THR  54           HMG      THR  54  -5.854   7.928   7.928
  456    H    SER  55           HN       SER  55  -2.300   5.035   5.035
  457    HA   SER  55           HA       SER  55  -1.916   3.128   3.128
  458   1HB   SER  55           HBR      SER  55  -1.943   1.563   1.563
  459   2HB   SER  55           HBS      SER  55  -0.568   2.606   2.606
  460    HG   SER  55           HG       SER  55  -2.779   3.282   3.282
  461    H    GLU  56           HN       GLU  56  -4.576   3.637   3.637
  462    HA   GLU  56           HA       GLU  56  -5.618   1.006   1.006
  463   1HB   GLU  56           HBR      GLU  56  -6.057   3.389   3.389
  464   2HB   GLU  56           HBS      GLU  56  -7.429   3.262   3.262
  465   1HG   GLU  56           HGR      GLU  56  -7.887   1.003   1.003
  466   2HG   GLU  56           HGS      GLU  56  -6.610   1.488   1.488
  467    H    GLY  57           HN       GLY  57  -6.409   3.996   3.996
  468   1HA   GLY  57           HAR      GLY  57  -8.567   2.836   2.836
  469   2HA   GLY  57           HAS      GLY  57  -7.739   4.385   4.385
  470    H    CYS  58           HN       CYS  58  -5.092   3.500   3.500
  471    HA   CYS  58           HA       CYS  58  -4.861   2.521   2.521
  472   1HB   CYS  58           HBR      CYS  58  -3.165   3.736   3.736
  473   2HB   CYS  58           HBS      CYS  58  -2.664   2.068   2.068
  474    H    ARG  59           HN       ARG  59  -5.027   0.840   0.840
  475    HA   ARG  59           HA       ARG  59  -4.483  -1.735  -1.735
  476   1HB   ARG  59           HBS      ARG  59  -4.249  -1.204  -1.204
  477   2HB   ARG  59           HBR      ARG  59  -6.014  -0.962  -0.962
  478   1HG   ARG  59           HGS      ARG  59  -5.263  -3.147  -3.147
  479   2HG   ARG  59           HGR      ARG  59  -6.419  -3.297  -3.297
  480   1HD   ARG  59           HDS      ARG  59  -4.973  -4.654  -4.654
  481   2HD   ARG  59           HDR      ARG  59  -3.917  -3.233  -3.233
  482    HE   ARG  59           HE       ARG  59  -3.749  -4.854  -4.854
  483   1HH1  ARG  59           HH1      ARG  59  -2.276  -3.752  -3.752
  484   2HH1  ARG  59           HH1      ARG  59  -0.658  -3.959  -3.959
  485   1HH2  ARG  59           HH2      ARG  59  -1.621  -5.093  -5.093
  486   2HH2  ARG  59           HH2      ARG  59  -0.290  -4.783  -4.783
  487    H    GLN  60           HN       GLN  60  -7.427   0.157   0.157
  488    HA   GLN  60           HA       GLN  60  -9.256  -2.129  -2.129
  489   1HB   GLN  60           HBS      GLN  60  -9.923  -0.107  -0.107
  490   2HB   GLN  60           HBR      GLN  60  -9.866   0.829   0.829
  491   1HG   GLN  60           HGR      GLN  60 -11.967   0.260   0.260
  492   2HG   GLN  60           HGS      GLN  60 -11.451  -1.444  -1.444
  493   1HE2  GLN  60           HE2      GLN  60 -12.476  -2.395  -2.395
  494   2HE2  GLN  60           HE2      GLN  60 -11.331  -2.705  -2.705
  495    H    ILE  61           HN       ILE  61  -7.514   0.240   0.240
  496    HA   ILE  61           HA       ILE  61  -8.722  -0.568  -0.568
  497    HB   ILE  61           HB       ILE  61  -6.152   1.010   1.010
  498   1HG1  ILE  61           HG1      ILE  61  -7.834   2.364   2.364
  499   2HG1  ILE  61           HG1      ILE  61  -7.625   2.912   2.912
  500   1HG2  ILE  61           HMG      ILE  61  -6.330  -0.266  -0.266
  501   2HG2  ILE  61           HMG      ILE  61  -7.541   0.970   0.970
  502   3HG2  ILE  61           HMG      ILE  61  -5.880   1.460   1.460
  503   1HD1  ILE  61           HMD      ILE  61  -9.769   0.921   0.921
  504   2HD1  ILE  61           HMD      ILE  61 -10.004   2.677   2.677
  505   3HD1  ILE  61           HMD      ILE  61  -9.669   1.992   1.992
  506    H    LEU  62           HN       LEU  62  -5.426  -1.043  -1.043
  507    HA   LEU  62           HA       LEU  62  -4.521  -2.503  -2.503
  508   1HB   LEU  62           HBR      LEU  62  -3.349  -1.346  -1.346
  509   2HB   LEU  62           HBS      LEU  62  -3.487  -2.952  -2.952
  510    HG   LEU  62           HG       LEU  62  -2.085  -3.938  -3.938
  511   1HD1  LEU  62           HMD      LEU  62  -2.885  -2.181  -2.181
  512   2HD1  LEU  62           HMD      LEU  62  -1.504  -1.232  -1.232
  513   3HD1  LEU  62           HMD      LEU  62  -1.238  -2.854  -2.854
  514   1HD2  LEU  62           HMD      LEU  62  -1.192  -1.462  -1.462
  515   2HD2  LEU  62           HMD      LEU  62  -0.824  -3.174  -3.174
  516   3HD2  LEU  62           HMD      LEU  62  -0.045  -2.343  -2.343
  517    H    GLY  63           HN       GLY  63  -6.487  -3.495  -3.495
  518   1HA   GLY  63           HAS      GLY  63  -6.265  -6.354  -6.354
  519   2HA   GLY  63           HAR      GLY  63  -7.471  -5.545  -5.545
  520    H    GLN  64           HN       GLN  64  -8.883  -3.931  -3.931
  521    HA   GLN  64           HA       GLN  64 -10.545  -5.616  -5.616
  522   1HB   GLN  64           HBR      GLN  64 -10.795  -3.105  -3.105
  523   2HB   GLN  64           HBS      GLN  64 -10.764  -2.776  -2.776
  524   1HG   GLN  64           HGS      GLN  64 -12.483  -4.827  -4.827
  525   2HG   GLN  64           HGR      GLN  64 -12.777  -4.216  -4.216
  526   1HE2  GLN  64           HE2      GLN  64 -13.909  -2.103  -2.103
  527   2HE2  GLN  64           HE2      GLN  64 -12.788  -3.420  -3.420
  528    H    LEU  65           HN       LEU  65  -7.621  -4.074  -4.074
  529    HA   LEU  65           HA       LEU  65  -8.385  -3.585  -3.585
  530   1HB   LEU  65           HBR      LEU  65  -7.301  -2.012  -2.012
  531   2HB   LEU  65           HBS      LEU  65  -5.791  -2.888  -2.888
  532    HG   LEU  65           HG       LEU  65  -6.120  -2.200  -2.200
  533   1HD1  LEU  65           HMD      LEU  65  -8.506  -0.987  -0.987
  534   2HD1  LEU  65           HMD      LEU  65  -7.549   0.129   0.129
  535   3HD1  LEU  65           HMD      LEU  65  -8.165  -1.390  -1.390
  536   1HD2  LEU  65           HMD      LEU  65  -4.906  -1.020  -1.020
  537   2HD2  LEU  65           HMD      LEU  65  -4.782  -0.431  -0.431
  538   3HD2  LEU  65           HMD      LEU  65  -5.955   0.308   0.308
  539    H    GLN  66           HN       GLN  66  -6.034  -5.460  -5.460
  540    HA   GLN  66           HA       GLN  66  -4.478  -6.436  -6.436
  541   1HB   GLN  66           HBR      GLN  66  -5.077  -7.252  -7.252
  542   2HB   GLN  66           HBS      GLN  66  -4.856  -8.677  -8.677
  543   1HG   GLN  66           HGS      GLN  66  -2.799  -6.824  -6.824
  544   2HG   GLN  66           HGR      GLN  66  -2.889  -6.939  -6.939
  545   1HE2  GLN  66           HE2      GLN  66  -2.373 -10.578 -10.578
  546   2HE2  GLN  66           HE2      GLN  66  -3.558  -9.471  -9.471
  547    HA   PRO  67           HA       PRO  67  -7.943  -9.795  -9.795
  548   1HB   PRO  67           HBR      PRO  67 -10.192  -8.605  -8.605
  549   2HB   PRO  67           HBS      PRO  67  -9.716 -10.174 -10.174
  550   1HG   PRO  67           HGS      PRO  67  -9.616  -8.457  -8.457
  551   2HG   PRO  67           HGR      PRO  67  -8.760  -9.889  -9.889
  552   1HD   PRO  67           HDS      PRO  67  -7.809  -7.265  -7.265
  553   2HD   PRO  67           HDR      PRO  67  -6.951  -8.631  -8.631
  554    H    SER  68           HN       SER  68  -8.748  -6.434  -6.434
  555    HA   SER  68           HA       SER  68 -10.599  -6.478  -6.478
  556   1HB   SER  68           HBS      SER  68  -9.572  -4.484  -4.484
  557   2HB   SER  68           HBR      SER  68 -10.006  -3.841  -3.841
  558    HG   SER  68           HG       SER  68 -11.953  -3.833  -3.833
  559    H    LEU  69           HN       LEU  69  -7.206  -6.403  -6.403
  560    HA   LEU  69           HA       LEU  69  -6.625  -4.596  -4.596
  561   1HB   LEU  69           HBR      LEU  69  -5.098  -6.771  -6.771
  562   2HB   LEU  69           HBS      LEU  69  -4.377  -5.734  -5.734
  563    HG   LEU  69           HG       LEU  69  -5.563  -4.715  -4.715
  564   1HD1  LEU  69           HMD      LEU  69  -3.176  -6.111  -6.111
  565   2HD1  LEU  69           HMD      LEU  69  -2.689  -4.400  -4.400
  566   3HD1  LEU  69           HMD      LEU  69  -3.591  -5.008  -5.008
  567   1HD2  LEU  69           HMD      LEU  69  -5.470  -3.308  -3.308
  568   2HD2  LEU  69           HMD      LEU  69  -4.753  -2.618  -2.618
  569   3HD2  LEU  69           HMD      LEU  69  -3.702  -3.323  -3.323
  570    H    GLN  70           HN       GLN  70  -7.166  -8.078  -8.078
  571    HA   GLN  70           HA       GLN  70  -6.600  -8.831  -8.831
  572   1HB   GLN  70           HBR      GLN  70  -7.903 -10.766 -10.766
  573   2HB   GLN  70           HBS      GLN  70  -7.100 -10.394 -10.394
  574   1HG   GLN  70           HGS      GLN  70  -9.047 -10.274 -10.274
  575   2HG   GLN  70           HGR      GLN  70  -9.729  -9.171  -9.171
  576   1HE2  GLN  70           HE2      GLN  70 -10.790 -12.014 -12.014
  577   2HE2  GLN  70           HE2      GLN  70  -9.849 -10.569 -10.569
  578    H    THR  71           HN       THR  71  -9.060  -6.793  -6.793
  579    HA   THR  71           HA       THR  71 -10.549  -6.896  -6.896
  580    HB   THR  71           HB       THR  71 -11.721  -8.456  -8.456
  581    HG1  THR  71           HG1      THR  71 -12.803  -7.151  -7.151
  582   1HG2  THR  71           HMG      THR  71 -10.568  -7.642  -7.642
  583   2HG2  THR  71           HMG      THR  71 -11.999  -6.594  -6.594
  584   3HG2  THR  71           HMG      THR  71 -12.196  -8.364  -8.364
  585    H    GLY  72           HN       GLY  72  -8.783  -4.945  -4.945
  586   1HA   GLY  72           HAR      GLY  72 -10.504  -2.588  -2.588
  587   2HA   GLY  72           HAS      GLY  72  -8.963  -2.631  -2.631
  588    H    SER  73           HN       SER  73  -6.999  -3.104  -3.104
  589    HA   SER  73           HA       SER  73  -6.774  -3.243  -3.243
  590   1HB   SER  73           HBS      SER  73  -6.042  -0.939  -0.939
  591   2HB   SER  73           HBR      SER  73  -7.799  -1.161  -1.161
  592    HG   SER  73           HG       SER  73  -7.892   0.224   0.224
  593    H    GLU  74           HN       GLU  74  -4.561  -2.630  -2.630
  594    HA   GLU  74           HA       GLU  74  -2.367  -2.930  -2.930
  595   1HB   GLU  74           HBR      GLU  74  -1.090  -2.755  -2.755
  596   2HB   GLU  74           HBS      GLU  74  -2.517  -3.415  -3.415
  597   1HG   GLU  74           HGR      GLU  74  -3.144  -1.651  -1.651
  598   2HG   GLU  74           HGS      GLU  74  -2.120  -0.554  -0.554
  599    H    GLU  75           HN       GLU  75  -4.490  -0.382  -0.382
  600    HA   GLU  75           HA       GLU  75  -2.895   1.786   1.786
  601   1HB   GLU  75           HBS      GLU  75  -4.311   2.391   2.391
  602   2HB   GLU  75           HBR      GLU  75  -5.479   1.238   1.238
  603   1HG   GLU  75           HGR      GLU  75  -5.341   3.479   3.479
  604   2HG   GLU  75           HGS      GLU  75  -5.660   3.851   3.851
  605    H    LEU  76           HN       LEU  76  -5.238  -0.430  -0.430
  606    HA   LEU  76           HA       LEU  76  -5.308   0.890   0.890
  607   1HB   LEU  76           HBS      LEU  76  -6.803  -1.038  -1.038
  608   2HB   LEU  76           HBR      LEU  76  -5.796  -2.011  -2.011
  609    HG   LEU  76           HG       LEU  76  -7.831   0.115   0.115
  610   1HD1  LEU  76           HMD      LEU  76  -7.637  -2.826  -2.826
  611   2HD1  LEU  76           HMD      LEU  76  -8.227  -2.070  -2.070
  612   3HD1  LEU  76           HMD      LEU  76  -9.066  -1.760  -1.760
  613   1HD2  LEU  76           HMD      LEU  76  -5.542   0.131   0.131
  614   2HD2  LEU  76           HMD      LEU  76  -7.080   0.202   0.202
  615   3HD2  LEU  76           HMD      LEU  76  -6.193  -1.338  -1.338
  616    H    ARG  77           HN       ARG  77  -3.176  -1.108  -1.108
  617    HA   ARG  77           HA       ARG  77  -1.793  -2.371  -2.371
  618   1HB   ARG  77           HBR      ARG  77  -1.824  -2.898  -2.898
  619   2HB   ARG  77           HBS      ARG  77  -0.407  -1.808  -1.808
  620   1HG   ARG  77           HGR      ARG  77   0.844  -3.253  -3.253
  621   2HG   ARG  77           HGS      ARG  77  -0.603  -4.147  -4.147
  622   1HD   ARG  77           HDS      ARG  77  -0.769  -5.346  -5.346
  623   2HD   ARG  77           HDR      ARG  77   0.092  -4.114  -4.114
  624    HE   ARG  77           HE       ARG  77   2.108  -5.097  -5.097
  625   1HH1  ARG  77           HH1      ARG  77  -0.346  -6.200  -6.200
  626   2HH1  ARG  77           HH1      ARG  77   0.624  -7.514  -7.514
  627   1HH2  ARG  77           HH2      ARG  77   3.296  -6.901  -6.901
  628   2HH2  ARG  77           HH2      ARG  77   2.686  -7.910  -7.910
  629    H    SER  78           HN       SER  78  -1.309   0.574   0.574
  630    HA   SER  78           HA       SER  78   0.925   1.512   1.512
  631   1HB   SER  78           HBS      SER  78   0.475   2.426   2.426
  632   2HB   SER  78           HBR      SER  78  -1.147   2.987   2.987
  633    HG   SER  78           HG       SER  78   1.516   3.831   3.831
  634    H    LEU  79           HN       LEU  79  -2.577   1.976   1.976
  635    HA   LEU  79           HA       LEU  79  -2.474   3.640   3.640
  636   1HB   LEU  79           HBS      LEU  79  -4.399   1.800   1.800
  637   2HB   LEU  79           HBR      LEU  79  -4.726   2.216   2.216
  638    HG   LEU  79           HG       LEU  79  -5.017   4.498   4.498
  639   1HD1  LEU  79           HMD      LEU  79  -3.143   4.091   4.091
  640   2HD1  LEU  79           HMD      LEU  79  -4.655   4.426   4.426
  641   3HD1  LEU  79           HMD      LEU  79  -4.047   5.591   5.591
  642   1HD2  LEU  79           HMD      LEU  79  -6.792   2.820   2.820
  643   2HD2  LEU  79           HMD      LEU  79  -6.880   4.410   4.410
  644   3HD2  LEU  79           HMD      LEU  79  -6.213   3.009   3.009
  645    H    TYR  80           HN       TYR  80  -2.413   0.090   0.090
  646    HA   TYR  80           HA       TYR  80  -2.521  -0.479  -0.479
  647   1HB   TYR  80           HBS      TYR  80  -3.132  -2.151  -2.151
  648   2HB   TYR  80           HBR      TYR  80  -1.475  -2.136  -2.136
  649    HD1  TYR  80           HD1      TYR  80  -3.483  -3.075  -3.075
  650    HD2  TYR  80           HD2      TYR  80   0.254  -3.415  -3.415
  651    HE1  TYR  80           HE1      TYR  80  -2.798  -4.818  -4.818
  652    HE2  TYR  80           HE2      TYR  80   0.910  -5.228  -5.228
  653    HH   TYR  80           HH       TYR  80  -0.773  -6.979  -6.979
  654    H    ASN  81           HN       ASN  81   0.194  -0.441  -0.441
  655    HA   ASN  81           HA       ASN  81   2.091  -1.367  -1.367
  656   1HB   ASN  81           HBS      ASN  81   3.733  -1.159  -1.159
  657   2HB   ASN  81           HBR      ASN  81   2.248  -1.694  -1.694
  658   1HD2  ASN  81           HD2      ASN  81   4.065   1.066   1.066
  659   2HD2  ASN  81           HD2      ASN  81   4.572  -0.447  -0.447
  660    H    THR  82           HN       THR  82   1.181   1.833   1.833
  661    HA   THR  82           HA       THR  82   2.962   3.160   3.160
  662    HB   THR  82           HB       THR  82   0.640   4.217   4.217
  663    HG1  THR  82           HG1      THR  82   2.154   3.325   3.325
  664   1HG2  THR  82           HMG      THR  82   1.453   5.591   5.591
  665   2HG2  THR  82           HMG      THR  82   2.788   6.021   6.021
  666   3HG2  THR  82           HMG      THR  82   1.103   6.380   6.380
  667    H    ILE  83           HN       ILE  83  -0.174   1.796   1.796
  668    HA   ILE  83           HA       ILE  83  -0.792   3.233   3.233
  669    HB   ILE  83           HB       ILE  83  -2.008   1.046   1.046
  670   1HG1  ILE  83           HG1      ILE  83  -2.501   3.420   3.420
  671   2HG1  ILE  83           HG1      ILE  83  -3.950   2.470   2.470
  672   1HG2  ILE  83           HMG      ILE  83  -2.093   0.685   0.685
  673   2HG2  ILE  83           HMG      ILE  83  -3.685   1.258   1.258
  674   3HG2  ILE  83           HMG      ILE  83  -2.959  -0.198  -0.198
  675   1HD1  ILE  83           HMD      ILE  83  -2.468   3.603   3.603
  676   2HD1  ILE  83           HMD      ILE  83  -3.165   4.827   4.827
  677   3HD1  ILE  83           HMD      ILE  83  -4.219   3.601   3.601
  678    H    ALA  84           HN       ALA  84   0.554  -0.016  -0.016
  679    HA   ALA  84           HA       ALA  84   0.786  -0.768  -0.768
  680   1HB   ALA  84           HMB      ALA  84   1.520  -1.855  -1.855
  681   2HB   ALA  84           HMB      ALA  84   2.919  -1.976  -1.976
  682   3HB   ALA  84           HMB      ALA  84   1.349  -2.669  -2.669
  683    H    VAL  85           HN       VAL  85   2.928   1.112   1.112
  684    HA   VAL  85           HA       VAL  85   5.065   1.418   1.418
  685    HB   VAL  85           HB       VAL  85   4.130   3.102   3.102
  686   1HG1  VAL  85           HMG      VAL  85   5.375   4.354   4.354
  687   2HG1  VAL  85           HMG      VAL  85   6.809   3.524   3.524
  688   3HG1  VAL  85           HMG      VAL  85   5.853   4.603   4.603
  689   1HG2  VAL  85           HMG      VAL  85   5.247   0.751   0.751
  690   2HG2  VAL  85           HMG      VAL  85   5.749   2.098   2.098
  691   3HG2  VAL  85           HMG      VAL  85   6.740   1.651   1.651
  692    H    LEU  86           HN       LEU  86   2.261   3.496   3.496
  693    HA   LEU  86           HA       LEU  86   2.831   5.410   5.410
  694   1HB   LEU  86           HBS      LEU  86   1.367   5.548   5.548
  695   2HB   LEU  86           HBR      LEU  86   0.084   4.783   4.783
  696    HG   LEU  86           HG       LEU  86  -0.167   6.657   6.657
  697   1HD1  LEU  86           HMD      LEU  86   2.471   7.601   7.601
  698   2HD1  LEU  86           HMD      LEU  86   1.342   8.680   8.680
  699   3HD1  LEU  86           HMD      LEU  86   2.054   7.283   7.283
  700   1HD2  LEU  86           HMD      LEU  86   0.210   7.164   7.164
  701   2HD2  LEU  86           HMD      LEU  86  -1.271   7.199   7.199
  702   3HD2  LEU  86           HMD      LEU  86  -0.117   8.556   8.556
  703    H    TYR  87           HN       TYR  87   1.138   2.351   2.351
  704    HA   TYR  87           HA       TYR  87   0.603   2.560   2.560
  705   1HB   TYR  87           HBS      TYR  87  -0.237   0.761   0.761
  706   2HB   TYR  87           HBR      TYR  87   1.322  -0.064  -0.064
  707    HD1  TYR  87           HD1      TYR  87   1.915   0.028   0.028
  708    HD2  TYR  87           HD2      TYR  87  -2.010   0.352   0.352
  709    HE1  TYR  87           HE1      TYR  87   0.982  -0.637  -0.637
  710    HE2  TYR  87           HE2      TYR  87  -2.950  -0.003  -0.003
  711    HH   TYR  87           HH       TYR  87  -1.782  -1.792  -1.792
  712    H    CYS  88           HN       CYS  88   3.449   1.380   1.380
  713    HA   CYS  88           HA       CYS  88   4.979   0.507   0.507
  714   1HB   CYS  88           HBS      CYS  88   5.275   0.817   0.817
  715   2HB   CYS  88           HBR      CYS  88   6.568   1.817   1.817
  716    H    VAL  89           HN       VAL  89   4.532   3.722   3.722
  717    HA   VAL  89           HA       VAL  89   6.554   4.897   4.897
  718    HB   VAL  89           HB       VAL  89   4.385   6.342   6.342
  719   1HG1  VAL  89           HMG      VAL  89   7.176   7.080   7.080
  720   2HG1  VAL  89           HMG      VAL  89   6.325   7.945   7.945
  721   3HG1  VAL  89           HMG      VAL  89   5.638   7.909   7.909
  722   1HG2  VAL  89           HMG      VAL  89   6.366   4.528   4.528
  723   2HG2  VAL  89           HMG      VAL  89   5.052   5.396   5.396
  724   3HG2  VAL  89           HMG      VAL  89   6.634   6.180   6.180
  725    H    HIS  90           HN       HIS  90   2.992   4.871   4.871
  726    HA   HIS  90           HA       HIS  90   2.749   6.769   6.769
  727   1HB   HIS  90           HBS      HIS  90   0.800   4.563   4.563
  728   2HB   HIS  90           HBR      HIS  90   0.455   5.888   5.888
  729    HD1  HIS  90           HD1      HIS  90   1.632   8.292   8.292
  730    HD2  HIS  90           HD2      HIS  90  -0.847   5.327   5.327
  731    HE1  HIS  90           HE1      HIS  90   0.470   9.306   9.306
  732    HE2  HIS  90           HE2      HIS  90  -1.046   7.522   7.522
  733    H    GLN  91           HN       GLN  91   3.344   3.321   3.321
  734    HA   GLN  91           HA       GLN  91   2.607   2.735   2.735
  735   1HB   GLN  91           HBS      GLN  91   2.687   0.952   0.952
  736   2HB   GLN  91           HBR      GLN  91   4.425   1.250   1.250
  737   1HG   GLN  91           HGS      GLN  91   3.982  -0.708  -0.708
  738   2HG   GLN  91           HGR      GLN  91   4.955   0.556   0.556
  739   1HE2  GLN  91           HE2      GLN  91   2.880  -0.015  -0.015
  740   2HE2  GLN  91           HE2      GLN  91   4.391  -0.406  -0.406
  741    H    ARG  92           HN       ARG  92   5.650   3.529   3.529
  742    HA   ARG  92           HA       ARG  92   7.302   4.299   4.299
  743   1HB   ARG  92           HBR      ARG  92   6.436   1.729   1.729
  744   2HB   ARG  92           HBS      ARG  92   8.050   1.488   1.488
  745   1HG   ARG  92           HGS      ARG  92   7.332   3.252   3.252
  746   2HG   ARG  92           HGR      ARG  92   8.279   1.738   1.738
  747   1HD   ARG  92           HDR      ARG  92  10.128   2.716   2.716
  748   2HD   ARG  92           HDS      ARG  92   9.190   3.978   3.978
  749    HE   ARG  92           HE       ARG  92   9.617   5.317   5.317
  750   1HH1  ARG  92           HH1      ARG  92   9.790   1.970   1.970
  751   2HH1  ARG  92           HH1      ARG  92   9.972   2.411   2.411
  752   1HH2  ARG  92           HH2      ARG  92   9.723   5.851   5.851
  753   2HH2  ARG  92           HH2      ARG  92   9.930   4.607   4.607
  754    H    ILE  93           HN       ILE  93   7.012   1.796   1.796
  755    HA   ILE  93           HA       ILE  93   9.871   1.486   1.486
  756    HB   ILE  93           HB       ILE  93   7.567   0.602   0.602
  757   1HG1  ILE  93           HG1      ILE  93   8.188  -1.627  -1.627
  758   2HG1  ILE  93           HG1      ILE  93   8.469  -0.344  -0.344
  759   1HG2  ILE  93           HMG      ILE  93  10.465  -0.089  -0.089
  760   2HG2  ILE  93           HMG      ILE  93   9.303  -1.385  -1.385
  761   3HG2  ILE  93           HMG      ILE  93   9.370   0.086   0.086
  762   1HD1  ILE  93           HMD      ILE  93   5.967  -0.018  -0.018
  763   2HD1  ILE  93           HMD      ILE  93   6.049  -1.531  -1.531
  764   3HD1  ILE  93           HMD      ILE  93   6.278   0.040   0.040
  765    H    ASP  94           HN       ASP  94  11.144   2.254   2.254
  766    HA   ASP  94           HA       ASP  94   9.811   3.905   3.905
  767   1HB   ASP  94           HBS      ASP  94  11.778   5.266   5.266
  768   2HB   ASP  94           HBR      ASP  94  11.081   5.468   5.468
  769    H    VAL  95           HN       VAL  95  10.530   3.637   3.637
  770    HA   VAL  95           HA       VAL  95  12.313   1.300   1.300
  771    HB   VAL  95           HB       VAL  95  10.722   0.328   0.328
  772   1HG1  VAL  95           HMG      VAL  95   9.349   1.607   1.607
  773   2HG1  VAL  95           HMG      VAL  95   8.593   0.352   0.352
  774   3HG1  VAL  95           HMG      VAL  95  10.093  -0.006  -0.006
  775   1HG2  VAL  95           HMG      VAL  95   9.886   2.982   2.982
  776   2HG2  VAL  95           HMG      VAL  95   9.469   1.445   1.445
  777   3HG2  VAL  95           HMG      VAL  95   8.471   2.051   2.051
  778    H    LYS  96           HN       LYS  96  12.266   1.119   1.119
  779    HA   LYS  96           HA       LYS  96  13.762   3.572   3.572
  780   1HB   LYS  96           HBS      LYS  96  14.694   0.919   0.919
  781   2HB   LYS  96           HBR      LYS  96  15.580   2.459   2.459
  782   1HG   LYS  96           HGS      LYS  96  14.748   1.361   1.361
  783   2HG   LYS  96           HGR      LYS  96  15.743   0.201   0.201
  784   1HD   LYS  96           HDS      LYS  96  16.696   3.007   3.007
  785   2HD   LYS  96           HDR      LYS  96  16.639   2.211   2.211
  786   1HE   LYS  96           HES      LYS  96  18.778   1.745   1.745
  787   2HE   LYS  96           HER      LYS  96  17.868   0.271   0.271
  788   1HZ   LYS  96           HZB      LYS  96  18.267   2.458   2.458
  789   2HZ   LYS  96           HZC      LYS  96  19.369   1.266   1.266
  790   3HZ   LYS  96           HZA      LYS  96  17.848   0.908   0.908
  791    H    ASP  97           HN       ASP  97  12.829   0.389   0.389
  792    HA   ASP  97           HA       ASP  97  11.153   1.847   1.847
  793   1HB   ASP  97           HBS      ASP  97  11.562   0.173   0.173
  794   2HB   ASP  97           HBR      ASP  97  13.125   0.484   0.484
  795    H    THR  98           HN       THR  98   9.232   0.637   0.637
  796    HA   THR  98           HA       THR  98   7.440   0.160   0.160
  797    HB   THR  98           HB       THR  98   7.254   0.328   0.328
  798    HG1  THR  98           HG1      THR  98   5.974   0.802   0.802
  799   1HG2  THR  98           HMG      THR  98   7.882  -2.131  -2.131
  800   2HG2  THR  98           HMG      THR  98   6.274  -2.506  -2.506
  801   3HG2  THR  98           HMG      THR  98   6.417  -1.517  -1.517
  802    H    LYS  99           HN       LYS  99   9.492  -2.360  -2.360
  803    HA   LYS  99           HA       LYS  99   7.957  -4.552  -4.552
  804   1HB   LYS  99           HBR      LYS  99  10.631  -4.315  -4.315
  805   2HB   LYS  99           HBS      LYS  99  10.121  -5.838  -5.838
  806   1HG   LYS  99           HGR      LYS  99   8.710  -4.383  -4.383
  807   2HG   LYS  99           HGS      LYS  99   9.600  -5.929  -5.929
  808   1HD   LYS  99           HDR      LYS  99   7.778  -7.022  -7.022
  809   2HD   LYS  99           HDS      LYS  99   7.719  -6.330  -6.330
  810   1HE   LYS  99           HES      LYS  99   5.641  -5.777  -5.777
  811   2HE   LYS  99           HER      LYS  99   6.583  -4.316  -4.316
  812   1HZ   LYS  99           HZB      LYS  99   6.713  -6.301  -6.301
  813   2HZ   LYS  99           HZC      LYS  99   5.173  -5.837  -5.837
  814   3HZ   LYS  99           HZA      LYS  99   6.300  -4.726  -4.726
  815    H    GLU 100           HN       GLU 100  10.459  -2.451  -2.451
  816    HA   GLU 100           HA       GLU 100  11.362  -4.182  -4.182
  817   1HB   GLU 100           HBS      GLU 100  12.762  -2.664  -2.664
  818   2HB   GLU 100           HBR      GLU 100  11.708  -1.368  -1.368
  819   1HG   GLU 100           HGS      GLU 100  13.839  -1.538  -1.538
  820   2HG   GLU 100           HGR      GLU 100  12.421  -0.748  -0.748
  821    H    ALA 101           HN       ALA 101   9.211  -1.335  -1.335
  822    HA   ALA 101           HA       ALA 101   8.190  -1.463  -1.463
  823   1HB   ALA 101           HMB      ALA 101   7.861   0.222   0.222
  824   2HB   ALA 101           HMB      ALA 101   6.326  -0.682  -0.682
  825   3HB   ALA 101           HMB      ALA 101   6.838   0.189   0.189
  826    H    LEU 102           HN       LEU 102   6.986  -2.732  -2.732
  827    HA   LEU 102           HA       LEU 102   4.660  -3.839  -3.839
  828   1HB   LEU 102           HBS      LEU 102   5.200  -3.278  -3.278
  829   2HB   LEU 102           HBR      LEU 102   6.155  -4.785  -4.785
  830    HG   LEU 102           HG       LEU 102   4.219  -6.133  -6.133
  831   1HD1  LEU 102           HMD      LEU 102   3.107  -4.532  -4.532
  832   2HD1  LEU 102           HMD      LEU 102   2.504  -3.655  -3.655
  833   3HD1  LEU 102           HMD      LEU 102   2.047  -5.357  -5.357
  834   1HD2  LEU 102           HMD      LEU 102   4.762  -4.527  -4.527
  835   2HD2  LEU 102           HMD      LEU 102   3.480  -5.765  -5.765
  836   3HD2  LEU 102           HMD      LEU 102   3.073  -4.060  -4.060
  837    H    ASP 103           HN       ASP 103   7.905  -4.995  -4.995
  838    HA   ASP 103           HA       ASP 103   7.232  -7.703  -7.703
  839   1HB   ASP 103           HBR      ASP 103   9.441  -6.854  -6.854
  840   2HB   ASP 103           HBS      ASP 103   9.840  -6.378  -6.378
  841    H    LYS 104           HN       LYS 104   8.635  -4.951  -4.951
  842    HA   LYS 104           HA       LYS 104   8.184  -5.963  -5.963
  843   1HB   LYS 104           HBR      LYS 104   9.293  -3.678  -3.678
  844   2HB   LYS 104           HBS      LYS 104   7.772  -3.047  -3.047
  845   1HG   LYS 104           HGR      LYS 104   8.547  -3.214  -3.214
  846   2HG   LYS 104           HGS      LYS 104   9.082  -4.899  -4.899
  847   1HD   LYS 104           HDS      LYS 104  10.741  -2.772  -2.772
  848   2HD   LYS 104           HDR      LYS 104  10.711  -2.825  -2.825
  849   1HE   LYS 104           HER      LYS 104  12.553  -4.114  -4.114
  850   2HE   LYS 104           HES      LYS 104  11.477  -5.089  -5.089
  851   1HZ   LYS 104           HZB      LYS 104  10.842  -5.002  -5.002
  852   2HZ   LYS 104           HZC      LYS 104  12.192  -5.828  -5.828
  853   3HZ   LYS 104           HZA      LYS 104  10.753  -6.246  -6.246
  854    H    ILE 105           HN       ILE 105   5.918  -4.657  -4.657
  855    HA   ILE 105           HA       ILE 105   3.892  -4.138  -4.138
  856    HB   ILE 105           HB       ILE 105   3.834  -4.155  -4.155
  857   1HG1  ILE 105           HG1      ILE 105   5.248  -2.468  -2.468
  858   2HG1  ILE 105           HG1      ILE 105   3.863  -1.741  -1.741
  859   1HG2  ILE 105           HMG      ILE 105   1.618  -3.799  -3.799
  860   2HG2  ILE 105           HMG      ILE 105   1.738  -2.615  -2.615
  861   3HG2  ILE 105           HMG      ILE 105   1.587  -4.353  -4.353
  862   1HD1  ILE 105           HMD      ILE 105   2.694  -1.769  -1.769
  863   2HD1  ILE 105           HMD      ILE 105   4.330  -2.013  -2.013
  864   3HD1  ILE 105           HMD      ILE 105   3.965  -0.550  -0.550
  865    H    GLU 106           HN       GLU 106   4.055  -6.468  -6.468
  866    HA   GLU 106           HA       GLU 106   2.081  -8.184  -8.184
  867   1HB   GLU 106           HBR      GLU 106   3.951  -8.016  -8.016
  868   2HB   GLU 106           HBS      GLU 106   4.560  -9.298  -9.298
  869   1HG   GLU 106           HGR      GLU 106   3.073 -10.805 -10.805
  870   2HG   GLU 106           HGS      GLU 106   1.795  -9.562  -9.562
  871    H    GLU 107           HN       GLU 107   5.454  -8.052  -8.052
  872    HA   GLU 107           HA       GLU 107   5.371 -10.739 -10.739
  873   1HB   GLU 107           HBR      GLU 107   7.217  -8.942  -8.942
  874   2HB   GLU 107           HBS      GLU 107   7.549  -8.885  -8.885
  875   1HG   GLU 107           HGS      GLU 107   9.076 -10.222 -10.222
  876   2HG   GLU 107           HGR      GLU 107   7.978 -11.306 -11.306
  877    H    GLU 108           HN       GLU 108   4.686  -7.582  -7.582
  878    HA   GLU 108           HA       GLU 108   5.371  -8.304  -8.304
  879   1HB   GLU 108           HBR      GLU 108   5.924  -5.557  -5.557
  880   2HB   GLU 108           HBS      GLU 108   6.493  -6.381  -6.381
  881   1HG   GLU 108           HGS      GLU 108   7.412  -6.848  -6.848
  882   2HG   GLU 108           HGR      GLU 108   8.275  -5.903  -5.903
  883    H    GLN 109           HN       GLN 109   3.985  -5.731  -5.731
  884    HA   GLN 109           HA       GLN 109   1.799  -5.088  -5.088
  885   1HB   GLN 109           HBR      GLN 109   2.634  -4.342  -4.342
  886   2HB   GLN 109           HBS      GLN 109   0.910  -4.807  -4.807
  887   1HG   GLN 109           HGS      GLN 109   1.076  -2.448  -2.448
  888   2HG   GLN 109           HGR      GLN 109   0.525  -3.243  -3.243
  889   1HE2  GLN 109           HE2      GLN 109   4.503  -2.164  -2.164
  890   2HE2  GLN 109           HE2      GLN 109   3.764  -2.916  -2.916
  891    H    ASN 110           HN       ASN 110   2.278  -7.471  -7.471
  892    HA   ASN 110           HA       ASN 110   1.502  -9.581  -9.581
  893   1HB   ASN 110           HBS      ASN 110   2.035  -9.461  -9.461
  894   2HB   ASN 110           HBR      ASN 110   0.273  -9.312  -9.312
  895   1HD2  ASN 110           HD2      ASN 110   2.009 -12.904 -12.904
  896   2HD2  ASN 110           HD2      ASN 110   2.917 -11.435 -11.435
  897    H    LYS 111           HN       LYS 111   0.037 -10.136 -10.136
  898    HA   LYS 111           HA       LYS 111  -2.574 -10.616 -10.616
  899   1HB   LYS 111           HBR      LYS 111  -3.675  -8.975  -8.975
  900   2HB   LYS 111           HBS      LYS 111  -3.409  -8.493  -8.493
  901   1HG   LYS 111           HGR      LYS 111  -1.493  -7.175  -7.175
  902   2HG   LYS 111           HGS      LYS 111  -1.482  -7.825  -7.825
  903   1HD   LYS 111           HDS      LYS 111  -2.346  -5.549  -5.549
  904   2HD   LYS 111           HDR      LYS 111  -3.467  -6.711  -6.711
  905   1HE   LYS 111           HES      LYS 111  -3.570  -5.793  -5.793
  906   2HE   LYS 111           HER      LYS 111  -4.465  -5.022  -5.022
  907   1HZ   LYS 111           HZA      LYS 111  -5.111  -7.558  -7.558
  908   2HZ   LYS 111           HZB      LYS 111  -4.935  -7.537  -7.537
  909   3HZ   LYS 111           HZC      LYS 111  -5.988  -6.517  -6.517
  910    H    SER 112           HN       SER 112  -1.870 -12.508 -12.508
  911    HA   SER 112           HA       SER 112  -2.345 -12.788 -12.788
  912   1HB   SER 112           HBS      SER 112  -0.068 -13.377 -13.377
  913   2HB   SER 112           HBR      SER 112  -0.201 -11.662 -11.662
  914    HG   SER 112           HG       SER 112   0.913 -11.914 -11.914
  915    H    LYS 113           HN       LYS 113  -3.053 -14.747 -14.747
  916    HA   LYS 113           HA       LYS 113  -1.671 -17.065 -17.065
  917   1HB   LYS 113           HBR      LYS 113  -2.725 -16.247 -16.247
  918   2HB   LYS 113           HBS      LYS 113  -4.151 -17.101 -17.101
  919   1HG   LYS 113           HGR      LYS 113  -1.730 -18.692 -18.692
  920   2HG   LYS 113           HGS      LYS 113  -1.987 -18.226 -18.226
  921   1HD   LYS 113           HDS      LYS 113  -4.323 -19.059 -19.059
  922   2HD   LYS 113           HDR      LYS 113  -3.962 -19.614 -19.614
  923   1HE   LYS 113           HES      LYS 113  -3.614 -21.547 -21.547
  924   2HE   LYS 113           HER      LYS 113  -1.971 -20.847 -20.847
  925   1HZ   LYS 113           HZC      LYS 113  -3.041 -19.811 -19.811
  926   2HZ   LYS 113           HZA      LYS 113  -3.871 -21.217 -21.217
  927   3HZ   LYS 113           HZB      LYS 113  -2.239 -21.234 -21.234
  928    H    LYS 114           HN       LYS 114  -4.707 -15.456 -15.456
  929    HA   LYS 114           HA       LYS 114  -6.101 -17.835 -17.835
  930   1HB   LYS 114           HBR      LYS 114  -7.179 -15.758 -15.758
  931   2HB   LYS 114           HBS      LYS 114  -6.797 -14.951 -14.951
  932   1HG   LYS 114           HGR      LYS 114  -8.078 -17.337 -17.337
  933   2HG   LYS 114           HGS      LYS 114  -8.995 -16.743 -16.743
  934   1HD   LYS 114           HDS      LYS 114  -8.913 -14.457 -14.457
  935   2HD   LYS 114           HDR      LYS 114  -8.511 -15.408 -15.408
  936   1HE   LYS 114           HES      LYS 114 -10.557 -16.730 -16.730
  937   2HE   LYS 114           HER      LYS 114 -10.979 -15.736 -15.736
  938   1HZ   LYS 114           HZC      LYS 114 -10.735 -13.822 -13.822
  939   2HZ   LYS 114           HZA      LYS 114 -10.871 -14.943 -14.943
  940   3HZ   LYS 114           HZB      LYS 114 -12.081 -14.742 -14.742
  941    H    LYS 115           HN       LYS 115  -5.423 -18.913 -18.913
  942    HA   LYS 115           HA       LYS 115  -5.116 -19.450 -19.450
  943   1HB   LYS 115           HBR      LYS 115  -6.302 -16.705 -16.705
  944   2HB   LYS 115           HBS      LYS 115  -6.168 -18.065 -18.065
  945   1HG   LYS 115           HGR      LYS 115  -7.556 -19.049 -19.049
  946   2HG   LYS 115           HGS      LYS 115  -8.274 -17.463 -17.463
  947   1HD   LYS 115           HDS      LYS 115  -8.201 -18.430 -18.430
  948   2HD   LYS 115           HDR      LYS 115  -8.142 -19.960 -19.960
  949   1HE   LYS 115           HES      LYS 115 -10.274 -19.874 -19.874
  950   2HE   LYS 115           HER      LYS 115 -10.189 -18.121 -18.121
  951   1HZ   LYS 115           HZB      LYS 115 -10.237 -19.163 -19.163
  952   2HZ   LYS 115           HZC      LYS 115 -11.616 -18.873 -18.873
  953   3HZ   LYS 115           HZA      LYS 115 -10.577 -17.652 -17.652
  954    H    ALA 116           HN       ALA 116  -3.973 -18.861 -18.861
  955    HA   ALA 116           HA       ALA 116  -1.893 -16.767 -16.767
  956   1HB   ALA 116           HMB      ALA 116  -0.955 -19.052 -19.052
  957   2HB   ALA 116           HMB      ALA 116  -1.650 -19.288 -19.288
  958   3HB   ALA 116           HMB      ALA 116  -0.403 -18.043 -18.043
  959    H    GLN 117           HN       GLN 117  -0.971 -16.896 -16.896
  960    HA   GLN 117           HA       GLN 117  -3.253 -15.523 -15.523
  961   1HB   GLN 117           HBR      GLN 117  -1.439 -14.437 -14.437
  962   2HB   GLN 117           HBS      GLN 117  -1.665 -13.857 -13.857
  963   1HG   GLN 117           HGS      GLN 117   0.228 -15.713 -15.713
  964   2HG   GLN 117           HGR      GLN 117   0.624 -15.280 -15.280
  965   1HE2  GLN 117           HE2      GLN 117   2.148 -13.117 -13.117
  966   2HE2  GLN 117           HE2      GLN 117   1.747 -14.801 -14.801
  967    H    GLN 118           HN       GLN 118  -0.193 -17.186 -17.186
  968    HA   GLN 118           HA       GLN 118  -1.311 -17.881 -17.881
  969   1HB   GLN 118           HBR      GLN 118   0.892 -18.906 -18.906
  970   2HB   GLN 118           HBS      GLN 118   0.965 -17.189 -17.189
  971   1HG   GLN 118           HGS      GLN 118   1.217 -18.565 -18.565
  972   2HG   GLN 118           HGR      GLN 118   2.147 -19.557 -19.557
  973   1HE2  GLN 118           HE2      GLN 118   4.011 -16.613 -16.613
  974   2HE2  GLN 118           HE2      GLN 118   2.804 -17.679 -17.679
  975    H    ALA 119           HN       ALA 119  -1.173 -20.043 -20.043
  976    HA   ALA 119           HA       ALA 119  -2.052 -22.069 -22.069
  977   1HB   ALA 119           HMB      ALA 119  -2.881 -21.554 -21.554
  978   2HB   ALA 119           HMB      ALA 119  -3.058 -23.163 -23.163
  979   3HB   ALA 119           HMB      ALA 119  -3.887 -21.753 -21.753
  980    H    ALA 120           HN       ALA 120  -0.788 -22.053 -22.053
  981    HA   ALA 120           HA       ALA 120   1.554 -23.567 -23.567
  982   1HB   ALA 120           HMB      ALA 120  -0.736 -24.993 -24.993
  983   2HB   ALA 120           HMB      ALA 120   0.470 -25.041 -25.041
  984   3HB   ALA 120           HMB      ALA 120   0.908 -25.603 -25.603
  985    H    ALA 121           HN       ALA 121  -0.046 -23.611 -23.611
  986    HA   ALA 121           HA       ALA 121   1.893 -21.567 -21.567
  987   1HB   ALA 121           HMB      ALA 121   1.728 -24.348 -24.348
  988   2HB   ALA 121           HMB      ALA 121   1.236 -23.443 -23.443
  989   3HB   ALA 121           HMB      ALA 121   2.812 -23.115 -23.115
  990    H    ASP 122           HN       ASP 122   1.179 -21.251 -21.251
  991    HA   ASP 122           HA       ASP 122  -1.696 -20.548 -20.548
  992   1HB   ASP 122           HBS      ASP 122  -1.208 -18.705 -18.705
  993   2HB   ASP 122           HBR      ASP 122  -0.222 -18.636 -18.636
  994    H    THR 123           HN       THR 123  -2.743 -22.165 -22.165
  995    HA   THR 123           HA       THR 123  -1.692 -23.678 -23.678
  996    HB   THR 123           HB       THR 123  -3.131 -24.760 -24.760
  997    HG1  THR 123           HG1      THR 123  -2.791 -25.506 -25.506
  998   1HG2  THR 123           HMG      THR 123  -4.791 -22.651 -22.651
  999   2HG2  THR 123           HMG      THR 123  -5.623 -23.735 -23.735
 1000   3HG2  THR 123           HMG      THR 123  -5.303 -24.276 -24.276
 1001    H    GLY 124           HN       GLY 124  -4.105 -23.998 -23.998
 1002   1HA   GLY 124           HAR      GLY 124  -5.081 -21.577 -21.577
 1003   2HA   GLY 124           HAS      GLY 124  -3.594 -22.107 -22.107
 1004    H    ASN 125           HN       ASN 125  -4.008 -24.934 -24.934
 1005    HA   ASN 125           HA       ASN 125  -5.082 -26.771 -26.771
 1006   1HB   ASN 125           HBS      ASN 125  -7.150 -25.858 -25.858
 1007   2HB   ASN 125           HBR      ASN 125  -7.474 -25.022 -25.022
 1008   1HD2  ASN 125           HD2      ASN 125  -7.648 -29.163 -29.163
 1009   2HD2  ASN 125           HD2      ASN 125  -6.539 -28.310 -28.310
 1010    H    ASN 126           HN       ASN 126  -4.884 -27.776 -27.776
 1011    HA   ASN 126           HA       ASN 126  -4.968 -26.500 -26.500
 1012   1HB   ASN 126           HBS      ASN 126  -2.920 -25.524 -25.524
 1013   2HB   ASN 126           HBR      ASN 126  -2.149 -27.032 -27.032
 1014   1HD2  ASN 126           HD2      ASN 126  -2.274 -23.885 -23.885
 1015   2HD2  ASN 126           HD2      ASN 126  -2.413 -23.856 -23.856
 1016    H    SER 127           HN       SER 127  -3.573 -29.041 -29.041
 1017    HA   SER 127           HA       SER 127  -3.618 -31.308 -31.308
 1018   1HB   SER 127           HBS      SER 127  -5.943 -30.355 -30.355
 1019   2HB   SER 127           HBR      SER 127  -5.400 -32.017 -32.017
 1020    HG   SER 127           HG       SER 127  -5.859 -30.856 -30.856
 1021    H    GLN 128           HN       GLN 128  -4.466 -30.738 -30.738
 1022    HA   GLN 128           HA       GLN 128  -1.822 -31.429 -31.429
 1023   1HB   GLN 128           HBR      GLN 128  -3.345 -33.557 -33.557
 1024   2HB   GLN 128           HBS      GLN 128  -3.707 -33.479 -33.479
 1025   1HG   GLN 128           HGS      GLN 128  -1.864 -34.947 -34.947
 1026   2HG   GLN 128           HGR      GLN 128  -1.223 -33.417 -33.417
 1027   1HE2  GLN 128           HE2      GLN 128   1.240 -33.298 -33.298
 1028   2HE2  GLN 128           HE2      GLN 128   0.719 -33.086 -33.086
 1029    H    VAL 129           HN       VAL 129  -5.028 -32.315 -32.315
 1030    HA   VAL 129           HA       VAL 129  -5.164 -30.003 -30.003
 1031    HB   VAL 129           HB       VAL 129  -5.297 -31.475 -31.475
 1032   1HG1  VAL 129           HMG      VAL 129  -3.498 -29.705 -29.705
 1033   2HG1  VAL 129           HMG      VAL 129  -2.455 -31.147 -31.147
 1034   3HG1  VAL 129           HMG      VAL 129  -3.270 -30.670 -30.670
 1035   1HG2  VAL 129           HMG      VAL 129  -4.132 -33.355 -33.355
 1036   2HG2  VAL 129           HMG      VAL 129  -4.915 -33.642 -33.642
 1037   3HG2  VAL 129           HMG      VAL 129  -3.196 -33.185 -33.185
 1038    H    SER 130           HN       SER 130  -6.276 -33.406 -33.406
 1039    HA   SER 130           HA       SER 130  -8.976 -32.896 -32.896
 1040   1HB   SER 130           HBS      SER 130  -9.884 -33.239 -33.239
 1041   2HB   SER 130           HBR      SER 130  -9.377 -31.604 -31.604
 1042    HG   SER 130           HG       SER 130  -7.438 -31.770 -31.770
 1043    H    GLN 131           HN       GLN 131  -6.687 -34.736 -34.736
 1044    HA   GLN 131           HA       GLN 131  -6.418 -36.976 -36.976
 1045   1HB   GLN 131           HBR      GLN 131  -7.380 -37.032 -37.032
 1046   2HB   GLN 131           HBS      GLN 131  -8.645 -37.942 -37.942
 1047   1HG   GLN 131           HGS      GLN 131  -6.854 -39.378 -39.378
 1048   2HG   GLN 131           HGR      GLN 131  -7.023 -39.506 -39.506
 1049   1HE2  GLN 131           HE2      GLN 131  -3.738 -37.607 -37.607
 1050   2HE2  GLN 131           HE2      GLN 131  -5.247 -37.653 -37.653
 1051    H    ASN 132           HN       ASN 132  -9.911 -36.483 -36.483
 1052    HA   ASN 132           HA       ASN 132 -11.753 -36.981 -36.981
 1053   1HB   ASN 132           HBS      ASN 132 -11.826 -35.946 -35.946
 1054   2HB   ASN 132           HBR      ASN 132 -10.839 -34.952 -34.952
 1055   1HD2  ASN 132           HD2      ASN 132  -7.844 -35.233 -35.233
 1056   2HD2  ASN 132           HD2      ASN 132  -8.580 -34.804 -34.804
 1057    H    TYR 133           HN       TYR 133 -12.094 -39.092 -39.092
 1058    HA   TYR 133           HA       TYR 133 -12.461 -41.232 -41.232
 1059   1HB   TYR 133           HBS      TYR 133 -11.909 -39.799 -39.799
 1060   2HB   TYR 133           HBR      TYR 133 -11.472 -41.530 -41.530
 1061    HD1  TYR 133           HD1      TYR 133 -14.342 -39.734 -39.734
 1062    HD2  TYR 133           HD2      TYR 133 -13.109 -42.658 -42.658
 1063    HE1  TYR 133           HE1      TYR 133 -16.693 -40.314 -40.314
 1064    HE2  TYR 133           HE2      TYR 133 -15.455 -43.225 -43.225
 1065    HH   TYR 133           HH       TYR 133 -17.673 -43.058 -43.058

  Start of MODEL   12
    1   1H    HIS   1           HNC      HIS   1   4.872  19.449  19.449
    2   2H    HIS   1           HN       HIS   1   6.095  18.844  18.844
    3   3H    HIS   1           HNB      HIS   1   4.973  19.807  19.807
    4    HA   HIS   1           HA       HIS   1   5.716  21.708  21.708
    5   1HB   HIS   1           HBR      HIS   1   7.946  19.881  19.881
    6   2HB   HIS   1           HBS      HIS   1   8.378  21.412  21.412
    7    HD1  HIS   1           HD1      HIS   1   5.306  21.558  21.558
    8    HD2  HIS   1           HD2      HIS   1   9.402  22.179  22.179
    9    HE1  HIS   1           HE1      HIS   1   5.618  22.673  22.673
   10    HE2  HIS   1           HE2      HIS   1   8.096  23.031  23.031
   11    H    MET   2           HN       MET   2   6.593  18.799  18.799
   12    HA   MET   2           HA       MET   2   7.169  20.416  20.416
   13   1HB   MET   2           HBR      MET   2   8.707  17.937  17.937
   14   2HB   MET   2           HBS      MET   2   9.070  19.088  19.088
   15   1HG   MET   2           HGS      MET   2   8.950  19.983  19.983
   16   2HG   MET   2           HGR      MET   2  10.421  19.254  19.254
   17   1HE   MET   2           HME      MET   2  11.573  21.421  21.421
   18   2HE   MET   2           HME      MET   2  11.394  23.016  23.016
   19   3HE   MET   2           HME      MET   2  10.180  22.456  22.456
   20    H    GLY   3           HN       GLY   3   7.244  18.978  18.978
   21   1HA   GLY   3           HAR      GLY   3   6.626  17.044  17.044
   22   2HA   GLY   3           HAS      GLY   3   5.629  16.521  16.521
   23    H    ALA   4           HN       ALA   4   3.926  18.478  18.478
   24    HA   ALA   4           HA       ALA   4   1.878  19.297  19.297
   25   1HB   ALA   4           HMB      ALA   4   3.158  19.562  19.562
   26   2HB   ALA   4           HMB      ALA   4   1.567  20.209  20.209
   27   3HB   ALA   4           HMB      ALA   4   3.048  20.823  20.823
   28    H    ARG   5           HN       ARG   5   2.693  17.799  17.799
   29    HA   ARG   5           HA       ARG   5   1.658  16.151  16.151
   30   1HB   ARG   5           HBS      ARG   5   1.200  15.174  15.174
   31   2HB   ARG   5           HBR      ARG   5   0.179  14.507  14.507
   32   1HG   ARG   5           HGS      ARG   5   2.120  13.081  13.081
   33   2HG   ARG   5           HGR      ARG   5   2.184  13.781  13.781
   34   1HD   ARG   5           HDS      ARG   5   3.872  15.259  15.259
   35   2HD   ARG   5           HDR      ARG   5   3.550  15.117  15.117
   36    HE   ARG   5           HE       ARG   5   4.358  12.592  12.592
   37   1HH1  ARG   5           HH1      ARG   5   5.734  15.801  15.801
   38   2HH1  ARG   5           HH1      ARG   5   7.294  15.185  15.185
   39   1HH2  ARG   5           HH2      ARG   5   6.374  11.821  11.821
   40   2HH2  ARG   5           HH2      ARG   5   7.658  12.934  12.934
   41    H    ALA   6           HN       ALA   6  -0.323  15.827  15.827
   42    HA   ALA   6           HA       ALA   6  -2.806  16.808  16.808
   43   1HB   ALA   6           HMB      ALA   6  -1.081  18.866  18.866
   44   2HB   ALA   6           HMB      ALA   6  -2.861  18.946  18.946
   45   3HB   ALA   6           HMB      ALA   6  -1.911  18.995  18.995
   46    H    SER   7           HN       SER   7  -0.481  16.306  16.306
   47    HA   SER   7           HA       SER   7  -2.599  16.305  16.305
   48   1HB   SER   7           HBS      SER   7  -0.501  17.560  17.560
   49   2HB   SER   7           HBR      SER   7   0.399  16.016  16.016
   50    HG   SER   7           HG       SER   7  -1.928  16.514  16.514
   51    H    VAL   8           HN       VAL   8  -1.346  14.545  14.545
   52    HA   VAL   8           HA       VAL   8  -2.138  11.921  11.921
   53    HB   VAL   8           HB       VAL   8  -0.482  12.850  12.850
   54   1HG1  VAL   8           HMG      VAL   8  -1.622  10.110  10.110
   55   2HG1  VAL   8           HMG      VAL   8  -1.025  10.626  10.626
   56   3HG1  VAL   8           HMG      VAL   8   0.088  10.560  10.560
   57   1HG2  VAL   8           HMG      VAL   8  -2.902  13.600  13.600
   58   2HG2  VAL   8           HMG      VAL   8  -2.423  12.751  12.751
   59   3HG2  VAL   8           HMG      VAL   8  -3.339  11.890  11.890
   60    H    LEU   9           HN       LEU   9   1.064  13.335  13.335
   61    HA   LEU   9           HA       LEU   9   2.276  10.913  10.913
   62   1HB   LEU   9           HBR      LEU   9   3.040  13.158  13.158
   63   2HB   LEU   9           HBS      LEU   9   4.319  12.152  12.152
   64    HG   LEU   9           HG       LEU   9   2.063  11.137  11.137
   65   1HD1  LEU   9           HMD      LEU   9   4.299  12.542  12.542
   66   2HD1  LEU   9           HMD      LEU   9   4.855  10.851  10.851
   67   3HD1  LEU   9           HMD      LEU   9   3.413  11.364  11.364
   68   1HD2  LEU   9           HMD      LEU   9   4.152   9.913   9.913
   69   2HD2  LEU   9           HMD      LEU   9   2.581   9.269   9.269
   70   3HD2  LEU   9           HMD      LEU   9   3.986   9.224   9.224
   71    H    SER  10           HN       SER  10   4.807  11.774  11.774
   72    HA   SER  10           HA       SER  10   4.500  13.763  13.763
   73   1HB   SER  10           HBS      SER  10   5.434  12.074  12.074
   74   2HB   SER  10           HBR      SER  10   6.249  11.353  11.353
   75    HG   SER  10           HG       SER  10   7.858  12.077  12.077
   76    H    GLY  11           HN       GLY  11   6.376  15.252  15.252
   77   1HA   GLY  11           HAR      GLY  11   7.183  16.396  16.396
   78   2HA   GLY  11           HAS      GLY  11   7.857  16.767  16.767
   79    H    GLY  12           HN       GLY  12   8.870  14.478  14.478
   80   1HA   GLY  12           HAR      GLY  12  11.222  13.889  13.889
   81   2HA   GLY  12           HAS      GLY  12  10.506  12.861  12.861
   82    H    GLU  13           HN       GLU  13   8.190  11.983  11.983
   83    HA   GLU  13           HA       GLU  13   9.087   9.858   9.858
   84   1HB   GLU  13           HBR      GLU  13   6.358  10.891  10.891
   85   2HB   GLU  13           HBS      GLU  13   6.584   9.551   9.551
   86   1HG   GLU  13           HGS      GLU  13   7.442   8.221   8.221
   87   2HG   GLU  13           HGR      GLU  13   7.680   9.537   9.537
   88    H    LEU  14           HN       LEU  14   7.809  13.005  13.005
   89    HA   LEU  14           HA       LEU  14   7.124  12.612  12.612
   90   1HB   LEU  14           HBR      LEU  14   7.422  14.737  14.737
   91   2HB   LEU  14           HBS      LEU  14   8.248  15.167  15.167
   92    HG   LEU  14           HG       LEU  14   6.096  16.102  16.102
   93   1HD1  LEU  14           HMD      LEU  14   6.674  13.713  13.713
   94   2HD1  LEU  14           HMD      LEU  14   4.968  14.228  14.228
   95   3HD1  LEU  14           HMD      LEU  14   6.241  15.371  15.371
   96   1HD2  LEU  14           HMD      LEU  14   5.324  13.510  13.510
   97   2HD2  LEU  14           HMD      LEU  14   4.765  15.169  15.169
   98   3HD2  LEU  14           HMD      LEU  14   4.140  14.287  14.287
   99    H    ASP  15           HN       ASP  15  10.093  13.790  13.790
  100    HA   ASP  15           HA       ASP  15  11.488  14.174  14.174
  101   1HB   ASP  15           HBS      ASP  15  12.081  15.363  15.363
  102   2HB   ASP  15           HBR      ASP  15  12.552  13.846  13.846
  103    H    LYS  16           HN       LYS  16  11.082  11.325  11.325
  104    HA   LYS  16           HA       LYS  16  12.854   9.729   9.729
  105   1HB   LYS  16           HBS      LYS  16  11.946   9.362   9.362
  106   2HB   LYS  16           HBR      LYS  16  10.734   8.411   8.411
  107   1HG   LYS  16           HGR      LYS  16  12.314   6.784   6.784
  108   2HG   LYS  16           HGS      LYS  16  12.900   7.412   7.412
  109   1HD   LYS  16           HDR      LYS  16  14.768   7.161   7.161
  110   2HD   LYS  16           HDS      LYS  16  14.482   8.869   8.869
  111   1HE   LYS  16           HES      LYS  16  13.940   9.168   9.168
  112   2HE   LYS  16           HER      LYS  16  13.270   7.518   7.518
  113   1HZ   LYS  16           HZB      LYS  16  16.123   7.857   7.857
  114   2HZ   LYS  16           HZC      LYS  16  15.523   8.110   8.110
  115   3HZ   LYS  16           HZA      LYS  16  15.326   6.660   6.660
  116    H    TRP  17           HN       TRP  17   9.428  10.544  10.544
  117    HA   TRP  17           HA       TRP  17   8.478   8.623   8.623
  118   1HB   TRP  17           HBS      TRP  17   7.000   9.749   9.749
  119   2HB   TRP  17           HBR      TRP  17   7.351  11.329  11.329
  120    HD1  TRP  17           HD1      TRP  17   6.109  11.878  11.878
  121    HE1  TRP  17           HE1      TRP  17   4.360  10.681  10.681
  122    HE3  TRP  17           HE3      TRP  17   6.290   7.290   7.290
  123    HZ2  TRP  17           HZ2      TRP  17   2.992   8.230   8.230
  124    HZ3  TRP  17           HZ3      TRP  17   4.412   5.731   5.731
  125    HH2  TRP  17           HH2      TRP  17   2.980   6.076   6.076
  126    H    GLU  18           HN       GLU  18  10.386  11.379  11.379
  127    HA   GLU  18           HA       GLU  18   9.286  12.024  12.024
  128   1HB   GLU  18           HBR      GLU  18  10.439  13.342  13.342
  129   2HB   GLU  18           HBS      GLU  18  11.880  12.758  12.758
  130   1HG   GLU  18           HGS      GLU  18  11.433  13.832  13.832
  131   2HG   GLU  18           HGR      GLU  18  10.133  14.752  14.752
  132    H    LYS  19           HN       LYS  19  10.472   9.275   9.275
  133    HA   LYS  19           HA       LYS  19  10.914   8.994   8.994
  134   1HB   LYS  19           HBS      LYS  19  13.468   9.786   9.786
  135   2HB   LYS  19           HBR      LYS  19  13.553   8.254   8.254
  136   1HG   LYS  19           HGR      LYS  19  13.370   9.298   9.298
  137   2HG   LYS  19           HGS      LYS  19  12.109  10.416  10.416
  138   1HD   LYS  19           HDS      LYS  19  14.082  11.627  11.627
  139   2HD   LYS  19           HDR      LYS  19  13.709  11.844  11.844
  140   1HE   LYS  19           HER      LYS  19  16.128  11.558  11.558
  141   2HE   LYS  19           HES      LYS  19  15.484  10.479  10.479
  142   1HZ   LYS  19           HZC      LYS  19  15.180   8.855   8.855
  143   2HZ   LYS  19           HZA      LYS  19  16.143   9.818   9.818
  144   3HZ   LYS  19           HZB      LYS  19  16.719   9.140   9.140
  145    H    ILE  20           HN       ILE  20   9.523   7.383   7.383
  146    HA   ILE  20           HA       ILE  20  10.915   4.947   4.947
  147    HB   ILE  20           HB       ILE  20   8.061   5.146   5.146
  148   1HG1  ILE  20           HG1      ILE  20   7.643   6.523   6.523
  149   2HG1  ILE  20           HG1      ILE  20   7.470   4.948   4.948
  150   1HG2  ILE  20           HMG      ILE  20   9.482   3.063   3.063
  151   2HG2  ILE  20           HMG      ILE  20   7.707   3.152   3.152
  152   3HG2  ILE  20           HMG      ILE  20   8.727   2.932   2.932
  153   1HD1  ILE  20           HMD      ILE  20  10.154   5.620   5.620
  154   2HD1  ILE  20           HMD      ILE  20   9.257   7.148   7.148
  155   3HD1  ILE  20           HMD      ILE  20   8.814   5.715   5.715
  156    H    ARG  21           HN       ARG  21  10.518   3.049   3.049
  157    HA   ARG  21           HA       ARG  21  11.403   4.027   4.027
  158   1HB   ARG  21           HBS      ARG  21  12.844   2.538   2.538
  159   2HB   ARG  21           HBR      ARG  21  11.743   1.216   1.216
  160   1HG   ARG  21           HGR      ARG  21  12.304   1.959   1.959
  161   2HG   ARG  21           HGS      ARG  21  13.692   2.797   2.797
  162   1HD   ARG  21           HDR      ARG  21  13.027  -0.138  -0.138
  163   2HD   ARG  21           HDS      ARG  21  14.286   0.574   0.574
  164    HE   ARG  21           HE       ARG  21  14.536  -0.033  -0.033
  165   1HH1  ARG  21           HH1      ARG  21  15.604   2.198   2.198
  166   2HH1  ARG  21           HH1      ARG  21  16.954   2.764   2.764
  167   1HH2  ARG  21           HH2      ARG  21  16.237   0.825   0.825
  168   2HH2  ARG  21           HH2      ARG  21  17.316   1.985   1.985
  169    H    LEU  22           HN       LEU  22  10.524   3.390   3.390
  170    HA   LEU  22           HA       LEU  22   8.776   1.251   1.251
  171   1HB   LEU  22           HBS      LEU  22   6.727   1.902   1.902
  172   2HB   LEU  22           HBR      LEU  22   7.515   3.189   3.189
  173    HG   LEU  22           HG       LEU  22   7.269   4.592   4.592
  174   1HD1  LEU  22           HMD      LEU  22   6.120   2.209   2.209
  175   2HD1  LEU  22           HMD      LEU  22   4.730   3.258   3.258
  176   3HD1  LEU  22           HMD      LEU  22   5.980   3.813   3.813
  177   1HD2  LEU  22           HMD      LEU  22   5.446   3.879   3.879
  178   2HD2  LEU  22           HMD      LEU  22   6.122   5.455   5.455
  179   3HD2  LEU  22           HMD      LEU  22   4.705   4.793   4.793
  180    H    ARG  23           HN       ARG  23   9.479   0.782   0.782
  181    HA   ARG  23           HA       ARG  23   9.935   3.027   3.027
  182   1HB   ARG  23           HBR      ARG  23  11.959   2.031   2.031
  183   2HB   ARG  23           HBS      ARG  23  11.906   1.904   1.904
  184   1HG   ARG  23           HGS      ARG  23  11.024  -0.497  -0.497
  185   2HG   ARG  23           HGR      ARG  23  11.650  -0.263  -0.263
  186   1HD   ARG  23           HDS      ARG  23  13.809   0.503   0.503
  187   2HD   ARG  23           HDR      ARG  23  13.127  -0.304  -0.304
  188    HE   ARG  23           HE       ARG  23  13.951  -1.610  -1.610
  189   1HH1  ARG  23           HH1      ARG  23  12.482  -1.928  -1.928
  190   2HH1  ARG  23           HH1      ARG  23  12.930  -3.594  -3.594
  191   1HH2  ARG  23           HH2      ARG  23  14.640  -3.748  -3.748
  192   2HH2  ARG  23           HH2      ARG  23  14.150  -4.624  -4.624
  193    HA   PRO  24           HA       PRO  24   7.042   0.157   0.157
  194   1HB   PRO  24           HBR      PRO  24   5.341   2.186   2.186
  195   2HB   PRO  24           HBS      PRO  24   5.064   0.974   0.974
  196   1HG   PRO  24           HGS      PRO  24   5.461   3.595   3.595
  197   2HG   PRO  24           HGR      PRO  24   5.230   2.356   2.356
  198   1HD   PRO  24           HDS      PRO  24   7.631   3.615   3.615
  199   2HD   PRO  24           HDR      PRO  24   7.327   2.662   2.662
  200    H    GLY  25           HN       GLY  25   8.610   3.096   3.096
  201   1HA   GLY  25           HAR      GLY  25   9.679   1.942   1.942
  202   2HA   GLY  25           HAS      GLY  25   8.794   3.463   3.463
  203    H    GLY  26           HN       GLY  26  10.762   2.430   2.430
  204   1HA   GLY  26           HAR      GLY  26  12.797   3.093   3.093
  205   2HA   GLY  26           HAS      GLY  26  13.134   3.555   3.555
  206    H    LYS  27           HN       LYS  27  10.443   5.170   5.170
  207    HA   LYS  27           HA       LYS  27  11.852   7.664   7.664
  208   1HB   LYS  27           HBR      LYS  27   9.026   6.720   6.720
  209   2HB   LYS  27           HBS      LYS  27   9.689   8.343   8.343
  210   1HG   LYS  27           HGR      LYS  27   9.151   9.038   9.038
  211   2HG   LYS  27           HGS      LYS  27  10.064   7.693   7.693
  212   1HD   LYS  27           HDR      LYS  27   7.645   6.670   6.670
  213   2HD   LYS  27           HDS      LYS  27   7.240   8.087   8.087
  214   1HE   LYS  27           HES      LYS  27   7.948   7.153   7.153
  215   2HE   LYS  27           HER      LYS  27   9.119   6.084   6.084
  216   1HZ   LYS  27           HZB      LYS  27   6.211   5.761   5.761
  217   2HZ   LYS  27           HZC      LYS  27   7.111   4.979   4.979
  218   3HZ   LYS  27           HZA      LYS  27   7.370   4.713   4.713
  219    H    LYS  28           HN       LYS  28  10.428   4.757   4.757
  220    HA   LYS  28           HA       LYS  28  11.214   3.470   3.470
  221   1HB   LYS  28           HBR      LYS  28  13.548   3.294   3.294
  222   2HB   LYS  28           HBS      LYS  28  13.238   3.692   3.692
  223   1HG   LYS  28           HGS      LYS  28  14.281   5.724   5.724
  224   2HG   LYS  28           HGR      LYS  28  13.854   5.966   5.966
  225   1HD   LYS  28           HDR      LYS  28  16.108   5.662   5.662
  226   2HD   LYS  28           HDS      LYS  28  15.518   4.065   4.065
  227   1HE   LYS  28           HES      LYS  28  15.900   3.399   3.399
  228   2HE   LYS  28           HER      LYS  28  16.529   5.041   5.041
  229   1HZ   LYS  28           HZC      LYS  28  17.662   3.195   3.195
  230   2HZ   LYS  28           HZA      LYS  28  18.247   3.385   3.385
  231   3HZ   LYS  28           HZB      LYS  28  18.277   4.636   4.636
  232    H    GLN  29           HN       GLN  29   9.756   5.573   5.573
  233    HA   GLN  29           HA       GLN  29  10.429   5.359   5.359
  234   1HB   GLN  29           HBS      GLN  29  11.193   7.968   7.968
  235   2HB   GLN  29           HBR      GLN  29  10.663   7.885   7.885
  236   1HG   GLN  29           HGR      GLN  29  12.832   7.555   7.555
  237   2HG   GLN  29           HGS      GLN  29  12.517   5.881   5.881
  238   1HE2  GLN  29           HE2      GLN  29  15.396   6.463   6.463
  239   2HE2  GLN  29           HE2      GLN  29  14.737   5.730   5.730
  240    H    TYR  30           HN       TYR  30   8.986   6.600   6.600
  241    HA   TYR  30           HA       TYR  30   6.876   8.095   8.095
  242   1HB   TYR  30           HBS      TYR  30   5.798   7.883   7.883
  243   2HB   TYR  30           HBR      TYR  30   5.234   7.038   7.038
  244    HD1  TYR  30           HD2      TYR  30   7.310   4.904   4.904
  245    HD2  TYR  30           HD1      TYR  30   5.209   6.376   6.376
  246    HE1  TYR  30           HE2      TYR  30   6.733   2.599   2.599
  247    HE2  TYR  30           HE1      TYR  30   4.984   4.084   4.084
  248    HH   TYR  30           HH       TYR  30   6.925   1.625   1.625
  249    H    LYS  31           HN       LYS  31   6.146   9.963   9.963
  250    HA   LYS  31           HA       LYS  31   7.704  11.013  11.013
  251   1HB   LYS  31           HBS      LYS  31   7.482  12.106  12.106
  252   2HB   LYS  31           HBR      LYS  31   6.652  13.178  13.178
  253   1HG   LYS  31           HGS      LYS  31   8.790  14.036  14.036
  254   2HG   LYS  31           HGR      LYS  31   8.876  12.815  12.815
  255   1HD   LYS  31           HDR      LYS  31  10.523  11.798  11.798
  256   2HD   LYS  31           HDS      LYS  31   9.551  11.539  11.539
  257   1HE   LYS  31           HES      LYS  31  11.534  12.686  12.686
  258   2HE   LYS  31           HER      LYS  31  10.176  13.843  13.843
  259   1HZ   LYS  31           HZC      LYS  31  11.157  14.067  14.067
  260   2HZ   LYS  31           HZA      LYS  31  12.495  13.955  13.955
  261   3HZ   LYS  31           HZB      LYS  31  11.388  15.118  15.118
  262    H    LEU  32           HN       LEU  32   6.318  13.290  13.290
  263    HA   LEU  32           HA       LEU  32   3.876  12.305  12.305
  264   1HB   LEU  32           HBR      LEU  32   5.675  14.100  14.100
  265   2HB   LEU  32           HBS      LEU  32   4.597  15.204  15.204
  266    HG   LEU  32           HG       LEU  32   2.729  14.526  14.526
  267   1HD1  LEU  32           HMD      LEU  32   3.689  12.291  12.291
  268   2HD1  LEU  32           HMD      LEU  32   4.866  13.133  13.133
  269   3HD1  LEU  32           HMD      LEU  32   3.123  13.246  13.246
  270   1HD2  LEU  32           HMD      LEU  32   5.269  15.773  15.773
  271   2HD2  LEU  32           HMD      LEU  32   3.671  16.504  16.504
  272   3HD2  LEU  32           HMD      LEU  32   3.944  15.509  15.509
  273    H    LYS  33           HN       LYS  33   4.734  13.592  13.592
  274    HA   LYS  33           HA       LYS  33   2.068  14.463  14.463
  275   1HB   LYS  33           HBR      LYS  33   4.597  14.585  14.585
  276   2HB   LYS  33           HBS      LYS  33   3.757  13.332  13.332
  277   1HG   LYS  33           HGS      LYS  33   3.072  15.128  15.128
  278   2HG   LYS  33           HGR      LYS  33   1.825  15.229  15.229
  279   1HD   LYS  33           HDR      LYS  33   2.769  17.385  17.385
  280   2HD   LYS  33           HDS      LYS  33   3.148  16.891  16.891
  281   1HE   LYS  33           HER      LYS  33   5.373  16.046  16.046
  282   2HE   LYS  33           HES      LYS  33   4.939  17.110  17.110
  283   1HZ   LYS  33           HZB      LYS  33   4.544  18.677  18.677
  284   2HZ   LYS  33           HZC      LYS  33   5.819  17.796  17.796
  285   3HZ   LYS  33           HZA      LYS  33   5.922  18.643  18.643
  286    H    HIS  34           HN       DHI  34   3.772  11.484  11.484
  287    HA   HIS  34           HA       DHI  34   1.775   9.935   9.935
  288   1HB   HIS  34           HBS      DHI  34   4.339   9.272   9.272
  289   2HB   HIS  34           HBR      DHI  34   3.118   7.985   7.985
  290    HD2  HIS  34           HD2      DHI  34   2.518   7.401   7.401
  291    HE1  HIS  34           HE1      DHI  34   6.401   8.501   8.501
  292    HE2  HIS  34           HE2      DHI  34   4.305   7.273   7.273
  293    H    ILE  35           HN       ILE  35   2.591  10.682  10.682
  294    HA   ILE  35           HA       ILE  35   0.619   8.969   8.969
  295    HB   ILE  35           HB       ILE  35   2.612  10.336  10.336
  296   1HG1  ILE  35           HG1      ILE  35   0.098  10.199  10.199
  297   2HG1  ILE  35           HG1      ILE  35   0.784   8.719   8.719
  298   1HG2  ILE  35           HMG      ILE  35   0.402  12.368  12.368
  299   2HG2  ILE  35           HMG      ILE  35   1.545  12.242  12.242
  300   3HG2  ILE  35           HMG      ILE  35   2.152  12.578  12.578
  301   1HD1  ILE  35           HMD      ILE  35   2.848  10.266  10.266
  302   2HD1  ILE  35           HMD      ILE  35   1.510   9.918   9.918
  303   3HD1  ILE  35           HMD      ILE  35   2.337   8.581   8.581
  304    H    VAL  36           HN       VAL  36   0.545  12.204  12.204
  305    HA   VAL  36           HA       VAL  36  -2.016  12.911  12.911
  306    HB   VAL  36           HB       VAL  36  -0.285  14.242  14.242
  307   1HG1  VAL  36           HMG      VAL  36  -3.015  14.947  14.947
  308   2HG1  VAL  36           HMG      VAL  36  -1.847  16.262  16.262
  309   3HG1  VAL  36           HMG      VAL  36  -2.270  15.162  15.162
  310   1HG2  VAL  36           HMG      VAL  36   0.157  14.101  14.101
  311   2HG2  VAL  36           HMG      VAL  36   0.694  15.431  15.431
  312   3HG2  VAL  36           HMG      VAL  36  -0.805  15.595  15.595
  313    H    TRP  37           HN       TRP  37  -0.696  11.873  11.873
  314    HA   TRP  37           HA       TRP  37  -3.113  11.346  11.346
  315   1HB   TRP  37           HBS      TRP  37  -0.982  11.256  11.256
  316   2HB   TRP  37           HBR      TRP  37  -0.450   9.915   9.915
  317    HD1  TRP  37           HD1      TRP  37  -2.417  10.596  10.596
  318    HE1  TRP  37           HE1      TRP  37  -2.877   8.356   8.356
  319    HE3  TRP  37           HE3      TRP  37  -1.081   7.484   7.484
  320    HZ2  TRP  37           HZ2      TRP  37  -2.629   5.630   5.630
  321    HZ3  TRP  37           HZ3      TRP  37  -1.160   5.065   5.065
  322    HH2  TRP  37           HH2      TRP  37  -1.916   4.146   4.146
  323    H    ALA  38           HN       ALA  38  -1.298   9.453   9.453
  324    HA   ALA  38           HA       ALA  38  -2.638   6.935   6.935
  325   1HB   ALA  38           HMB      ALA  38  -0.894   8.132   8.132
  326   2HB   ALA  38           HMB      ALA  38  -1.648   6.528   6.528
  327   3HB   ALA  38           HMB      ALA  38  -0.512   6.821   6.821
  328    H    SER  39           HN       SER  39  -2.619   9.139   9.139
  329    HA   SER  39           HA       SER  39  -4.898   8.135   8.135
  330   1HB   SER  39           HBS      SER  39  -4.889  10.065  10.065
  331   2HB   SER  39           HBR      SER  39  -3.181   9.699   9.699
  332    HG   SER  39           HG       SER  39  -4.954  11.800  11.800
  333    H    ARG  40           HN       ARG  40  -4.574  10.431  10.431
  334    HA   ARG  40           HA       ARG  40  -7.274  11.381  11.381
  335   1HB   ARG  40           HBR      ARG  40  -5.484  12.442  12.442
  336   2HB   ARG  40           HBS      ARG  40  -5.285  10.958  10.958
  337   1HG   ARG  40           HGS      ARG  40  -7.891  11.405  11.405
  338   2HG   ARG  40           HGR      ARG  40  -7.373  13.084  13.084
  339   1HD   ARG  40           HDR      ARG  40  -5.438  12.497  12.497
  340   2HD   ARG  40           HDS      ARG  40  -6.540  11.196  11.196
  341    HE   ARG  40           HE       ARG  40  -7.606  13.944  13.944
  342   1HH1  ARG  40           HH1      ARG  40  -6.092  11.444  11.444
  343   2HH1  ARG  40           HH1      ARG  40  -6.838  11.994  11.994
  344   1HH2  ARG  40           HH2      ARG  40  -8.659  14.559  14.559
  345   2HH2  ARG  40           HH2      ARG  40  -8.288  13.758  13.758
  346    H    GLU  41           HN       GLU  41  -5.611   8.711   8.711
  347    HA   GLU  41           HA       GLU  41  -7.927   7.887   7.887
  348   1HB   GLU  41           HBR      GLU  41  -5.265   7.500   7.500
  349   2HB   GLU  41           HBS      GLU  41  -5.682   6.156   6.156
  350   1HG   GLU  41           HGS      GLU  41  -5.244   5.777   5.777
  351   2HG   GLU  41           HGR      GLU  41  -6.733   5.027   5.027
  352    H    LEU  42           HN       LEU  42  -6.658   7.217   7.217
  353    HA   LEU  42           HA       LEU  42  -8.096   4.735   4.735
  354   1HB   LEU  42           HBR      LEU  42  -6.106   5.258   5.258
  355   2HB   LEU  42           HBS      LEU  42  -6.791   6.830   6.830
  356    HG   LEU  42           HG       LEU  42  -8.631   4.929   4.929
  357   1HD1  LEU  42           HMD      LEU  42  -6.124   3.643   3.643
  358   2HD1  LEU  42           HMD      LEU  42  -6.333   3.918   3.918
  359   3HD1  LEU  42           HMD      LEU  42  -7.576   3.030   3.030
  360   1HD2  LEU  42           HMD      LEU  42  -6.515   6.628   6.628
  361   2HD2  LEU  42           HMD      LEU  42  -8.290   6.779   6.779
  362   3HD2  LEU  42           HMD      LEU  42  -7.487   5.502   5.502
  363    H    GLU  43           HN       GLU  43  -8.418   8.002   8.002
  364    HA   GLU  43           HA       GLU  43 -10.757   7.471   7.471
  365   1HB   GLU  43           HBR      GLU  43  -9.584  10.008  10.008
  366   2HB   GLU  43           HBS      GLU  43 -10.981   9.996   9.996
  367   1HG   GLU  43           HGS      GLU  43  -9.705  10.603  10.603
  368   2HG   GLU  43           HGR      GLU  43  -9.524   8.849   8.849
  369    H    ARG  44           HN       ARG  44 -10.257   8.418   8.418
  370    HA   ARG  44           HA       ARG  44 -13.136   8.810   8.810
  371   1HB   ARG  44           HBS      ARG  44 -10.661   9.655   9.655
  372   2HB   ARG  44           HBR      ARG  44 -11.844   9.005   9.005
  373   1HG   ARG  44           HGR      ARG  44 -13.547  10.572  10.572
  374   2HG   ARG  44           HGS      ARG  44 -12.203  11.318  11.318
  375   1HD   ARG  44           HDS      ARG  44 -12.792  12.502  12.502
  376   2HD   ARG  44           HDR      ARG  44 -11.098  11.942  11.942
  377    HE   ARG  44           HE       ARG  44 -13.259  10.734  10.734
  378   1HH1  ARG  44           HH1      ARG  44  -9.855  10.869  10.869
  379   2HH1  ARG  44           HH1      ARG  44  -9.316  10.187  10.187
  380   1HH2  ARG  44           HH2      ARG  44 -12.509   9.948   9.948
  381   2HH2  ARG  44           HH2      ARG  44 -10.818   9.657   9.657
  382    H    PHE  45           HN       PHE  45 -10.946   6.237   6.237
  383    HA   PHE  45           HA       PHE  45 -12.379   4.531   4.531
  384   1HB   PHE  45           HBS      PHE  45 -10.272   4.160   4.160
  385   2HB   PHE  45           HBR      PHE  45 -11.516   2.880   2.880
  386    HD1  PHE  45           HD2      PHE  45  -9.838   4.785   4.785
  387    HD2  PHE  45           HD1      PHE  45 -10.984   1.060   1.060
  388    HE1  PHE  45           HE2      PHE  45  -8.842   3.595   3.595
  389    HE2  PHE  45           HE1      PHE  45 -10.083  -0.138  -0.138
  390    HZ   PHE  45           HZ       PHE  45  -9.010   1.125   1.125
  391    H    ALA  46           HN       ALA  46 -12.305   4.646   4.646
  392    HA   ALA  46           HA       ALA  46 -15.233   4.504   4.504
  393   1HB   ALA  46           HMB      ALA  46 -13.348   2.156   2.156
  394   2HB   ALA  46           HMB      ALA  46 -14.916   2.188   2.188
  395   3HB   ALA  46           HMB      ALA  46 -14.860   2.308   2.308
  396    H    VAL  47           HN       VAL  47 -12.607   5.848   5.848
  397    HA   VAL  47           HA       VAL  47 -12.653   4.825   4.825
  398    HB   VAL  47           HB       VAL  47 -10.251   5.785   5.785
  399   1HG1  VAL  47           HMG      VAL  47 -10.591   4.393   4.393
  400   2HG1  VAL  47           HMG      VAL  47  -9.072   4.303   4.303
  401   3HG1  VAL  47           HMG      VAL  47  -9.694   5.882   5.882
  402   1HG2  VAL  47           HMG      VAL  47 -11.221   3.871   3.871
  403   2HG2  VAL  47           HMG      VAL  47  -9.680   3.441   3.441
  404   3HG2  VAL  47           HMG      VAL  47 -11.221   2.944   2.944
  405    H    ASN  48           HN       ASN  48 -11.644   6.238   6.238
  406    HA   ASN  48           HA       ASN  48 -12.110   9.104   9.104
  407   1HB   ASN  48           HBS      ASN  48 -13.735   8.545   8.545
  408   2HB   ASN  48           HBR      ASN  48 -12.552   7.635   7.635
  409   1HD2  ASN  48           HD2      ASN  48 -13.255  11.502  11.502
  410   2HD2  ASN  48           HD2      ASN  48 -14.261  10.474  10.474
  411    HA   PRO  49           HA       PRO  49  -7.948   9.621   9.621
  412   1HB   PRO  49           HBR      PRO  49  -7.866  12.244  12.244
  413   2HB   PRO  49           HBS      PRO  49  -7.955  11.654  11.654
  414   1HG   PRO  49           HGS      PRO  49  -9.914  12.951  12.951
  415   2HG   PRO  49           HGR      PRO  49  -9.948  12.500  12.500
  416   1HD   PRO  49           HDS      PRO  49 -11.270  11.303  11.303
  417   2HD   PRO  49           HDR      PRO  49 -11.307  10.862  10.862
  418    H    GLY  50           HN       GLY  50  -9.288  11.279  11.279
  419   1HA   GLY  50           HAR      GLY  50  -7.199  10.872  10.872
  420   2HA   GLY  50           HAS      GLY  50  -8.928  10.971  10.971
  421    H    LEU  51           HN       LEU  51  -9.518   8.642   8.642
  422    HA   LEU  51           HA       LEU  51  -9.477   6.583   6.583
  423   1HB   LEU  51           HBR      LEU  51 -10.994   7.238   7.238
  424   2HB   LEU  51           HBS      LEU  51  -9.896   6.118   6.118
  425    HG   LEU  51           HG       LEU  51 -11.672   5.464   5.464
  426   1HD1  LEU  51           HMD      LEU  51 -12.725   5.843   5.843
  427   2HD1  LEU  51           HMD      LEU  51 -11.862   4.364   4.364
  428   3HD1  LEU  51           HMD      LEU  51 -13.059   4.299   4.299
  429   1HD2  LEU  51           HMD      LEU  51  -9.443   4.077   4.077
  430   2HD2  LEU  51           HMD      LEU  51 -10.035   3.926   3.926
  431   3HD2  LEU  51           HMD      LEU  51 -10.890   3.097   3.097
  432    H    LEU  52           HN       LEU  52  -7.880   6.857   6.857
  433    HA   LEU  52           HA       LEU  52  -5.957   4.879   4.879
  434   1HB   LEU  52           HBS      LEU  52  -6.035   4.718   4.718
  435   2HB   LEU  52           HBR      LEU  52  -6.979   6.225   6.225
  436    HG   LEU  52           HG       LEU  52  -5.099   6.136   6.136
  437   1HD1  LEU  52           HMD      LEU  52  -5.961   8.266   8.266
  438   2HD1  LEU  52           HMD      LEU  52  -4.255   8.269   8.269
  439   3HD1  LEU  52           HMD      LEU  52  -4.664   8.338   8.338
  440   1HD2  LEU  52           HMD      LEU  52  -3.696   4.906   4.906
  441   2HD2  LEU  52           HMD      LEU  52  -2.936   5.831   5.831
  442   3HD2  LEU  52           HMD      LEU  52  -3.133   6.572   6.572
  443    H    GLU  53           HN       GLU  53  -6.128   8.199   8.199
  444    HA   GLU  53           HA       GLU  53  -3.407   8.918   8.918
  445   1HB   GLU  53           HBR      GLU  53  -5.758  10.092  10.092
  446   2HB   GLU  53           HBS      GLU  53  -5.471   9.701   9.701
  447   1HG   GLU  53           HGR      GLU  53  -3.419  11.061  11.061
  448   2HG   GLU  53           HGS      GLU  53  -3.896  11.557  11.557
  449    H    THR  54           HN       THR  54  -5.481   7.299   7.299
  450    HA   THR  54           HA       THR  54  -3.290   6.865   6.865
  451    HB   THR  54           HB       THR  54  -4.846   5.579   5.579
  452    HG1  THR  54           HG1      THR  54  -6.385   5.798   5.798
  453   1HG2  THR  54           HMG      THR  54  -5.481   8.186   8.186
  454   2HG2  THR  54           HMG      THR  54  -7.022   7.293   7.293
  455   3HG2  THR  54           HMG      THR  54  -6.058   7.306   7.306
  456    H    SER  55           HN       SER  55  -2.574   4.703   4.703
  457    HA   SER  55           HA       SER  55  -1.955   2.838   2.838
  458   1HB   SER  55           HBS      SER  55  -2.344   1.858   1.858
  459   2HB   SER  55           HBR      SER  55  -1.013   1.579   1.579
  460    HG   SER  55           HG       SER  55  -0.916   2.998   2.998
  461    H    GLU  56           HN       GLU  56  -4.668   3.143   3.143
  462    HA   GLU  56           HA       GLU  56  -5.526   0.441   0.441
  463   1HB   GLU  56           HBR      GLU  56  -6.884   2.998   2.998
  464   2HB   GLU  56           HBS      GLU  56  -7.692   1.534   1.534
  465   1HG   GLU  56           HGR      GLU  56  -5.972   0.616   0.616
  466   2HG   GLU  56           HGS      GLU  56  -5.619   2.353   2.353
  467    H    GLY  57           HN       GLY  57  -6.675   3.479   3.479
  468   1HA   GLY  57           HAR      GLY  57  -8.693   2.131   2.131
  469   2HA   GLY  57           HAS      GLY  57  -8.225   3.848   3.848
  470    H    CYS  58           HN       CYS  58  -5.340   3.107   3.107
  471    HA   CYS  58           HA       CYS  58  -5.106   2.497   2.497
  472   1HB   CYS  58           HBS      CYS  58  -3.468   3.732   3.732
  473   2HB   CYS  58           HBR      CYS  58  -2.902   2.104   2.104
  474    H    ARG  59           HN       ARG  59  -5.134   0.531   0.531
  475    HA   ARG  59           HA       ARG  59  -4.648  -1.928  -1.928
  476   1HB   ARG  59           HBR      ARG  59  -4.243  -1.559  -1.559
  477   2HB   ARG  59           HBS      ARG  59  -6.016  -1.608  -1.608
  478   1HG   ARG  59           HGR      ARG  59  -4.747  -3.884  -3.884
  479   2HG   ARG  59           HGS      ARG  59  -4.453  -3.759  -3.759
  480   1HD   ARG  59           HDR      ARG  59  -7.229  -3.282  -3.282
  481   2HD   ARG  59           HDS      ARG  59  -6.651  -4.877  -4.877
  482    HE   ARG  59           HE       ARG  59  -6.425  -5.549  -5.549
  483   1HH1  ARG  59           HH1      ARG  59  -7.382  -2.160  -2.160
  484   2HH1  ARG  59           HH1      ARG  59  -7.550  -2.007  -2.007
  485   1HH2  ARG  59           HH2      ARG  59  -6.528  -5.274  -5.274
  486   2HH2  ARG  59           HH2      ARG  59  -7.067  -3.769  -3.769
  487    H    GLN  60           HN       GLN  60  -7.389   0.111   0.111
  488    HA   GLN  60           HA       GLN  60  -9.433  -1.998  -1.998
  489   1HB   GLN  60           HBS      GLN  60  -9.912   0.073   0.073
  490   2HB   GLN  60           HBR      GLN  60  -9.778   1.003   1.003
  491   1HG   GLN  60           HGS      GLN  60 -11.698  -1.306  -1.306
  492   2HG   GLN  60           HGR      GLN  60 -12.114   0.375   0.375
  493   1HE2  GLN  60           HE2      GLN  60 -13.098  -0.644  -0.644
  494   2HE2  GLN  60           HE2      GLN  60 -13.204  -1.489  -1.489
  495    H    ILE  61           HN       ILE  61  -7.529   0.329   0.329
  496    HA   ILE  61           HA       ILE  61  -8.743  -0.435  -0.435
  497    HB   ILE  61           HB       ILE  61  -6.247   1.233   1.233
  498   1HG1  ILE  61           HG1      ILE  61  -7.984   2.497   2.497
  499   2HG1  ILE  61           HG1      ILE  61  -7.800   3.059   3.059
  500   1HG2  ILE  61           HMG      ILE  61  -6.263   0.003   0.003
  501   2HG2  ILE  61           HMG      ILE  61  -7.528   1.176   1.176
  502   3HG2  ILE  61           HMG      ILE  61  -5.918   1.752   1.752
  503   1HD1  ILE  61           HMD      ILE  61  -9.830   0.941   0.941
  504   2HD1  ILE  61           HMD      ILE  61 -10.168   2.672   2.672
  505   3HD1  ILE  61           HMD      ILE  61  -9.810   2.077   2.077
  506    H    LEU  62           HN       LEU  62  -5.435  -0.917  -0.917
  507    HA   LEU  62           HA       LEU  62  -4.555  -2.417  -2.417
  508   1HB   LEU  62           HBR      LEU  62  -3.349  -1.237  -1.237
  509   2HB   LEU  62           HBS      LEU  62  -3.495  -2.826  -2.826
  510    HG   LEU  62           HG       LEU  62  -2.171  -3.851  -3.851
  511   1HD1  LEU  62           HMD      LEU  62  -2.917  -1.762  -1.762
  512   2HD1  LEU  62           HMD      LEU  62  -1.295  -1.223  -1.223
  513   3HD1  LEU  62           HMD      LEU  62  -1.496  -2.788  -2.788
  514   1HD2  LEU  62           HMD      LEU  62  -1.089  -1.412  -1.412
  515   2HD2  LEU  62           HMD      LEU  62  -0.988  -3.122  -3.122
  516   3HD2  LEU  62           HMD      LEU  62  -0.046  -2.539  -2.539
  517    H    GLY  63           HN       GLY  63  -6.499  -3.349  -3.349
  518   1HA   GLY  63           HAR      GLY  63  -6.362  -6.192  -6.192
  519   2HA   GLY  63           HAS      GLY  63  -7.580  -5.330  -5.330
  520    H    GLN  64           HN       GLN  64  -8.944  -3.762  -3.762
  521    HA   GLN  64           HA       GLN  64 -10.555  -5.461  -5.461
  522   1HB   GLN  64           HBS      GLN  64 -10.853  -2.957  -2.957
  523   2HB   GLN  64           HBR      GLN  64 -10.743  -2.617  -2.617
  524   1HG   GLN  64           HGR      GLN  64 -12.798  -3.384  -3.384
  525   2HG   GLN  64           HGS      GLN  64 -12.471  -4.887  -4.887
  526   1HE2  GLN  64           HE2      GLN  64 -14.724  -1.908  -1.908
  527   2HE2  GLN  64           HE2      GLN  64 -14.021  -1.841  -1.841
  528    H    LEU  65           HN       LEU  65  -7.587  -4.005  -4.005
  529    HA   LEU  65           HA       LEU  65  -8.321  -3.393  -3.393
  530   1HB   LEU  65           HBR      LEU  65  -7.306  -1.830  -1.830
  531   2HB   LEU  65           HBS      LEU  65  -5.788  -2.753  -2.753
  532    HG   LEU  65           HG       LEU  65  -5.909  -2.136  -2.136
  533   1HD1  LEU  65           HMD      LEU  65  -8.323  -0.864  -0.864
  534   2HD1  LEU  65           HMD      LEU  65  -7.212   0.331   0.331
  535   3HD1  LEU  65           HMD      LEU  65  -7.748  -1.074  -1.074
  536   1HD2  LEU  65           HMD      LEU  65  -4.648  -1.076  -1.076
  537   2HD2  LEU  65           HMD      LEU  65  -4.543  -0.358  -0.358
  538   3HD2  LEU  65           HMD      LEU  65  -5.661   0.329   0.329
  539    H    GLN  66           HN       GLN  66  -5.973  -5.354  -5.354
  540    HA   GLN  66           HA       GLN  66  -4.498  -6.368  -6.368
  541   1HB   GLN  66           HBR      GLN  66  -4.877  -7.062  -7.062
  542   2HB   GLN  66           HBS      GLN  66  -5.210  -8.555  -8.555
  543   1HG   GLN  66           HGS      GLN  66  -2.715  -6.859  -6.859
  544   2HG   GLN  66           HGR      GLN  66  -2.845  -8.310  -8.310
  545   1HE2  GLN  66           HE2      GLN  66  -3.488 -10.385 -10.385
  546   2HE2  GLN  66           HE2      GLN  66  -4.446  -9.896  -9.896
  547    HA   PRO  67           HA       PRO  67  -8.149  -9.504  -9.504
  548   1HB   PRO  67           HBS      PRO  67 -10.313  -8.181  -8.181
  549   2HB   PRO  67           HBR      PRO  67  -9.967  -9.786  -9.786
  550   1HG   PRO  67           HGS      PRO  67  -9.737  -8.132  -8.132
  551   2HG   PRO  67           HGR      PRO  67  -8.970  -9.610  -9.610
  552   1HD   PRO  67           HDS      PRO  67  -7.860  -7.045  -7.045
  553   2HD   PRO  67           HDR      PRO  67  -7.086  -8.470  -8.470
  554    H    SER  68           HN       SER  68  -8.761  -6.108  -6.108
  555    HA   SER  68           HA       SER  68 -10.610  -6.021  -6.021
  556   1HB   SER  68           HBR      SER  68  -9.556  -4.156  -4.156
  557   2HB   SER  68           HBS      SER  68  -9.746  -3.426  -3.426
  558    HG   SER  68           HG       SER  68 -11.641  -3.073  -3.073
  559    H    LEU  69           HN       LEU  69  -7.217  -6.147  -6.147
  560    HA   LEU  69           HA       LEU  69  -6.495  -4.301  -4.301
  561   1HB   LEU  69           HBR      LEU  69  -5.140  -6.617  -6.617
  562   2HB   LEU  69           HBS      LEU  69  -4.340  -5.603  -5.603
  563    HG   LEU  69           HG       LEU  69  -5.437  -4.592  -4.592
  564   1HD1  LEU  69           HMD      LEU  69  -3.144  -6.103  -6.103
  565   2HD1  LEU  69           HMD      LEU  69  -2.556  -4.423  -4.423
  566   3HD1  LEU  69           HMD      LEU  69  -3.455  -4.992  -4.992
  567   1HD2  LEU  69           HMD      LEU  69  -5.204  -3.184  -3.184
  568   2HD2  LEU  69           HMD      LEU  69  -4.705  -2.513  -2.513
  569   3HD2  LEU  69           HMD      LEU  69  -3.481  -3.169  -3.169
  570    H    GLN  70           HN       GLN  70  -7.320  -7.730  -7.730
  571    HA   GLN  70           HA       GLN  70  -6.634  -8.520  -8.520
  572   1HB   GLN  70           HBR      GLN  70  -8.082 -10.382 -10.382
  573   2HB   GLN  70           HBS      GLN  70  -7.287 -10.072 -10.072
  574   1HG   GLN  70           HGR      GLN  70  -9.572  -8.653  -8.653
  575   2HG   GLN  70           HGS      GLN  70 -10.145  -9.945  -9.945
  576   1HE2  GLN  70           HE2      GLN  70  -8.940 -12.495 -12.495
  577   2HE2  GLN  70           HE2      GLN  70  -8.352 -11.967 -11.967
  578    H    THR  71           HN       THR  71  -9.074  -6.376  -6.376
  579    HA   THR  71           HA       THR  71 -10.207  -6.204  -6.204
  580    HB   THR  71           HB       THR  71 -11.464  -7.960  -7.960
  581    HG1  THR  71           HG1      THR  71 -12.698  -5.544  -5.544
  582   1HG2  THR  71           HMG      THR  71 -12.119  -5.806  -5.806
  583   2HG2  THR  71           HMG      THR  71 -12.902  -7.403  -7.403
  584   3HG2  THR  71           HMG      THR  71 -11.166  -7.288  -7.288
  585    H    GLY  72           HN       GLY  72  -8.602  -4.493  -4.493
  586   1HA   GLY  72           HAR      GLY  72 -10.266  -2.054  -2.054
  587   2HA   GLY  72           HAS      GLY  72  -8.711  -2.162  -2.162
  588    H    SER  73           HN       SER  73  -6.784  -2.662  -2.662
  589    HA   SER  73           HA       SER  73  -6.696  -2.857  -2.857
  590   1HB   SER  73           HBR      SER  73  -5.824  -0.626  -0.626
  591   2HB   SER  73           HBS      SER  73  -7.568  -0.669  -0.669
  592    HG   SER  73           HG       SER  73  -6.592   1.209   1.209
  593    H    GLU  74           HN       GLU  74  -4.443  -2.270  -2.270
  594    HA   GLU  74           HA       GLU  74  -2.233  -2.903  -2.903
  595   1HB   GLU  74           HBS      GLU  74  -0.995  -2.652  -2.652
  596   2HB   GLU  74           HBR      GLU  74  -2.417  -3.185  -3.185
  597   1HG   GLU  74           HGR      GLU  74  -2.298  -1.507  -1.507
  598   2HG   GLU  74           HGS      GLU  74  -2.400  -0.387  -0.387
  599    H    GLU  75           HN       GLU  75  -4.230  -0.169  -0.169
  600    HA   GLU  75           HA       GLU  75  -2.387   1.818   1.818
  601   1HB   GLU  75           HBS      GLU  75  -4.810   1.520   1.520
  602   2HB   GLU  75           HBR      GLU  75  -5.273   2.347   2.347
  603   1HG   GLU  75           HGR      GLU  75  -4.852   3.620   3.620
  604   2HG   GLU  75           HGS      GLU  75  -4.175   4.235   4.235
  605    H    LEU  76           HN       LEU  76  -4.942  -0.135  -0.135
  606    HA   LEU  76           HA       LEU  76  -4.913   1.142   1.142
  607   1HB   LEU  76           HBS      LEU  76  -6.409  -0.777  -0.777
  608   2HB   LEU  76           HBR      LEU  76  -5.434  -1.752  -1.752
  609    HG   LEU  76           HG       LEU  76  -7.429   0.426   0.426
  610   1HD1  LEU  76           HMD      LEU  76  -7.552  -2.411  -2.411
  611   2HD1  LEU  76           HMD      LEU  76  -7.697  -1.999  -1.999
  612   3HD1  LEU  76           HMD      LEU  76  -8.818  -1.281  -1.281
  613   1HD2  LEU  76           HMD      LEU  76  -5.178   0.335   0.335
  614   2HD2  LEU  76           HMD      LEU  76  -6.730   0.425   0.425
  615   3HD2  LEU  76           HMD      LEU  76  -5.883  -1.137  -1.137
  616    H    ARG  77           HN       ARG  77  -3.051  -1.368  -1.368
  617    HA   ARG  77           HA       ARG  77  -1.731  -2.422  -2.422
  618   1HB   ARG  77           HBS      ARG  77  -1.885  -3.148  -3.148
  619   2HB   ARG  77           HBR      ARG  77  -0.227  -2.491  -2.491
  620   1HG   ARG  77           HGS      ARG  77  -1.321  -4.608  -4.608
  621   2HG   ARG  77           HGR      ARG  77  -0.437  -4.976  -4.976
  622   1HD   ARG  77           HDS      ARG  77   1.077  -3.050  -3.050
  623   2HD   ARG  77           HDR      ARG  77   0.566  -4.264  -4.264
  624    HE   ARG  77           HE       ARG  77   2.512  -4.619  -4.619
  625   1HH1  ARG  77           HH1      ARG  77  -0.165  -6.356  -6.356
  626   2HH1  ARG  77           HH1      ARG  77   0.624  -7.893  -7.893
  627   1HH2  ARG  77           HH2      ARG  77   3.565  -6.626  -6.626
  628   2HH2  ARG  77           HH2      ARG  77   2.734  -8.047  -8.047
  629    H    SER  78           HN       SER  78  -0.987   0.163   0.163
  630    HA   SER  78           HA       SER  78   1.429   1.084   1.084
  631   1HB   SER  78           HBR      SER  78  -0.146   1.877   1.877
  632   2HB   SER  78           HBS      SER  78  -0.380   3.191   3.191
  633    HG   SER  78           HG       SER  78   1.319   3.935   3.935
  634    H    LEU  79           HN       LEU  79  -1.998   1.821   1.821
  635    HA   LEU  79           HA       LEU  79  -1.648   3.461   3.461
  636   1HB   LEU  79           HBS      LEU  79  -3.724   1.929   1.929
  637   2HB   LEU  79           HBR      LEU  79  -3.909   1.859   1.859
  638    HG   LEU  79           HG       LEU  79  -5.273   3.627   3.627
  639   1HD1  LEU  79           HMD      LEU  79  -3.446   4.030   4.030
  640   2HD1  LEU  79           HMD      LEU  79  -2.857   5.236   5.236
  641   3HD1  LEU  79           HMD      LEU  79  -4.526   5.333   5.333
  642   1HD2  LEU  79           HMD      LEU  79  -2.986   4.052   4.052
  643   2HD2  LEU  79           HMD      LEU  79  -4.736   4.257   4.257
  644   3HD2  LEU  79           HMD      LEU  79  -3.808   5.527   5.527
  645    H    TYR  80           HN       TYR  80  -1.242   0.015   0.015
  646    HA   TYR  80           HA       TYR  80  -1.740  -0.567  -0.567
  647   1HB   TYR  80           HBS      TYR  80  -2.518  -2.101  -2.101
  648   2HB   TYR  80           HBR      TYR  80  -0.850  -2.331  -2.331
  649    HD1  TYR  80           HD1      TYR  80  -3.078  -2.949  -2.949
  650    HD2  TYR  80           HD2      TYR  80   0.606  -3.885  -3.885
  651    HE1  TYR  80           HE1      TYR  80  -2.724  -4.781  -4.781
  652    HE2  TYR  80           HE2      TYR  80   0.989  -5.696  -5.696
  653    HH   TYR  80           HH       TYR  80  -0.902  -7.239  -7.239
  654    H    ASN  81           HN       ASN  81   1.013   0.084   0.084
  655    HA   ASN  81           HA       ASN  81   2.918  -0.711  -0.711
  656   1HB   ASN  81           HBS      ASN  81   4.631   0.191   0.191
  657   2HB   ASN  81           HBR      ASN  81   3.522  -0.651  -0.651
  658   1HD2  ASN  81           HD2      ASN  81   4.036   2.140   2.140
  659   2HD2  ASN  81           HD2      ASN  81   4.479   0.496   0.496
  660    H    THR  82           HN       THR  82   1.348   2.279   2.279
  661    HA   THR  82           HA       THR  82   2.655   3.888   3.888
  662    HB   THR  82           HB       THR  82   0.035   5.027   5.027
  663    HG1  THR  82           HG1      THR  82   1.660   3.967   3.967
  664   1HG2  THR  82           HMG      THR  82   2.740   5.841   5.841
  665   2HG2  THR  82           HMG      THR  82   2.106   6.189   6.189
  666   3HG2  THR  82           HMG      THR  82   1.265   6.823   6.823
  667    H    ILE  83           HN       ILE  83  -0.394   2.124   2.124
  668    HA   ILE  83           HA       ILE  83  -1.022   3.201   3.201
  669    HB   ILE  83           HB       ILE  83  -2.123   1.037   1.037
  670   1HG1  ILE  83           HG1      ILE  83  -2.729   3.328   3.328
  671   2HG1  ILE  83           HG1      ILE  83  -4.150   2.427   2.427
  672   1HG2  ILE  83           HMG      ILE  83  -2.156   0.277   0.277
  673   2HG2  ILE  83           HMG      ILE  83  -3.549   1.391   1.391
  674   3HG2  ILE  83           HMG      ILE  83  -3.527   0.013   0.013
  675   1HD1  ILE  83           HMD      ILE  83  -3.466   3.290   3.290
  676   2HD1  ILE  83           HMD      ILE  83  -2.406   4.431   4.431
  677   3HD1  ILE  83           HMD      ILE  83  -4.172   4.480   4.480
  678    H    ALA  84           HN       ALA  84   0.417   0.077   0.077
  679    HA   ALA  84           HA       ALA  84   0.737  -0.932  -0.932
  680   1HB   ALA  84           HMB      ALA  84   1.902  -1.574  -1.574
  681   2HB   ALA  84           HMB      ALA  84   2.750  -2.163  -2.163
  682   3HB   ALA  84           HMB      ALA  84   1.047  -2.605  -2.605
  683    H    VAL  85           HN       VAL  85   2.730   1.181   1.181
  684    HA   VAL  85           HA       VAL  85   4.951   1.349   1.349
  685    HB   VAL  85           HB       VAL  85   3.975   3.212   3.212
  686   1HG1  VAL  85           HMG      VAL  85   5.360   4.283   4.283
  687   2HG1  VAL  85           HMG      VAL  85   6.723   3.348   3.348
  688   3HG1  VAL  85           HMG      VAL  85   5.877   4.535   4.535
  689   1HG2  VAL  85           HMG      VAL  85   5.289   0.737   0.737
  690   2HG2  VAL  85           HMG      VAL  85   5.034   1.918   1.918
  691   3HG2  VAL  85           HMG      VAL  85   6.527   1.970   1.970
  692    H    LEU  86           HN       LEU  86   2.208   3.558   3.558
  693    HA   LEU  86           HA       LEU  86   2.871   5.363   5.363
  694   1HB   LEU  86           HBS      LEU  86   1.246   5.474   5.474
  695   2HB   LEU  86           HBR      LEU  86   0.029   4.922   4.922
  696    HG   LEU  86           HG       LEU  86   0.191   6.899   6.899
  697   1HD1  LEU  86           HMD      LEU  86   2.697   7.419   7.419
  698   2HD1  LEU  86           HMD      LEU  86   1.826   8.724   8.724
  699   3HD1  LEU  86           HMD      LEU  86   2.497   7.359   7.359
  700   1HD2  LEU  86           HMD      LEU  86  -0.951   6.928   6.928
  701   2HD2  LEU  86           HMD      LEU  86  -0.489   8.520   8.520
  702   3HD2  LEU  86           HMD      LEU  86   0.492   7.763   7.763
  703    H    TYR  87           HN       TYR  87   1.082   2.353   2.353
  704    HA   TYR  87           HA       TYR  87   0.540   2.461   2.461
  705   1HB   TYR  87           HBS      TYR  87  -0.349   0.741   0.741
  706   2HB   TYR  87           HBR      TYR  87   1.209  -0.117  -0.117
  707    HD1  TYR  87           HD1      TYR  87   1.891  -0.208  -0.208
  708    HD2  TYR  87           HD2      TYR  87  -2.077   0.130   0.130
  709    HE1  TYR  87           HE1      TYR  87   1.016  -0.934  -0.934
  710    HE2  TYR  87           HE2      TYR  87  -2.959  -0.303  -0.303
  711    HH   TYR  87           HH       TYR  87  -0.932  -1.890  -1.890
  712    H    CYS  88           HN       CYS  88   3.392   1.336   1.336
  713    HA   CYS  88           HA       CYS  88   4.955   0.469   0.469
  714   1HB   CYS  88           HBS      CYS  88   5.233   0.721   0.721
  715   2HB   CYS  88           HBR      CYS  88   6.496   1.774   1.774
  716    H    VAL  89           HN       VAL  89   4.269   3.638   3.638
  717    HA   VAL  89           HA       VAL  89   6.333   4.912   4.912
  718    HB   VAL  89           HB       VAL  89   4.170   6.274   6.274
  719   1HG1  VAL  89           HMG      VAL  89   6.503   7.179   7.179
  720   2HG1  VAL  89           HMG      VAL  89   6.664   7.542   7.542
  721   3HG1  VAL  89           HMG      VAL  89   5.243   8.119   8.119
  722   1HG2  VAL  89           HMG      VAL  89   6.027   4.402   4.402
  723   2HG2  VAL  89           HMG      VAL  89   4.928   5.480   5.480
  724   3HG2  VAL  89           HMG      VAL  89   6.578   6.020   6.020
  725    H    HIS  90           HN       HIS  90   2.786   4.682   4.682
  726    HA   HIS  90           HA       HIS  90   2.399   6.586   6.586
  727   1HB   HIS  90           HBS      HIS  90   0.589   4.288   4.288
  728   2HB   HIS  90           HBR      HIS  90   0.153   5.575   5.575
  729    HD1  HIS  90           HD1      HIS  90   1.176   8.079   8.079
  730    HD2  HIS  90           HD2      HIS  90  -1.060   4.986   4.986
  731    HE1  HIS  90           HE1      HIS  90  -0.018   9.055   9.055
  732    HE2  HIS  90           HE2      HIS  90  -1.431   7.205   7.205
  733    H    GLN  91           HN       GLN  91   3.246   3.202   3.202
  734    HA   GLN  91           HA       GLN  91   2.564   2.480   2.480
  735   1HB   GLN  91           HBS      GLN  91   2.970   0.861   0.861
  736   2HB   GLN  91           HBR      GLN  91   4.709   1.224   1.224
  737   1HG   GLN  91           HGR      GLN  91   3.030   0.300   0.300
  738   2HG   GLN  91           HGS      GLN  91   3.778  -0.855  -0.855
  739   1HE2  GLN  91           HE2      GLN  91   5.837   0.798   0.798
  740   2HE2  GLN  91           HE2      GLN  91   4.194   1.225   1.225
  741    H    ARG  92           HN       ARG  92   5.578   3.525   3.525
  742    HA   ARG  92           HA       ARG  92   7.116   4.461   4.461
  743   1HB   ARG  92           HBR      ARG  92   6.590   2.500   2.500
  744   2HB   ARG  92           HBS      ARG  92   7.221   1.428   1.428
  745   1HG   ARG  92           HGS      ARG  92   9.253   3.323   3.323
  746   2HG   ARG  92           HGR      ARG  92   8.616   2.696   2.696
  747   1HD   ARG  92           HDS      ARG  92   8.782   0.394   0.394
  748   2HD   ARG  92           HDR      ARG  92   9.963   1.268   1.268
  749    HE   ARG  92           HE       ARG  92  10.409   0.272   0.272
  750   1HH1  ARG  92           HH1      ARG  92  11.264   2.890   2.890
  751   2HH1  ARG  92           HH1      ARG  92  12.657   3.352   3.352
  752   1HH2  ARG  92           HH2      ARG  92  12.169   0.984   0.984
  753   2HH2  ARG  92           HH2      ARG  92  13.174   2.272   2.272
  754    H    ILE  93           HN       ILE  93   6.963   1.897   1.897
  755    HA   ILE  93           HA       ILE  93   9.843   1.767   1.767
  756    HB   ILE  93           HB       ILE  93   7.549   0.691   0.691
  757   1HG1  ILE  93           HG1      ILE  93   8.652  -1.408  -1.408
  758   2HG1  ILE  93           HG1      ILE  93   8.428  -0.042  -0.042
  759   1HG2  ILE  93           HMG      ILE  93  10.477  -0.049  -0.049
  760   2HG2  ILE  93           HMG      ILE  93   9.233  -1.051  -1.051
  761   3HG2  ILE  93           HMG      ILE  93   9.570   0.594   0.594
  762   1HD1  ILE  93           HMD      ILE  93   6.217  -0.918  -0.918
  763   2HD1  ILE  93           HMD      ILE  93   6.500  -1.728  -1.728
  764   3HD1  ILE  93           HMD      ILE  93   6.116   0.013   0.013
  765    H    ASP  94           HN       ASP  94  10.866   2.363   2.363
  766    HA   ASP  94           HA       ASP  94   9.308   4.105   4.105
  767   1HB   ASP  94           HBS      ASP  94  10.847   5.842   5.842
  768   2HB   ASP  94           HBR      ASP  94  10.554   5.642   5.642
  769    H    VAL  95           HN       VAL  95  10.001   4.114   4.114
  770    HA   VAL  95           HA       VAL  95  11.749   1.783   1.783
  771    HB   VAL  95           HB       VAL  95  10.156   0.766   0.766
  772   1HG1  VAL  95           HMG      VAL  95   8.939   2.055   2.055
  773   2HG1  VAL  95           HMG      VAL  95   7.915   1.071   1.071
  774   3HG1  VAL  95           HMG      VAL  95   9.360   0.354   0.354
  775   1HG2  VAL  95           HMG      VAL  95   8.823   3.436   3.436
  776   2HG2  VAL  95           HMG      VAL  95   9.354   2.246   2.246
  777   3HG2  VAL  95           HMG      VAL  95   7.912   1.923   1.923
  778    H    LYS  96           HN       LYS  96  11.740   1.635   1.635
  779    HA   LYS  96           HA       LYS  96  12.887   4.132   4.132
  780   1HB   LYS  96           HBR      LYS  96  14.644   2.550   2.550
  781   2HB   LYS  96           HBS      LYS  96  14.844   1.949   1.949
  782   1HG   LYS  96           HGS      LYS  96  15.659   3.981   3.981
  783   2HG   LYS  96           HGR      LYS  96  14.900   4.914   4.914
  784   1HD   LYS  96           HDS      LYS  96  17.356   3.150   3.150
  785   2HD   LYS  96           HDR      LYS  96  17.277   4.882   4.882
  786   1HE   LYS  96           HES      LYS  96  17.423   4.407   4.407
  787   2HE   LYS  96           HER      LYS  96  15.653   4.241   4.241
  788   1HZ   LYS  96           HZC      LYS  96  16.955   1.842   1.842
  789   2HZ   LYS  96           HZA      LYS  96  17.410   2.327   2.327
  790   3HZ   LYS  96           HZB      LYS  96  15.827   2.124   2.124
  791    H    ASP  97           HN       ASP  97  12.429   0.623   0.623
  792    HA   ASP  97           HA       ASP  97  11.412   1.227   1.227
  793   1HB   ASP  97           HBS      ASP  97  13.210  -0.300  -0.300
  794   2HB   ASP  97           HBR      ASP  97  12.526  -1.325  -1.325
  795    H    THR  98           HN       THR  98   9.461   0.332   0.332
  796    HA   THR  98           HA       THR  98   7.301  -0.064  -0.064
  797    HB   THR  98           HB       THR  98   7.914  -1.389  -1.389
  798    HG1  THR  98           HG1      THR  98   7.874   0.402   0.402
  799   1HG2  THR  98           HMG      THR  98   5.416  -1.476  -1.476
  800   2HG2  THR  98           HMG      THR  98   5.303  -1.401  -1.401
  801   3HG2  THR  98           HMG      THR  98   6.174  -2.746  -2.746
  802    H    LYS  99           HN       LYS  99   8.807  -2.890  -2.890
  803    HA   LYS  99           HA       LYS  99   7.338  -4.674  -4.674
  804   1HB   LYS  99           HBS      LYS  99   8.678  -6.449  -6.449
  805   2HB   LYS  99           HBR      LYS  99   8.322  -5.262  -5.262
  806   1HG   LYS  99           HGR      LYS  99  10.856  -4.670  -4.670
  807   2HG   LYS  99           HGS      LYS  99  10.823  -6.336  -6.336
  808   1HD   LYS  99           HDS      LYS  99  10.042  -5.402  -5.402
  809   2HD   LYS  99           HDR      LYS  99  10.269  -3.803  -3.803
  810   1HE   LYS  99           HES      LYS  99  12.401  -5.880  -5.880
  811   2HE   LYS  99           HER      LYS  99  12.163  -4.327  -4.327
  812   1HZ   LYS  99           HZC      LYS  99  12.454  -4.139  -4.139
  813   2HZ   LYS  99           HZA      LYS  99  13.788  -4.657  -4.657
  814   3HZ   LYS  99           HZB      LYS  99  13.112  -3.225  -3.225
  815    H    GLU 100           HN       GLU 100  10.265  -2.988  -2.988
  816    HA   GLU 100           HA       GLU 100  11.111  -4.593  -4.593
  817   1HB   GLU 100           HBS      GLU 100  11.946  -2.543  -2.543
  818   2HB   GLU 100           HBR      GLU 100  11.521  -1.639  -1.639
  819   1HG   GLU 100           HGR      GLU 100  13.765  -1.925  -1.925
  820   2HG   GLU 100           HGS      GLU 100  13.071  -3.271  -3.271
  821    H    ALA 101           HN       ALA 101   9.117  -1.626  -1.626
  822    HA   ALA 101           HA       ALA 101   8.228  -1.615  -1.615
  823   1HB   ALA 101           HMB      ALA 101   7.967   0.161   0.161
  824   2HB   ALA 101           HMB      ALA 101   6.490  -0.764  -0.764
  825   3HB   ALA 101           HMB      ALA 101   6.705  -0.038  -0.038
  826    H    LEU 102           HN       LEU 102   6.759  -2.863  -2.863
  827    HA   LEU 102           HA       LEU 102   4.464  -3.867  -3.867
  828   1HB   LEU 102           HBS      LEU 102   5.040  -3.335  -3.335
  829   2HB   LEU 102           HBR      LEU 102   5.619  -5.024  -5.024
  830    HG   LEU 102           HG       LEU 102   3.216  -5.543  -5.543
  831   1HD1  LEU 102           HMD      LEU 102   3.043  -2.766  -2.766
  832   2HD1  LEU 102           HMD      LEU 102   2.180  -3.475  -3.475
  833   3HD1  LEU 102           HMD      LEU 102   1.701  -3.906  -3.906
  834   1HD2  LEU 102           HMD      LEU 102   4.524  -5.782  -5.782
  835   2HD2  LEU 102           HMD      LEU 102   2.858  -6.346  -6.346
  836   3HD2  LEU 102           HMD      LEU 102   3.144  -4.767  -4.767
  837    H    ASP 103           HN       ASP 103   7.658  -5.092  -5.092
  838    HA   ASP 103           HA       ASP 103   6.926  -7.805  -7.805
  839   1HB   ASP 103           HBR      ASP 103   9.090  -7.173  -7.173
  840   2HB   ASP 103           HBS      ASP 103   9.599  -6.494  -6.494
  841    H    LYS 104           HN       LYS 104   8.574  -5.160  -5.160
  842    HA   LYS 104           HA       LYS 104   8.044  -6.022  -6.022
  843   1HB   LYS 104           HBS      LYS 104   9.270  -3.868  -3.868
  844   2HB   LYS 104           HBR      LYS 104   7.849  -3.100  -3.100
  845   1HG   LYS 104           HGR      LYS 104   9.731  -4.965  -4.965
  846   2HG   LYS 104           HGS      LYS 104   9.964  -3.195  -3.195
  847   1HD   LYS 104           HDS      LYS 104   7.707  -2.895  -2.895
  848   2HD   LYS 104           HDR      LYS 104   7.563  -4.625  -4.625
  849   1HE   LYS 104           HES      LYS 104   9.628  -2.916  -2.916
  850   2HE   LYS 104           HER      LYS 104   8.182  -3.668  -3.668
  851   1HZ   LYS 104           HZB      LYS 104   9.186  -5.808  -5.808
  852   2HZ   LYS 104           HZC      LYS 104  10.580  -4.987  -4.987
  853   3HZ   LYS 104           HZA      LYS 104   9.929  -5.094  -5.094
  854    H    ILE 105           HN       ILE 105   5.857  -4.706  -4.706
  855    HA   ILE 105           HA       ILE 105   3.784  -4.196  -4.196
  856    HB   ILE 105           HB       ILE 105   3.753  -4.213  -4.213
  857   1HG1  ILE 105           HG1      ILE 105   5.220  -2.546  -2.546
  858   2HG1  ILE 105           HG1      ILE 105   3.819  -1.784  -1.784
  859   1HG2  ILE 105           HMG      ILE 105   1.563  -3.814  -3.814
  860   2HG2  ILE 105           HMG      ILE 105   1.713  -2.589  -2.589
  861   3HG2  ILE 105           HMG      ILE 105   1.504  -4.309  -4.309
  862   1HD1  ILE 105           HMD      ILE 105   2.743  -1.818  -1.818
  863   2HD1  ILE 105           HMD      ILE 105   4.407  -2.077  -2.077
  864   3HD1  ILE 105           HMD      ILE 105   4.009  -0.609  -0.609
  865    H    GLU 106           HN       GLU 106   4.137  -6.536  -6.536
  866    HA   GLU 106           HA       GLU 106   2.116  -8.253  -8.253
  867   1HB   GLU 106           HBR      GLU 106   3.643  -8.171  -8.171
  868   2HB   GLU 106           HBS      GLU 106   4.852  -8.831  -8.831
  869   1HG   GLU 106           HGS      GLU 106   4.332 -10.838 -10.838
  870   2HG   GLU 106           HGR      GLU 106   2.566 -10.593 -10.593
  871    H    GLU 107           HN       GLU 107   5.191  -7.868  -7.868
  872    HA   GLU 107           HA       GLU 107   5.059 -10.583 -10.583
  873   1HB   GLU 107           HBR      GLU 107   6.963  -9.014  -9.014
  874   2HB   GLU 107           HBS      GLU 107   7.324  -8.774  -8.774
  875   1HG   GLU 107           HGS      GLU 107   7.242 -11.397 -11.397
  876   2HG   GLU 107           HGR      GLU 107   7.896 -11.094 -11.094
  877    H    GLU 108           HN       GLU 108   4.545  -7.298  -7.298
  878    HA   GLU 108           HA       GLU 108   5.005  -7.834  -7.834
  879   1HB   GLU 108           HBR      GLU 108   6.767  -6.360  -6.360
  880   2HB   GLU 108           HBS      GLU 108   5.610  -5.191  -5.191
  881   1HG   GLU 108           HGS      GLU 108   6.464  -6.521  -6.521
  882   2HG   GLU 108           HGR      GLU 108   7.738  -5.583  -5.583
  883    H    GLN 109           HN       GLN 109   3.745  -5.617  -5.617
  884    HA   GLN 109           HA       GLN 109   1.259  -5.165  -5.165
  885   1HB   GLN 109           HBR      GLN 109   2.402  -4.022  -4.022
  886   2HB   GLN 109           HBS      GLN 109   0.931  -4.876  -4.876
  887   1HG   GLN 109           HGS      GLN 109   1.159  -2.732  -2.732
  888   2HG   GLN 109           HGR      GLN 109   0.362  -2.613  -2.613
  889   1HE2  GLN 109           HE2      GLN 109  -2.615  -4.201  -4.201
  890   2HE2  GLN 109           HE2      GLN 109  -1.570  -3.774  -3.774
  891    H    ASN 110           HN       ASN 110  -0.553  -5.762  -5.762
  892    HA   ASN 110           HA       ASN 110  -1.065  -8.453  -8.453
  893   1HB   ASN 110           HBS      ASN 110  -3.218  -8.254  -8.254
  894   2HB   ASN 110           HBR      ASN 110  -2.816  -6.738  -6.738
  895   1HD2  ASN 110           HD2      ASN 110  -4.423  -6.118  -6.118
  896   2HD2  ASN 110           HD2      ASN 110  -4.847  -7.130  -7.130
  897    H    LYS 111           HN       LYS 111  -0.784 -10.302 -10.302
  898    HA   LYS 111           HA       LYS 111   0.391 -10.299 -10.299
  899   1HB   LYS 111           HBR      LYS 111   1.512 -11.487 -11.487
  900   2HB   LYS 111           HBS      LYS 111   0.093 -12.562 -12.562
  901   1HG   LYS 111           HGR      LYS 111   0.950 -12.562 -12.562
  902   2HG   LYS 111           HGS      LYS 111   2.384 -12.820 -12.820
  903   1HD   LYS 111           HDS      LYS 111   1.403 -14.700 -14.700
  904   2HD   LYS 111           HDR      LYS 111  -0.157 -14.367 -14.367
  905   1HE   LYS 111           HES      LYS 111   0.719 -16.183 -16.183
  906   2HE   LYS 111           HER      LYS 111   0.832 -14.744 -14.744
  907   1HZ   LYS 111           HZA      LYS 111   3.139 -15.187 -15.187
  908   2HZ   LYS 111           HZB      LYS 111   2.850 -16.404 -16.404
  909   3HZ   LYS 111           HZC      LYS 111   3.026 -14.875 -14.875
  910    H    SER 112           HN       SER 112  -1.662 -12.721 -12.721
  911    HA   SER 112           HA       SER 112  -3.345 -14.049 -14.049
  912   1HB   SER 112           HBS      SER 112  -3.885 -11.606 -11.606
  913   2HB   SER 112           HBR      SER 112  -4.828 -13.113 -13.113
  914    HG   SER 112           HG       SER 112  -4.285 -11.809 -11.809
  915    H    LYS 113           HN       LYS 113  -4.259 -14.756 -14.756
  916    HA   LYS 113           HA       LYS 113  -1.866 -15.678 -15.678
  917   1HB   LYS 113           HBR      LYS 113  -4.399 -16.814 -16.814
  918   2HB   LYS 113           HBS      LYS 113  -4.377 -16.415 -16.415
  919   1HG   LYS 113           HGR      LYS 113  -1.961 -17.576 -17.576
  920   2HG   LYS 113           HGS      LYS 113  -2.771 -18.412 -18.412
  921   1HD   LYS 113           HDS      LYS 113  -4.155 -18.244 -18.244
  922   2HD   LYS 113           HDR      LYS 113  -2.805 -19.330 -19.330
  923   1HE   LYS 113           HES      LYS 113  -4.677 -19.542 -19.542
  924   2HE   LYS 113           HER      LYS 113  -5.403 -19.891 -19.891
  925   1HZ   LYS 113           HZB      LYS 113  -2.858 -21.090 -21.090
  926   2HZ   LYS 113           HZC      LYS 113  -4.276 -21.765 -21.765
  927   3HZ   LYS 113           HZA      LYS 113  -3.918 -21.595 -21.595
  928    H    LYS 114           HN       LYS 114  -1.808 -15.442 -15.442
  929    HA   LYS 114           HA       LYS 114  -3.025 -12.874 -12.874
  930   1HB   LYS 114           HBR      LYS 114  -0.154 -13.778 -13.778
  931   2HB   LYS 114           HBS      LYS 114  -0.894 -12.251 -12.251
  932   1HG   LYS 114           HGR      LYS 114  -1.031 -12.827 -12.827
  933   2HG   LYS 114           HGS      LYS 114   0.575 -12.432 -12.432
  934   1HD   LYS 114           HDS      LYS 114  -0.004 -10.308 -10.308
  935   2HD   LYS 114           HDR      LYS 114  -1.689 -10.700 -10.700
  936   1HE   LYS 114           HES      LYS 114  -0.564 -10.859 -10.859
  937   2HE   LYS 114           HER      LYS 114  -0.858  -9.256  -9.256
  938   1HZ   LYS 114           HZB      LYS 114  -3.122 -10.314 -10.314
  939   2HZ   LYS 114           HZC      LYS 114  -2.771 -11.336 -11.336
  940   3HZ   LYS 114           HZA      LYS 114  -2.845  -9.727  -9.727
  941    H    LYS 115           HN       LYS 115  -4.491 -13.883 -13.883
  942    HA   LYS 115           HA       LYS 115  -5.263 -14.730 -14.730
  943   1HB   LYS 115           HBR      LYS 115  -2.439 -13.995 -13.995
  944   2HB   LYS 115           HBS      LYS 115  -3.790 -14.374 -14.374
  945   1HG   LYS 115           HGR      LYS 115  -4.711 -12.322 -12.322
  946   2HG   LYS 115           HGS      LYS 115  -4.380 -12.256 -12.256
  947   1HD   LYS 115           HDS      LYS 115  -2.735 -10.856 -10.856
  948   2HD   LYS 115           HDR      LYS 115  -1.885 -12.113 -12.113
  949   1HE   LYS 115           HES      LYS 115  -3.390 -11.352 -11.352
  950   2HE   LYS 115           HER      LYS 115  -3.465  -9.843  -9.843
  951   1HZ   LYS 115           HZA      LYS 115  -0.937 -11.171 -11.171
  952   2HZ   LYS 115           HZB      LYS 115  -1.607 -10.030 -10.030
  953   3HZ   LYS 115           HZC      LYS 115  -1.157  -9.654  -9.654
  954    H    ALA 116           HN       ALA 116  -4.238 -16.113 -16.113
  955    HA   ALA 116           HA       ALA 116  -3.015 -18.555 -18.555
  956   1HB   ALA 116           HMB      ALA 116  -4.956 -18.178 -18.178
  957   2HB   ALA 116           HMB      ALA 116  -3.899 -19.609 -19.609
  958   3HB   ALA 116           HMB      ALA 116  -5.050 -19.267 -19.267
  959    H    GLN 117           HN       GLN 117  -3.279 -16.888 -16.888
  960    HA   GLN 117           HA       GLN 117  -0.359 -17.029 -17.029
  961   1HB   GLN 117           HBR      GLN 117  -1.114 -19.222 -19.222
  962   2HB   GLN 117           HBS      GLN 117  -2.294 -18.467 -18.467
  963   1HG   GLN 117           HGS      GLN 117   0.408 -17.464 -17.464
  964   2HG   GLN 117           HGR      GLN 117   0.315 -19.239 -19.239
  965   1HE2  GLN 117           HE2      GLN 117  -1.284 -19.236 -19.236
  966   2HE2  GLN 117           HE2      GLN 117  -0.547 -20.118 -20.118
  967    H    GLN 118           HN       GLN 118   0.376 -15.333 -15.333
  968    HA   GLN 118           HA       GLN 118  -1.112 -14.207 -14.207
  969   1HB   GLN 118           HBR      GLN 118  -0.134 -12.154 -12.154
  970   2HB   GLN 118           HBS      GLN 118  -1.363 -12.038 -12.038
  971   1HG   GLN 118           HGS      GLN 118  -1.838 -13.762 -13.762
  972   2HG   GLN 118           HGR      GLN 118  -2.098 -11.996 -11.996
  973   1HE2  GLN 118           HE2      GLN 118  -5.138 -14.109 -14.109
  974   2HE2  GLN 118           HE2      GLN 118  -3.872 -14.466 -14.466
  975    H    ALA 119           HN       ALA 119   0.224 -13.925 -13.925
  976    HA   ALA 119           HA       ALA 119   3.060 -13.241 -13.241
  977   1HB   ALA 119           HMB      ALA 119   2.015 -15.972 -15.972
  978   2HB   ALA 119           HMB      ALA 119   3.387 -15.459 -15.459
  979   3HB   ALA 119           HMB      ALA 119   3.532 -15.423 -15.423
  980    H    ALA 120           HN       ALA 120   0.850 -11.963 -11.963
  981    HA   ALA 120           HA       ALA 120   2.211 -11.684 -11.684
  982   1HB   ALA 120           HMB      ALA 120  -0.639 -12.404 -12.404
  983   2HB   ALA 120           HMB      ALA 120  -0.300 -11.102 -11.102
  984   3HB   ALA 120           HMB      ALA 120   0.456 -12.703 -12.703
  985    H    ALA 121           HN       ALA 121   2.835  -9.681  -9.681
  986    HA   ALA 121           HA       ALA 121   1.542  -7.492  -7.492
  987   1HB   ALA 121           HMB      ALA 121   4.053  -7.733  -7.733
  988   2HB   ALA 121           HMB      ALA 121   3.874  -7.314  -7.314
  989   3HB   ALA 121           HMB      ALA 121   3.371  -6.154  -6.154
  990    H    ASP 122           HN       ASP 122   2.810  -7.652  -7.652
  991    HA   ASP 122           HA       ASP 122   1.884  -7.273  -7.273
  992   1HB   ASP 122           HBS      ASP 122  -0.298  -8.462  -8.462
  993   2HB   ASP 122           HBR      ASP 122  -0.780  -7.611  -7.611
  994    H    THR 123           HN       THR 123   1.948  -5.385  -5.385
  995    HA   THR 123           HA       THR 123   1.085  -3.127  -3.127
  996    HB   THR 123           HB       THR 123   3.176  -2.789  -2.789
  997    HG1  THR 123           HG1      THR 123   2.973  -1.228  -1.228
  998   1HG2  THR 123           HMG      THR 123   2.257  -4.478  -4.478
  999   2HG2  THR 123           HMG      THR 123   3.011  -3.001  -3.001
 1000   3HG2  THR 123           HMG      THR 123   3.913  -4.034  -4.034
 1001    H    GLY 124           HN       GLY 124   0.732  -2.916  -2.916
 1002   1HA   GLY 124           HAR      GLY 124  -1.085  -2.698  -2.698
 1003   2HA   GLY 124           HAS      GLY 124  -2.039  -3.620  -3.620
 1004    H    ASN 125           HN       ASN 125  -0.389  -0.431  -0.431
 1005    HA   ASN 125           HA       ASN 125  -2.155   0.693   0.693
 1006   1HB   ASN 125           HBS      ASN 125   0.276   1.407   1.407
 1007   2HB   ASN 125           HBR      ASN 125  -0.865   2.755   2.755
 1008   1HD2  ASN 125           HD2      ASN 125  -0.451   4.023   4.023
 1009   2HD2  ASN 125           HD2      ASN 125  -0.813   4.270   4.270
 1010    H    ASN 126           HN       ASN 126  -3.391   2.723   2.723
 1011    HA   ASN 126           HA       ASN 126  -4.859   2.891   2.891
 1012   1HB   ASN 126           HBS      ASN 126  -7.017   2.280   2.280
 1013   2HB   ASN 126           HBR      ASN 126  -5.874   0.934   0.934
 1014   1HD2  ASN 126           HD2      ASN 126  -6.900   2.098   2.098
 1015   2HD2  ASN 126           HD2      ASN 126  -7.179   3.149   3.149
 1016    H    SER 127           HN       SER 127  -3.345   4.789   4.789
 1017    HA   SER 127           HA       SER 127  -5.411   6.682   6.682
 1018   1HB   SER 127           HBS      SER 127  -2.524   7.153   7.153
 1019   2HB   SER 127           HBR      SER 127  -3.967   7.528   7.528
 1020    HG   SER 127           HG       SER 127  -2.464   5.099   5.099
 1021    H    GLN 128           HN       GLN 128  -4.362   5.972   5.972
 1022    HA   GLN 128           HA       GLN 128  -4.339   8.736   8.736
 1023   1HB   GLN 128           HBR      GLN 128  -2.245   8.223   8.223
 1024   2HB   GLN 128           HBS      GLN 128  -2.058   8.698   8.698
 1025   1HG   GLN 128           HGS      GLN 128  -2.152   5.797   5.797
 1026   2HG   GLN 128           HGR      GLN 128  -0.643   6.740   6.740
 1027   1HE2  GLN 128           HE2      GLN 128  -0.251   7.242   7.242
 1028   2HE2  GLN 128           HE2      GLN 128  -0.079   8.045   8.045
 1029    H    VAL 129           HN       VAL 129  -6.346   7.882   7.882
 1030    HA   VAL 129           HA       VAL 129  -6.015   6.060   6.060
 1031    HB   VAL 129           HB       VAL 129  -8.584   6.703   6.703
 1032   1HG1  VAL 129           HMG      VAL 129  -8.048   5.413   5.413
 1033   2HG1  VAL 129           HMG      VAL 129  -8.671   4.201   4.201
 1034   3HG1  VAL 129           HMG      VAL 129  -9.608   5.679   5.679
 1035   1HG2  VAL 129           HMG      VAL 129  -6.559   4.551   4.551
 1036   2HG2  VAL 129           HMG      VAL 129  -7.496   5.524   5.524
 1037   3HG2  VAL 129           HMG      VAL 129  -8.288   4.213   4.213
 1038    H    SER 130           HN       SER 130  -5.357   8.918   8.918
 1039    HA   SER 130           HA       SER 130  -6.631   9.998   9.998
 1040   1HB   SER 130           HBS      SER 130  -7.623  11.929  11.929
 1041   2HB   SER 130           HBR      SER 130  -8.577  10.516  10.516
 1042    HG   SER 130           HG       SER 130  -7.858  11.435  11.435
 1043    H    GLN 131           HN       GLN 131  -5.138  10.775  10.775
 1044    HA   GLN 131           HA       GLN 131  -3.227  11.907  11.907
 1045   1HB   GLN 131           HBR      GLN 131  -2.270  10.654  10.654
 1046   2HB   GLN 131           HBS      GLN 131  -2.510  12.186  12.186
 1047   1HG   GLN 131           HGS      GLN 131  -0.884  13.289  13.289
 1048   2HG   GLN 131           HGR      GLN 131  -1.068  12.247  12.247
 1049   1HE2  GLN 131           HE2      GLN 131   1.508  11.327  11.327
 1050   2HE2  GLN 131           HE2      GLN 131   0.311  12.568  12.568
 1051    H    ASN 132           HN       ASN 132  -2.484  14.047  14.047
 1052    HA   ASN 132           HA       ASN 132  -4.646  15.881  15.881
 1053   1HB   ASN 132           HBS      ASN 132  -3.428  15.333  15.333
 1054   2HB   ASN 132           HBR      ASN 132  -2.922  16.984  16.984
 1055   1HD2  ASN 132           HD2      ASN 132  -6.663  16.229  16.229
 1056   2HD2  ASN 132           HD2      ASN 132  -5.407  15.036  15.036
 1057    H    TYR 133           HN       TYR 133  -1.288  16.612  16.612
 1058    HA   TYR 133           HA       TYR 133   0.392  17.725  17.725
 1059   1HB   TYR 133           HBS      TYR 133  -0.295  16.013  16.013
 1060   2HB   TYR 133           HBR      TYR 133  -0.984  17.463  17.463
 1061    HD1  TYR 133           HD1      TYR 133   0.831  19.574  19.574
 1062    HD2  TYR 133           HD2      TYR 133   1.794  15.436  15.436
 1063    HE1  TYR 133           HE1      TYR 133   3.049  20.140  20.140
 1064    HE2  TYR 133           HE2      TYR 133   4.001  15.986  15.986
 1065    HH   TYR 133           HH       TYR 133   4.630  19.019  19.019

  Start of MODEL   13
    1   1H    HIS   1           HNB      HIS   1  -1.316  16.218  16.218
    2   2H    HIS   1           HNC      HIS   1  -2.663  15.300  15.300
    3   3H    HIS   1           HN       HIS   1  -2.642  16.609  16.609
    4    HA   HIS   1           HA       HIS   1  -1.656  15.615  15.615
    5   1HB   HIS   1           HBS      HIS   1  -3.247  13.713  13.713
    6   2HB   HIS   1           HBR      HIS   1  -1.828  12.869  12.869
    7    HD1  HIS   1           HD1      HIS   1  -4.881  14.896  14.896
    8    HD2  HIS   1           HD2      HIS   1  -1.825  12.588  12.588
    9    HE1  HIS   1           HE1      HIS   1  -5.398  14.669  14.669
   10    HE2  HIS   1           HE2      HIS   1  -3.540  13.294  13.294
   11    H    MET   2           HN       MET   2  -0.789  13.175  13.175
   12    HA   MET   2           HA       MET   2   2.055  13.407  13.407
   13   1HB   MET   2           HBS      MET   2   0.409  11.246  11.246
   14   2HB   MET   2           HBR      MET   2   1.629  11.515  11.515
   15   1HG   MET   2           HGR      MET   2   3.428  11.382  11.382
   16   2HG   MET   2           HGS      MET   2   2.269  11.252  11.252
   17   1HE   MET   2           HME      MET   2   4.323   9.887   9.887
   18   2HE   MET   2           HME      MET   2   4.517   8.350   8.350
   19   3HE   MET   2           HME      MET   2   3.663   8.379   8.379
   20    H    GLY   3           HN       GLY   3   2.627  15.354  15.354
   21   1HA   GLY   3           HAS      GLY   3   3.306  16.887  16.887
   22   2HA   GLY   3           HAR      GLY   3   3.153  15.619  15.619
   23    H    ALA   4           HN       ALA   4   2.252  18.515  18.515
   24    HA   ALA   4           HA       ALA   4  -0.482  18.713  18.713
   25   1HB   ALA   4           HMB      ALA   4   1.600  20.352  20.352
   26   2HB   ALA   4           HMB      ALA   4  -0.054  20.683  20.683
   27   3HB   ALA   4           HMB      ALA   4   0.320  20.794  20.794
   28    H    ARG   5           HN       ARG   5   1.208  17.612  17.612
   29    HA   ARG   5           HA       ARG   5  -0.930  16.058  16.058
   30   1HB   ARG   5           HBS      ARG   5  -1.096  18.805  18.805
   31   2HB   ARG   5           HBR      ARG   5  -1.046  17.569  17.569
   32   1HG   ARG   5           HGS      ARG   5  -3.060  16.626  16.626
   33   2HG   ARG   5           HGR      ARG   5  -2.939  17.235  17.235
   34   1HD   ARG   5           HDS      ARG   5  -2.946  19.496  19.496
   35   2HD   ARG   5           HDR      ARG   5  -4.198  18.402  18.402
   36    HE   ARG   5           HE       ARG   5  -4.927  18.324  18.324
   37   1HH1  ARG   5           HH1      ARG   5  -3.934  21.111  21.111
   38   2HH1  ARG   5           HH1      ARG   5  -4.707  22.248  22.248
   39   1HH2  ARG   5           HH2      ARG   5  -5.816  19.849  19.849
   40   2HH2  ARG   5           HH2      ARG   5  -5.775  21.534  21.534
   41    H    ALA   6           HN       ALA   6   1.216  18.192  18.192
   42    HA   ALA   6           HA       ALA   6   2.686  17.735  17.735
   43   1HB   ALA   6           HMB      ALA   6   3.123  15.431  15.431
   44   2HB   ALA   6           HMB      ALA   6   3.718  15.283  15.283
   45   3HB   ALA   6           HMB      ALA   6   4.268  16.634  16.634
   46    H    SER   7           HN       SER   7   0.869  17.837  17.837
   47    HA   SER   7           HA       SER   7  -1.042  17.121  17.121
   48   1HB   SER   7           HBS      SER   7   0.668  17.329  17.329
   49   2HB   SER   7           HBR      SER   7   1.641  16.030  16.030
   50    HG   SER   7           HG       SER   7   0.622  15.767  15.767
   51    H    VAL   8           HN       VAL   8   0.209  14.013  14.013
   52    HA   VAL   8           HA       VAL   8  -1.638  12.605  12.605
   53    HB   VAL   8           HB       VAL   8   0.295  12.004  12.004
   54   1HG1  VAL   8           HMG      VAL   8  -1.070   9.975   9.975
   55   2HG1  VAL   8           HMG      VAL   8  -0.712   9.605   9.605
   56   3HG1  VAL   8           HMG      VAL   8   0.607  10.029  10.029
   57   1HG2  VAL   8           HMG      VAL   8  -2.236  12.899  12.899
   58   2HG2  VAL   8           HMG      VAL   8  -1.459  11.911  11.911
   59   3HG2  VAL   8           HMG      VAL   8  -2.533  11.145  11.145
   60    H    LEU   9           HN       LEU   9   1.836  12.957  12.957
   61    HA   LEU   9           HA       LEU   9   2.387  10.727  10.727
   62   1HB   LEU   9           HBR      LEU   9   3.962  12.271  12.271
   63   2HB   LEU   9           HBS      LEU   9   4.732  11.115  11.115
   64    HG   LEU   9           HG       LEU   9   2.437  10.257  10.257
   65   1HD1  LEU   9           HMD      LEU   9   5.371  10.402  10.402
   66   2HD1  LEU   9           HMD      LEU   9   4.124   9.486   9.486
   67   3HD1  LEU   9           HMD      LEU   9   4.017  11.260  11.260
   68   1HD2  LEU   9           HMD      LEU   9   4.556   9.094   9.094
   69   2HD2  LEU   9           HMD      LEU   9   2.899   8.529   8.529
   70   3HD2  LEU   9           HMD      LEU   9   4.199   8.212   8.212
   71    H    SER  10           HN       SER  10   4.923  11.369  11.369
   72    HA   SER  10           HA       SER  10   4.410  13.632  13.632
   73   1HB   SER  10           HBS      SER  10   5.779  12.660  12.660
   74   2HB   SER  10           HBR      SER  10   4.770  11.313  11.313
   75    HG   SER  10           HG       SER  10   6.814  10.558  10.558
   76    H    GLY  11           HN       GLY  11   6.434  14.776  14.776
   77   1HA   GLY  11           HAR      GLY  11   7.460  16.049  16.049
   78   2HA   GLY  11           HAS      GLY  11   8.221  16.119  16.119
   79    H    GLY  12           HN       GLY  12   9.228  13.673  13.673
   80   1HA   GLY  12           HAR      GLY  12  11.483  13.484  13.484
   81   2HA   GLY  12           HAS      GLY  12  11.065  12.352  12.352
   82    H    GLU  13           HN       GLU  13   8.544  11.507  11.507
   83    HA   GLU  13           HA       GLU  13   9.163   9.390   9.390
   84   1HB   GLU  13           HBR      GLU  13   6.610  10.760  10.760
   85   2HB   GLU  13           HBS      GLU  13   6.610   9.499   9.499
   86   1HG   GLU  13           HGS      GLU  13   7.212   7.902   7.902
   87   2HG   GLU  13           HGR      GLU  13   7.736   9.023   9.023
   88    H    LEU  14           HN       LEU  14   8.099  12.667  12.667
   89    HA   LEU  14           HA       LEU  14   7.385  12.076  12.076
   90   1HB   LEU  14           HBS      LEU  14   6.481  13.772  13.772
   91   2HB   LEU  14           HBR      LEU  14   7.746  14.840  14.840
   92    HG   LEU  14           HG       LEU  14   6.713  14.870  14.870
   93   1HD1  LEU  14           HMD      LEU  14   5.523  12.393  12.393
   94   2HD1  LEU  14           HMD      LEU  14   4.283  13.503  13.503
   95   3HD1  LEU  14           HMD      LEU  14   5.667  13.035  13.035
   96   1HD2  LEU  14           HMD      LEU  14   5.581  15.838  15.838
   97   2HD2  LEU  14           HMD      LEU  14   5.126  16.310  16.310
   98   3HD2  LEU  14           HMD      LEU  14   4.209  15.039  15.039
   99    H    ASP  15           HN       ASP  15  10.031  13.904  13.904
  100    HA   ASP  15           HA       ASP  15  11.596  14.296  14.296
  101   1HB   ASP  15           HBS      ASP  15  12.050  15.398  15.398
  102   2HB   ASP  15           HBR      ASP  15  12.542  13.837  13.837
  103    H    LYS  16           HN       LYS  16  10.681  11.422  11.422
  104    HA   LYS  16           HA       LYS  16  12.641   9.828   9.828
  105   1HB   LYS  16           HBS      LYS  16  11.250   9.385   9.385
  106   2HB   LYS  16           HBR      LYS  16  10.327   8.430   8.430
  107   1HG   LYS  16           HGR      LYS  16  13.337   8.229   8.229
  108   2HG   LYS  16           HGS      LYS  16  12.152   7.160   7.160
  109   1HD   LYS  16           HDR      LYS  16  11.437   6.227   6.227
  110   2HD   LYS  16           HDS      LYS  16  12.172   7.464   7.464
  111   1HE   LYS  16           HES      LYS  16  14.300   6.354   6.354
  112   2HE   LYS  16           HER      LYS  16  13.244   4.977   4.977
  113   1HZ   LYS  16           HZA      LYS  16  13.276   6.031   6.031
  114   2HZ   LYS  16           HZB      LYS  16  14.593   6.853   6.853
  115   3HZ   LYS  16           HZC      LYS  16  14.609   5.220   5.220
  116    H    TRP  17           HN       TRP  17   9.141  10.530  10.530
  117    HA   TRP  17           HA       TRP  17   8.457   8.562   8.562
  118   1HB   TRP  17           HBS      TRP  17   6.822   9.490   9.490
  119   2HB   TRP  17           HBR      TRP  17   6.992  11.106  11.106
  120    HD1  TRP  17           HD1      TRP  17   6.219  11.163  11.163
  121    HE1  TRP  17           HE1      TRP  17   4.640   9.669   9.669
  122    HE3  TRP  17           HE3      TRP  17   5.499   7.479   7.479
  123    HZ2  TRP  17           HZ2      TRP  17   3.120   7.351   7.351
  124    HZ3  TRP  17           HZ3      TRP  17   3.927   5.673   5.673
  125    HH2  TRP  17           HH2      TRP  17   2.746   5.608   5.608
  126    H    GLU  18           HN       GLU  18  10.017  11.557  11.557
  127    HA   GLU  18           HA       GLU  18   8.923  12.058  12.058
  128   1HB   GLU  18           HBR      GLU  18  11.045  13.208  13.208
  129   2HB   GLU  18           HBS      GLU  18  10.947  13.708  13.708
  130   1HG   GLU  18           HGR      GLU  18   8.371  14.121  14.121
  131   2HG   GLU  18           HGS      GLU  18   9.474  14.554  14.554
  132    H    LYS  19           HN       LYS  19  10.440   9.529   9.529
  133    HA   LYS  19           HA       LYS  19  11.103   9.495   9.495
  134   1HB   LYS  19           HBS      LYS  19  13.106  10.826  10.826
  135   2HB   LYS  19           HBR      LYS  19  13.648   9.600   9.600
  136   1HG   LYS  19           HGR      LYS  19  13.276   8.099   8.099
  137   2HG   LYS  19           HGS      LYS  19  13.881   9.651   9.651
  138   1HD   LYS  19           HDR      LYS  19  15.195   7.964   7.964
  139   2HD   LYS  19           HDS      LYS  19  15.671   8.032   8.032
  140   1HE   LYS  19           HER      LYS  19  17.172   9.441   9.441
  141   2HE   LYS  19           HES      LYS  19  15.946  10.583  10.583
  142   1HZ   LYS  19           HZA      LYS  19  15.470   9.549   9.549
  143   2HZ   LYS  19           HZB      LYS  19  16.773  10.526  10.526
  144   3HZ   LYS  19           HZC      LYS  19  15.298  11.068  11.068
  145    H    ILE  20           HN       ILE  20   9.657   7.785   7.785
  146    HA   ILE  20           HA       ILE  20  11.149   5.459   5.459
  147    HB   ILE  20           HB       ILE  20   8.194   6.158   6.158
  148   1HG1  ILE  20           HG1      ILE  20  10.031   4.971   4.971
  149   2HG1  ILE  20           HG1      ILE  20   9.871   6.726   6.726
  150   1HG2  ILE  20           HMG      ILE  20   9.305   3.392   3.392
  151   2HG2  ILE  20           HMG      ILE  20   8.004   3.746   3.746
  152   3HG2  ILE  20           HMG      ILE  20   7.746   4.044   4.044
  153   1HD1  ILE  20           HMD      ILE  20   7.247   5.814   5.814
  154   2HD1  ILE  20           HMD      ILE  20   8.165   4.938   4.938
  155   3HD1  ILE  20           HMD      ILE  20   8.202   6.721   6.721
  156    H    ARG  21           HN       ARG  21  12.079   4.341   4.341
  157    HA   ARG  21           HA       ARG  21  11.704   4.763   4.763
  158   1HB   ARG  21           HBR      ARG  21  13.514   3.363   3.363
  159   2HB   ARG  21           HBS      ARG  21  12.753   2.088   2.088
  160   1HG   ARG  21           HGS      ARG  21  13.653   2.869   2.869
  161   2HG   ARG  21           HGR      ARG  21  13.650   4.569   4.569
  162   1HD   ARG  21           HDS      ARG  21  15.405   2.865   2.865
  163   2HD   ARG  21           HDR      ARG  21  15.827   2.889   2.889
  164    HE   ARG  21           HE       ARG  21  15.350   5.540   5.540
  165   1HH1  ARG  21           HH1      ARG  21  17.764   2.994   2.994
  166   2HH1  ARG  21           HH1      ARG  21  19.090   4.057   4.057
  167   1HH2  ARG  21           HH2      ARG  21  17.097   6.872   6.872
  168   2HH2  ARG  21           HH2      ARG  21  18.714   6.252   6.252
  169    H    LEU  22           HN       LEU  22  10.715   3.729   3.729
  170    HA   LEU  22           HA       LEU  22   8.127   2.602   2.602
  171   1HB   LEU  22           HBR      LEU  22   9.487   2.671   2.671
  172   2HB   LEU  22           HBS      LEU  22   7.743   2.717   2.717
  173    HG   LEU  22           HG       LEU  22   9.564   4.968   4.968
  174   1HD1  LEU  22           HMD      LEU  22   8.492   4.301   4.301
  175   2HD1  LEU  22           HMD      LEU  22   8.536   6.003   6.003
  176   3HD1  LEU  22           HMD      LEU  22  10.041   5.049   5.049
  177   1HD2  LEU  22           HMD      LEU  22   6.929   4.337   4.337
  178   2HD2  LEU  22           HMD      LEU  22   7.626   5.978   5.978
  179   3HD2  LEU  22           HMD      LEU  22   6.816   5.411   5.411
  180    H    ARG  23           HN       ARG  23  11.178   1.371   1.371
  181    HA   ARG  23           HA       ARG  23  10.355  -1.403  -1.403
  182   1HB   ARG  23           HBR      ARG  23  11.358  -1.863  -1.863
  183   2HB   ARG  23           HBS      ARG  23   9.615  -1.583  -1.583
  184   1HG   ARG  23           HGS      ARG  23   9.920   0.785   0.785
  185   2HG   ARG  23           HGR      ARG  23  11.641   0.449   0.449
  186   1HD   ARG  23           HDS      ARG  23  11.057  -0.124  -0.124
  187   2HD   ARG  23           HDR      ARG  23  10.199  -1.528  -1.528
  188    HE   ARG  23           HE       ARG  23   8.229  -0.503  -0.503
  189   1HH1  ARG  23           HH1      ARG  23  10.589   2.038   2.038
  190   2HH1  ARG  23           HH1      ARG  23   9.563   3.294   3.294
  191   1HH2  ARG  23           HH2      ARG  23   6.968   1.148   1.148
  192   2HH2  ARG  23           HH2      ARG  23   7.513   2.792   2.792
  193    HA   PRO  24           HA       PRO  24  14.599  -2.032  -2.032
  194   1HB   PRO  24           HBS      PRO  24  14.617  -4.565  -4.565
  195   2HB   PRO  24           HBR      PRO  24  14.686  -4.182  -4.182
  196   1HG   PRO  24           HGS      PRO  24  12.625  -5.328  -5.328
  197   2HG   PRO  24           HGR      PRO  24  12.554  -4.632  -4.632
  198   1HD   PRO  24           HDS      PRO  24  11.572  -3.628  -3.628
  199   2HD   PRO  24           HDR      PRO  24  11.153  -3.188  -3.188
  200    H    GLY  25           HN       GLY  25  13.380  -2.221  -2.221
  201   1HA   GLY  25           HAS      GLY  25  15.829  -2.235  -2.235
  202   2HA   GLY  25           HAR      GLY  25  14.270  -1.539  -1.539
  203    H    GLY  26           HN       GLY  26  13.791   0.365   0.365
  204   1HA   GLY  26           HAR      GLY  26  14.533   2.256   2.256
  205   2HA   GLY  26           HAS      GLY  26  16.197   1.903   1.903
  206    H    LYS  27           HN       LYS  27  13.135   2.422   2.422
  207    HA   LYS  27           HA       LYS  27  14.565   3.963   3.963
  208   1HB   LYS  27           HBR      LYS  27  12.599   2.256   2.256
  209   2HB   LYS  27           HBS      LYS  27  11.573   3.673   3.673
  210   1HG   LYS  27           HGS      LYS  27  13.678   3.671   3.671
  211   2HG   LYS  27           HGR      LYS  27  11.981   3.186   3.186
  212   1HD   LYS  27           HDR      LYS  27  11.499   5.495   5.495
  213   2HD   LYS  27           HDS      LYS  27  13.143   5.869   5.869
  214   1HE   LYS  27           HES      LYS  27  11.469   4.703   4.703
  215   2HE   LYS  27           HER      LYS  27  10.999   6.322   6.322
  216   1HZ   LYS  27           HZC      LYS  27  13.678   5.578   5.578
  217   2HZ   LYS  27           HZA      LYS  27  12.573   6.427   6.427
  218   3HZ   LYS  27           HZB      LYS  27  13.220   7.061   7.061
  219    H    LYS  28           HN       LYS  28  11.699   4.571   4.571
  220    HA   LYS  28           HA       LYS  28  12.693   7.327   7.327
  221   1HB   LYS  28           HBS      LYS  28  10.388   6.794   6.794
  222   2HB   LYS  28           HBR      LYS  28   9.800   7.285   7.285
  223   1HG   LYS  28           HGS      LYS  28  10.034   9.182   9.182
  224   2HG   LYS  28           HGR      LYS  28  11.010   9.374   9.374
  225   1HD   LYS  28           HDS      LYS  28  12.493   8.016   8.016
  226   2HD   LYS  28           HDR      LYS  28  11.793   9.487   9.487
  227   1HE   LYS  28           HER      LYS  28  13.776   9.138   9.138
  228   2HE   LYS  28           HES      LYS  28  13.842  10.204  10.204
  229   1HZ   LYS  28           HZC      LYS  28  11.787  11.234  11.234
  230   2HZ   LYS  28           HZA      LYS  28  12.455  10.594  10.594
  231   3HZ   LYS  28           HZB      LYS  28  13.299  11.663  11.663
  232    H    GLN  29           HN       GLN  29  11.065   8.299   8.299
  233    HA   GLN  29           HA       GLN  29  10.955   6.283   6.283
  234   1HB   GLN  29           HBR      GLN  29  11.901   8.159   8.159
  235   2HB   GLN  29           HBS      GLN  29  13.015   7.235   7.235
  236   1HG   GLN  29           HGS      GLN  29  11.943   9.593   9.593
  237   2HG   GLN  29           HGR      GLN  29  12.791  10.001  10.001
  238   1HE2  GLN  29           HE2      GLN  29  15.862   8.333   8.333
  239   2HE2  GLN  29           HE2      GLN  29  14.765   8.158   8.158
  240    H    TYR  30           HN       TYR  30   9.361   6.483   6.483
  241    HA   TYR  30           HA       TYR  30   7.128   7.912   7.912
  242   1HB   TYR  30           HBS      TYR  30   8.255   6.770   6.770
  243   2HB   TYR  30           HBR      TYR  30   6.795   7.787   7.787
  244    HD1  TYR  30           HD2      TYR  30   7.293   5.642   5.642
  245    HD2  TYR  30           HD1      TYR  30   5.479   5.895   5.895
  246    HE1  TYR  30           HE2      TYR  30   6.130   3.519   3.519
  247    HE2  TYR  30           HE1      TYR  30   4.670   3.566   3.566
  248    HH   TYR  30           HH       TYR  30   3.710   2.660   2.660
  249    H    LYS  31           HN       LYS  31   6.215   9.802   9.802
  250    HA   LYS  31           HA       LYS  31   7.689  11.742  11.742
  251   1HB   LYS  31           HBR      LYS  31   7.020  11.983  11.983
  252   2HB   LYS  31           HBS      LYS  31   5.716  12.870  12.870
  253   1HG   LYS  31           HGR      LYS  31   7.074  14.587  14.587
  254   2HG   LYS  31           HGS      LYS  31   8.375  13.498  13.498
  255   1HD   LYS  31           HDR      LYS  31   9.372  14.571  14.571
  256   2HD   LYS  31           HDS      LYS  31   8.877  13.066  13.066
  257   1HE   LYS  31           HES      LYS  31   7.629  14.129  14.129
  258   2HE   LYS  31           HER      LYS  31   6.809  15.075  15.075
  259   1HZ   LYS  31           HZB      LYS  31   9.471  15.716  15.716
  260   2HZ   LYS  31           HZC      LYS  31   8.087  16.412  16.412
  261   3HZ   LYS  31           HZA      LYS  31   8.577  16.622  16.622
  262    H    LEU  32           HN       LEU  32   6.453  13.216  13.216
  263    HA   LEU  32           HA       LEU  32   4.095  12.267  12.267
  264   1HB   LEU  32           HBR      LEU  32   5.887  14.555  14.555
  265   2HB   LEU  32           HBS      LEU  32   4.186  15.045  15.045
  266    HG   LEU  32           HG       LEU  32   5.854  13.168  13.168
  267   1HD1  LEU  32           HMD      LEU  32   4.946  15.962  15.962
  268   2HD1  LEU  32           HMD      LEU  32   4.613  15.055  15.055
  269   3HD1  LEU  32           HMD      LEU  32   6.278  15.159  15.159
  270   1HD2  LEU  32           HMD      LEU  32   2.892  13.511  13.511
  271   2HD2  LEU  32           HMD      LEU  32   3.852  12.065  12.065
  272   3HD2  LEU  32           HMD      LEU  32   3.592  13.336  13.336
  273    H    LYS  33           HN       LYS  33   4.599  13.756  13.756
  274    HA   LYS  33           HA       LYS  33   2.037  15.168  15.168
  275   1HB   LYS  33           HBR      LYS  33   4.313  15.441  15.441
  276   2HB   LYS  33           HBS      LYS  33   3.524  14.199  14.199
  277   1HG   LYS  33           HGS      LYS  33   2.912  16.261  16.261
  278   2HG   LYS  33           HGR      LYS  33   1.481  15.752  15.752
  279   1HD   LYS  33           HDR      LYS  33   1.813  18.066  18.066
  280   2HD   LYS  33           HDS      LYS  33   2.196  17.255  17.255
  281   1HE   LYS  33           HES      LYS  33   3.800  19.010  19.010
  282   2HE   LYS  33           HER      LYS  33   4.594  17.414  17.414
  283   1HZ   LYS  33           HZC      LYS  33   4.267  17.588  17.588
  284   2HZ   LYS  33           HZA      LYS  33   3.726  19.118  19.118
  285   3HZ   LYS  33           HZB      LYS  33   5.260  18.741  18.741
  286    H    HIS  34           HN       DHI  34   3.453  12.005  12.005
  287    HA   HIS  34           HA       DHI  34   0.829  11.224  11.224
  288   1HB   HIS  34           HBR      DHI  34   1.806   9.767   9.767
  289   2HB   HIS  34           HBS      DHI  34   3.231  10.793  10.793
  290    HD2  HIS  34           HD2      DHI  34   1.885   7.449   7.449
  291    HE1  HIS  34           HE1      DHI  34   5.925   6.983   6.983
  292    HE2  HIS  34           HE2      DHI  34   3.899   5.829   5.829
  293    H    ILE  35           HN       ILE  35   2.360  11.027  11.027
  294    HA   ILE  35           HA       ILE  35   0.654   8.898   8.898
  295    HB   ILE  35           HB       ILE  35   2.709  10.113  10.113
  296   1HG1  ILE  35           HG1      ILE  35   0.143   9.347   9.347
  297   2HG1  ILE  35           HG1      ILE  35   1.452   8.257   8.257
  298   1HG2  ILE  35           HMG      ILE  35   0.586  12.155  12.155
  299   2HG2  ILE  35           HMG      ILE  35   1.480  11.680  11.680
  300   3HG2  ILE  35           HMG      ILE  35   2.366  12.287  12.287
  301   1HD1  ILE  35           HMD      ILE  35   2.500  10.364  10.364
  302   2HD1  ILE  35           HMD      ILE  35   1.178   9.495   9.495
  303   3HD1  ILE  35           HMD      ILE  35   2.589   8.595   8.595
  304    H    VAL  36           HN       VAL  36   0.526  12.421  12.421
  305    HA   VAL  36           HA       VAL  36  -1.992  12.756  12.756
  306    HB   VAL  36           HB       VAL  36  -0.421  14.378  14.378
  307   1HG1  VAL  36           HMG      VAL  36  -3.209  14.795  14.795
  308   2HG1  VAL  36           HMG      VAL  36  -2.150  16.195  16.195
  309   3HG1  VAL  36           HMG      VAL  36  -2.272  15.504  15.504
  310   1HG2  VAL  36           HMG      VAL  36  -0.024  13.978  13.978
  311   2HG2  VAL  36           HMG      VAL  36   0.550  15.373  15.373
  312   3HG2  VAL  36           HMG      VAL  36  -0.966  15.489  15.489
  313    H    TRP  37           HN       TRP  37  -0.991  11.863  11.863
  314    HA   TRP  37           HA       TRP  37  -3.537  11.498  11.498
  315   1HB   TRP  37           HBS      TRP  37  -1.618  11.349  11.349
  316   2HB   TRP  37           HBR      TRP  37  -0.880  10.104  10.104
  317    HD1  TRP  37           HD1      TRP  37  -3.452  10.495  10.495
  318    HE1  TRP  37           HE1      TRP  37  -4.039   8.175   8.175
  319    HE3  TRP  37           HE3      TRP  37  -0.968   7.666   7.666
  320    HZ2  TRP  37           HZ2      TRP  37  -3.581   5.500   5.500
  321    HZ3  TRP  37           HZ3      TRP  37  -1.022   5.226   5.226
  322    HH2  TRP  37           HH2      TRP  37  -2.309   4.155   4.155
  323    H    ALA  38           HN       ALA  38  -1.601   9.409   9.409
  324    HA   ALA  38           HA       ALA  38  -3.099   6.992   6.992
  325   1HB   ALA  38           HMB      ALA  38  -1.262   7.813   7.813
  326   2HB   ALA  38           HMB      ALA  38  -1.819   6.155   6.155
  327   3HB   ALA  38           HMB      ALA  38  -0.761   6.997   6.997
  328    H    SER  39           HN       SER  39  -2.674   8.923   8.923
  329    HA   SER  39           HA       SER  39  -4.950   7.949   7.949
  330   1HB   SER  39           HBR      SER  39  -3.545   8.901   8.901
  331   2HB   SER  39           HBS      SER  39  -3.101  10.244  10.244
  332    HG   SER  39           HG       SER  39  -4.904  11.386  11.386
  333    H    ARG  40           HN       ARG  40  -4.690  10.217  10.217
  334    HA   ARG  40           HA       ARG  40  -7.369  11.344  11.344
  335   1HB   ARG  40           HBR      ARG  40  -5.230  11.207  11.207
  336   2HB   ARG  40           HBS      ARG  40  -6.917  11.335  11.335
  337   1HG   ARG  40           HGS      ARG  40  -7.232  13.398  13.398
  338   2HG   ARG  40           HGR      ARG  40  -5.627  13.249  13.249
  339   1HD   ARG  40           HDS      ARG  40  -5.611  14.836  14.836
  340   2HD   ARG  40           HDR      ARG  40  -4.551  13.434  13.434
  341    HE   ARG  40           HE       ARG  40  -7.271  13.310  13.310
  342   1HH1  ARG  40           HH1      ARG  40  -3.933  14.286  14.286
  343   2HH1  ARG  40           HH1      ARG  40  -4.029  13.993  13.993
  344   1HH2  ARG  40           HH2      ARG  40  -7.317  12.812  12.812
  345   2HH2  ARG  40           HH2      ARG  40  -5.945  13.162  13.162
  346    H    GLU  41           HN       GLU  41  -5.933   8.883   8.883
  347    HA   GLU  41           HA       GLU  41  -8.404   8.130   8.130
  348   1HB   GLU  41           HBS      GLU  41  -5.775   7.798   7.798
  349   2HB   GLU  41           HBR      GLU  41  -6.091   6.259   6.259
  350   1HG   GLU  41           HGR      GLU  41  -6.110   5.961   5.961
  351   2HG   GLU  41           HGS      GLU  41  -7.835   6.213   6.213
  352    H    LEU  42           HN       LEU  42  -6.801   7.154   7.154
  353    HA   LEU  42           HA       LEU  42  -8.221   4.656   4.656
  354   1HB   LEU  42           HBR      LEU  42  -6.135   5.092   5.092
  355   2HB   LEU  42           HBS      LEU  42  -6.755   6.646   6.646
  356    HG   LEU  42           HG       LEU  42  -8.548   4.684   4.684
  357   1HD1  LEU  42           HMD      LEU  42  -5.843   3.616   3.616
  358   2HD1  LEU  42           HMD      LEU  42  -6.387   3.595   3.595
  359   3HD1  LEU  42           HMD      LEU  42  -7.358   2.789   2.789
  360   1HD2  LEU  42           HMD      LEU  42  -6.703   6.684   6.684
  361   2HD2  LEU  42           HMD      LEU  42  -8.336   6.228   6.228
  362   3HD2  LEU  42           HMD      LEU  42  -6.921   5.307   5.307
  363    H    GLU  43           HN       GLU  43  -8.375   7.833   7.833
  364    HA   GLU  43           HA       GLU  43 -10.706   7.358   7.358
  365   1HB   GLU  43           HBS      GLU  43 -10.674   9.562   9.562
  366   2HB   GLU  43           HBR      GLU  43  -9.076   9.067   9.067
  367   1HG   GLU  43           HGS      GLU  43  -8.985  11.117  11.117
  368   2HG   GLU  43           HGR      GLU  43  -9.086  10.238  10.238
  369    H    ARG  44           HN       ARG  44 -10.232   8.411   8.411
  370    HA   ARG  44           HA       ARG  44 -13.071   8.996   8.996
  371   1HB   ARG  44           HBR      ARG  44 -10.681   9.849   9.849
  372   2HB   ARG  44           HBS      ARG  44 -11.516   8.888   8.888
  373   1HG   ARG  44           HGR      ARG  44 -12.668  11.255  11.255
  374   2HG   ARG  44           HGS      ARG  44 -12.088  11.259  11.259
  375   1HD   ARG  44           HDR      ARG  44 -13.840   9.960   9.960
  376   2HD   ARG  44           HDS      ARG  44 -14.195   9.326   9.326
  377    HE   ARG  44           HE       ARG  44 -14.673  12.187  12.187
  378   1HH1  ARG  44           HH1      ARG  44 -15.979   8.989   8.989
  379   2HH1  ARG  44           HH1      ARG  44 -17.488   9.612   9.612
  380   1HH2  ARG  44           HH2      ARG  44 -16.609  12.970  12.970
  381   2HH2  ARG  44           HH2      ARG  44 -17.846  11.865  11.865
  382    H    PHE  45           HN       PHE  45 -11.064   6.257   6.257
  383    HA   PHE  45           HA       PHE  45 -12.629   4.674   4.674
  384   1HB   PHE  45           HBS      PHE  45 -10.442   4.173   4.173
  385   2HB   PHE  45           HBR      PHE  45 -11.720   2.928   2.928
  386    HD1  PHE  45           HD2      PHE  45 -10.249   4.871   4.871
  387    HD2  PHE  45           HD1      PHE  45 -11.128   1.112   1.112
  388    HE1  PHE  45           HE2      PHE  45  -9.305   3.711   3.711
  389    HE2  PHE  45           HE1      PHE  45 -10.201  -0.062  -0.062
  390    HZ   PHE  45           HZ       PHE  45  -9.238   1.233   1.233
  391    H    ALA  46           HN       ALA  46 -12.394   4.633   4.633
  392    HA   ALA  46           HA       ALA  46 -15.297   4.446   4.446
  393   1HB   ALA  46           HMB      ALA  46 -13.398   2.114   2.114
  394   2HB   ALA  46           HMB      ALA  46 -14.851   2.057   2.057
  395   3HB   ALA  46           HMB      ALA  46 -15.014   2.306   2.306
  396    H    VAL  47           HN       VAL  47 -12.660   5.776   5.776
  397    HA   VAL  47           HA       VAL  47 -12.554   4.667   4.667
  398    HB   VAL  47           HB       VAL  47 -10.210   5.665   5.665
  399   1HG1  VAL  47           HMG      VAL  47 -10.490   4.200   4.200
  400   2HG1  VAL  47           HMG      VAL  47  -9.012   4.054   4.054
  401   3HG1  VAL  47           HMG      VAL  47  -9.534   5.649   5.649
  402   1HG2  VAL  47           HMG      VAL  47 -11.245   2.833   2.833
  403   2HG2  VAL  47           HMG      VAL  47 -11.149   3.835   3.835
  404   3HG2  VAL  47           HMG      VAL  47  -9.658   3.297   3.297
  405    H    ASN  48           HN       ASN  48 -11.590   6.066   6.066
  406    HA   ASN  48           HA       ASN  48 -12.207   8.918   8.918
  407   1HB   ASN  48           HBS      ASN  48 -13.560   8.142   8.142
  408   2HB   ASN  48           HBR      ASN  48 -12.148   7.423   7.423
  409   1HD2  ASN  48           HD2      ASN  48 -13.277  11.072  11.072
  410   2HD2  ASN  48           HD2      ASN  48 -14.264   9.843   9.843
  411    HA   PRO  49           HA       PRO  49  -8.080   9.526   9.526
  412   1HB   PRO  49           HBR      PRO  49  -8.054  12.208  12.208
  413   2HB   PRO  49           HBS      PRO  49  -8.421  11.337  11.337
  414   1HG   PRO  49           HGR      PRO  49 -10.136  12.847  12.847
  415   2HG   PRO  49           HGS      PRO  49 -10.433  12.113  12.113
  416   1HD   PRO  49           HDR      PRO  49 -11.241  11.267  11.267
  417   2HD   PRO  49           HDS      PRO  49 -11.609  10.587  10.587
  418    H    GLY  50           HN       GLY  50  -9.115  11.660  11.660
  419   1HA   GLY  50           HAR      GLY  50  -6.790  11.634  11.634
  420   2HA   GLY  50           HAS      GLY  50  -8.450  11.798  11.798
  421    H    LEU  51           HN       LEU  51  -9.233   9.179   9.179
  422    HA   LEU  51           HA       LEU  51  -8.739   7.519   7.519
  423   1HB   LEU  51           HBR      LEU  51 -10.679   7.840   7.840
  424   2HB   LEU  51           HBS      LEU  51  -9.773   6.538   6.538
  425    HG   LEU  51           HG       LEU  51 -11.238   6.487   6.487
  426   1HD1  LEU  51           HMD      LEU  51 -11.679   5.494   5.494
  427   2HD1  LEU  51           HMD      LEU  51 -11.885   4.253   4.253
  428   3HD1  LEU  51           HMD      LEU  51 -12.828   5.764   5.764
  429   1HD2  LEU  51           HMD      LEU  51  -8.812   5.274   5.274
  430   2HD2  LEU  51           HMD      LEU  51 -10.094   4.689   4.689
  431   3HD2  LEU  51           HMD      LEU  51  -9.940   4.008   4.008
  432    H    LEU  52           HN       LEU  52  -7.526   7.840   7.840
  433    HA   LEU  52           HA       LEU  52  -5.704   5.620   5.620
  434   1HB   LEU  52           HBS      LEU  52  -6.063   5.588   5.588
  435   2HB   LEU  52           HBR      LEU  52  -6.900   7.157   7.157
  436    HG   LEU  52           HG       LEU  52  -5.249   7.073   7.073
  437   1HD1  LEU  52           HMD      LEU  52  -4.809   8.999   8.999
  438   2HD1  LEU  52           HMD      LEU  52  -3.781   9.046   9.046
  439   3HD1  LEU  52           HMD      LEU  52  -5.555   9.238   9.238
  440   1HD2  LEU  52           HMD      LEU  52  -3.750   5.462   5.462
  441   2HD2  LEU  52           HMD      LEU  52  -2.925   6.840   6.840
  442   3HD2  LEU  52           HMD      LEU  52  -3.131   6.803   6.803
  443    H    GLU  53           HN       GLU  53  -5.639   9.029   9.029
  444    HA   GLU  53           HA       GLU  53  -2.859   9.544   9.544
  445   1HB   GLU  53           HBR      GLU  53  -5.179  10.846  10.846
  446   2HB   GLU  53           HBS      GLU  53  -4.781  10.479  10.479
  447   1HG   GLU  53           HGR      GLU  53  -3.608  12.248  12.248
  448   2HG   GLU  53           HGS      GLU  53  -2.521  11.630  11.630
  449    H    THR  54           HN       THR  54  -5.071   8.001   8.001
  450    HA   THR  54           HA       THR  54  -2.830   7.238   7.238
  451    HB   THR  54           HB       THR  54  -4.421   6.209   6.209
  452    HG1  THR  54           HG1      THR  54  -6.111   6.562   6.562
  453   1HG2  THR  54           HMG      THR  54  -5.755   8.632   8.632
  454   2HG2  THR  54           HMG      THR  54  -6.228   7.871   7.871
  455   3HG2  THR  54           HMG      THR  54  -4.608   8.594   8.594
  456    H    SER  55           HN       SER  55  -2.239   5.090   5.090
  457    HA   SER  55           HA       SER  55  -2.003   3.113   3.113
  458   1HB   SER  55           HBR      SER  55  -2.072   1.649   1.649
  459   2HB   SER  55           HBS      SER  55  -0.645   2.515   2.515
  460    HG   SER  55           HG       SER  55  -2.652   3.659   3.659
  461    H    GLU  56           HN       GLU  56  -4.583   3.740   3.740
  462    HA   GLU  56           HA       GLU  56  -5.714   1.153   1.153
  463   1HB   GLU  56           HBR      GLU  56  -6.071   3.588   3.588
  464   2HB   GLU  56           HBS      GLU  56  -7.457   3.468   3.468
  465   1HG   GLU  56           HGR      GLU  56  -7.990   1.275   1.275
  466   2HG   GLU  56           HGS      GLU  56  -6.656   1.709   1.709
  467    H    GLY  57           HN       GLY  57  -6.341   4.068   4.068
  468   1HA   GLY  57           HAR      GLY  57  -8.419   2.896   2.896
  469   2HA   GLY  57           HAS      GLY  57  -7.503   4.377   4.377
  470    H    CYS  58           HN       CYS  58  -4.913   3.417   3.417
  471    HA   CYS  58           HA       CYS  58  -4.720   2.254   2.254
  472   1HB   CYS  58           HBR      CYS  58  -2.766   2.563   2.563
  473   2HB   CYS  58           HBS      CYS  58  -2.328   1.655   1.655
  474    H    ARG  59           HN       ARG  59  -5.043   0.791   0.791
  475    HA   ARG  59           HA       ARG  59  -4.442  -1.866  -1.866
  476   1HB   ARG  59           HBS      ARG  59  -4.329  -1.167  -1.167
  477   2HB   ARG  59           HBR      ARG  59  -6.097  -0.920  -0.920
  478   1HG   ARG  59           HGS      ARG  59  -5.494  -3.025  -3.025
  479   2HG   ARG  59           HGR      ARG  59  -6.444  -3.308  -3.308
  480   1HD   ARG  59           HDS      ARG  59  -4.828  -4.821  -4.821
  481   2HD   ARG  59           HDR      ARG  59  -3.987  -3.393  -3.393
  482    HE   ARG  59           HE       ARG  59  -3.545  -3.952  -3.952
  483   1HH1  ARG  59           HH1      ARG  59  -2.314  -3.940  -3.940
  484   2HH1  ARG  59           HH1      ARG  59  -0.707  -4.373  -4.373
  485   1HH2  ARG  59           HH2      ARG  59  -1.457  -4.615  -4.615
  486   2HH2  ARG  59           HH2      ARG  59  -0.208  -4.693  -4.693
  487    H    GLN  60           HN       GLN  60  -7.455  -0.014  -0.014
  488    HA   GLN  60           HA       GLN  60  -9.215  -2.288  -2.288
  489   1HB   GLN  60           HBS      GLN  60  -9.793  -0.081  -0.081
  490   2HB   GLN  60           HBR      GLN  60 -10.012   0.580   0.580
  491   1HG   GLN  60           HGR      GLN  60 -12.073  -0.225  -0.225
  492   2HG   GLN  60           HGS      GLN  60 -11.387  -1.874  -1.874
  493   1HE2  GLN  60           HE2      GLN  60 -12.089  -2.523  -2.523
  494   2HE2  GLN  60           HE2      GLN  60 -11.188  -2.977  -2.977
  495    H    ILE  61           HN       ILE  61  -7.356   0.020   0.020
  496    HA   ILE  61           HA       ILE  61  -8.637  -0.684  -0.684
  497    HB   ILE  61           HB       ILE  61  -6.100   0.949   0.949
  498   1HG1  ILE  61           HG1      ILE  61  -7.811   2.213   2.213
  499   2HG1  ILE  61           HG1      ILE  61  -7.660   2.818   2.818
  500   1HG2  ILE  61           HMG      ILE  61  -6.263  -0.248  -0.248
  501   2HG2  ILE  61           HMG      ILE  61  -7.491   0.992   0.992
  502   3HG2  ILE  61           HMG      ILE  61  -5.836   1.482   1.482
  503   1HD1  ILE  61           HMD      ILE  61  -9.698   0.708   0.708
  504   2HD1  ILE  61           HMD      ILE  61 -10.010   2.437   2.437
  505   3HD1  ILE  61           HMD      ILE  61  -9.687   1.868   1.868
  506    H    LEU  62           HN       LEU  62  -5.301  -1.215  -1.215
  507    HA   LEU  62           HA       LEU  62  -4.434  -2.758  -2.758
  508   1HB   LEU  62           HBR      LEU  62  -3.329  -1.704  -1.704
  509   2HB   LEU  62           HBS      LEU  62  -3.445  -3.404  -3.404
  510    HG   LEU  62           HG       LEU  62  -1.994  -4.127  -4.127
  511   1HD1  LEU  62           HMD      LEU  62  -2.878  -2.007  -2.007
  512   2HD1  LEU  62           HMD      LEU  62  -1.284  -1.417  -1.417
  513   3HD1  LEU  62           HMD      LEU  62  -1.412  -2.953  -2.953
  514   1HD2  LEU  62           HMD      LEU  62  -1.232  -1.820  -1.820
  515   2HD2  LEU  62           HMD      LEU  62  -0.700  -3.520  -3.520
  516   3HD2  LEU  62           HMD      LEU  62  -0.044  -2.412  -2.412
  517    H    GLY  63           HN       GLY  63  -6.557  -3.582  -3.582
  518   1HA   GLY  63           HAS      GLY  63  -6.626  -6.455  -6.455
  519   2HA   GLY  63           HAR      GLY  63  -7.859  -5.464  -5.464
  520    H    GLN  64           HN       GLN  64  -8.947  -3.829  -3.829
  521    HA   GLN  64           HA       GLN  64 -10.653  -5.525  -5.525
  522   1HB   GLN  64           HBR      GLN  64 -10.914  -3.076  -3.076
  523   2HB   GLN  64           HBS      GLN  64 -10.691  -2.637  -2.637
  524   1HG   GLN  64           HGS      GLN  64 -12.502  -4.482  -4.482
  525   2HG   GLN  64           HGR      GLN  64 -12.889  -4.224  -4.224
  526   1HE2  GLN  64           HE2      GLN  64 -14.078  -1.649  -1.649
  527   2HE2  GLN  64           HE2      GLN  64 -13.053  -3.003  -3.003
  528    H    LEU  65           HN       LEU  65  -8.082  -3.229  -3.229
  529    HA   LEU  65           HA       LEU  65  -8.263  -3.206  -3.206
  530   1HB   LEU  65           HBR      LEU  65  -6.775  -2.133  -2.133
  531   2HB   LEU  65           HBS      LEU  65  -5.598  -3.139  -3.139
  532    HG   LEU  65           HG       LEU  65  -5.922  -1.867  -1.867
  533   1HD1  LEU  65           HMD      LEU  65  -8.284  -0.784  -0.784
  534   2HD1  LEU  65           HMD      LEU  65  -7.452   0.255   0.255
  535   3HD1  LEU  65           HMD      LEU  65  -8.143  -1.304  -1.304
  536   1HD2  LEU  65           HMD      LEU  65  -4.839  -0.933  -0.933
  537   2HD2  LEU  65           HMD      LEU  65  -4.633  -0.189  -0.189
  538   3HD2  LEU  65           HMD      LEU  65  -5.893   0.415   0.415
  539    H    GLN  66           HN       GLN  66  -6.455  -5.313  -5.313
  540    HA   GLN  66           HA       GLN  66  -4.731  -6.362  -6.362
  541   1HB   GLN  66           HBR      GLN  66  -5.588  -7.075  -7.075
  542   2HB   GLN  66           HBS      GLN  66  -5.442  -8.577  -8.577
  543   1HG   GLN  66           HGS      GLN  66  -3.173  -6.969  -6.969
  544   2HG   GLN  66           HGR      GLN  66  -3.390  -6.977  -6.977
  545   1HE2  GLN  66           HE2      GLN  66  -3.089 -10.576 -10.576
  546   2HE2  GLN  66           HE2      GLN  66  -4.210  -9.337  -9.337
  547    HA   PRO  67           HA       PRO  67  -7.869  -9.760  -9.760
  548   1HB   PRO  67           HBR      PRO  67 -10.340  -9.090  -9.090
  549   2HB   PRO  67           HBS      PRO  67  -9.557 -10.527 -10.527
  550   1HG   PRO  67           HGS      PRO  67  -9.985  -8.814  -8.814
  551   2HG   PRO  67           HGR      PRO  67  -8.931 -10.107 -10.107
  552   1HD   PRO  67           HDS      PRO  67  -8.337  -7.370  -7.370
  553   2HD   PRO  67           HDR      PRO  67  -7.344  -8.591  -8.591
  554    H    SER  68           HN       SER  68  -8.792  -6.502  -6.502
  555    HA   SER  68           HA       SER  68 -10.685  -6.339  -6.339
  556   1HB   SER  68           HBS      SER  68  -9.404  -4.438  -4.438
  557   2HB   SER  68           HBR      SER  68 -10.046  -3.772  -3.772
  558    HG   SER  68           HG       SER  68 -11.959  -3.896  -3.896
  559    H    LEU  69           HN       LEU  69  -7.272  -6.392  -6.392
  560    HA   LEU  69           HA       LEU  69  -6.713  -4.567  -4.567
  561   1HB   LEU  69           HBR      LEU  69  -5.190  -6.727  -6.727
  562   2HB   LEU  69           HBS      LEU  69  -4.439  -5.716  -5.716
  563    HG   LEU  69           HG       LEU  69  -5.724  -4.568  -4.568
  564   1HD1  LEU  69           HMD      LEU  69  -3.424  -6.136  -6.136
  565   2HD1  LEU  69           HMD      LEU  69  -2.811  -4.467  -4.467
  566   3HD1  LEU  69           HMD      LEU  69  -3.891  -4.942  -4.942
  567   1HD2  LEU  69           HMD      LEU  69  -4.953  -3.469  -3.469
  568   2HD2  LEU  69           HMD      LEU  69  -5.142  -2.590  -2.590
  569   3HD2  LEU  69           HMD      LEU  69  -3.536  -3.178  -3.178
  570    H    GLN  70           HN       GLN  70  -7.155  -8.069  -8.069
  571    HA   GLN  70           HA       GLN  70  -6.642  -8.707  -8.707
  572   1HB   GLN  70           HBR      GLN  70  -7.912 -10.664 -10.664
  573   2HB   GLN  70           HBS      GLN  70  -7.107 -10.347 -10.347
  574   1HG   GLN  70           HGS      GLN  70  -9.050 -10.188 -10.188
  575   2HG   GLN  70           HGR      GLN  70  -9.798  -9.196  -9.196
  576   1HE2  GLN  70           HE2      GLN  70 -10.695 -12.189 -12.189
  577   2HE2  GLN  70           HE2      GLN  70  -9.875 -10.680 -10.680
  578    H    THR  71           HN       THR  71  -9.078  -6.726  -6.726
  579    HA   THR  71           HA       THR  71 -10.620  -6.746  -6.746
  580    HB   THR  71           HB       THR  71 -11.780  -8.297  -8.297
  581    HG1  THR  71           HG1      THR  71 -12.883  -7.000  -7.000
  582   1HG2  THR  71           HMG      THR  71 -10.619  -7.748  -7.748
  583   2HG2  THR  71           HMG      THR  71 -11.740  -6.376  -6.376
  584   3HG2  THR  71           HMG      THR  71 -12.370  -8.043  -8.043
  585    H    GLY  72           HN       GLY  72  -8.792  -4.839  -4.839
  586   1HA   GLY  72           HAR      GLY  72 -10.477  -2.454  -2.454
  587   2HA   GLY  72           HAS      GLY  72  -8.920  -2.562  -2.562
  588    H    SER  73           HN       SER  73  -6.994  -3.004  -3.004
  589    HA   SER  73           HA       SER  73  -6.844  -3.205  -3.205
  590   1HB   SER  73           HBS      SER  73  -5.995  -0.919  -0.919
  591   2HB   SER  73           HBR      SER  73  -7.762  -1.115  -1.115
  592    HG   SER  73           HG       SER  73  -7.889   0.245   0.245
  593    H    GLU  74           HN       GLU  74  -4.608  -2.553  -2.553
  594    HA   GLU  74           HA       GLU  74  -2.394  -2.987  -2.987
  595   1HB   GLU  74           HBR      GLU  74  -1.151  -2.815  -2.815
  596   2HB   GLU  74           HBS      GLU  74  -2.618  -3.354  -3.354
  597   1HG   GLU  74           HGR      GLU  74  -3.140  -1.492  -1.492
  598   2HG   GLU  74           HGS      GLU  74  -2.063  -0.508  -0.508
  599    H    GLU  75           HN       GLU  75  -4.422  -0.332  -0.332
  600    HA   GLU  75           HA       GLU  75  -2.816   1.761   1.761
  601   1HB   GLU  75           HBS      GLU  75  -4.257   2.446   2.446
  602   2HB   GLU  75           HBR      GLU  75  -5.419   1.280   1.280
  603   1HG   GLU  75           HGR      GLU  75  -5.349   3.350   3.350
  604   2HG   GLU  75           HGS      GLU  75  -5.489   3.932   3.932
  605    H    LEU  76           HN       LEU  76  -5.256  -0.368  -0.368
  606    HA   LEU  76           HA       LEU  76  -5.207   0.878   0.878
  607   1HB   LEU  76           HBS      LEU  76  -6.714  -1.068  -1.068
  608   2HB   LEU  76           HBR      LEU  76  -5.766  -1.991  -1.991
  609    HG   LEU  76           HG       LEU  76  -7.890   0.094   0.094
  610   1HD1  LEU  76           HMD      LEU  76  -7.548  -2.783  -2.783
  611   2HD1  LEU  76           HMD      LEU  76  -8.090  -1.990  -1.990
  612   3HD1  LEU  76           HMD      LEU  76  -9.028  -1.789  -1.789
  613   1HD2  LEU  76           HMD      LEU  76  -5.763   0.555   0.555
  614   2HD2  LEU  76           HMD      LEU  76  -7.286   0.339   0.339
  615   3HD2  LEU  76           HMD      LEU  76  -6.099  -0.988  -0.988
  616    H    ARG  77           HN       ARG  77  -3.172  -1.198  -1.198
  617    HA   ARG  77           HA       ARG  77  -1.853  -2.552  -2.552
  618   1HB   ARG  77           HBR      ARG  77  -1.932  -3.116  -3.116
  619   2HB   ARG  77           HBS      ARG  77  -0.511  -2.035  -2.035
  620   1HG   ARG  77           HGR      ARG  77   0.762  -3.449  -3.449
  621   2HG   ARG  77           HGS      ARG  77  -0.677  -4.393  -4.393
  622   1HD   ARG  77           HDS      ARG  77  -0.768  -5.521  -5.521
  623   2HD   ARG  77           HDR      ARG  77   0.099  -4.240  -4.240
  624    HE   ARG  77           HE       ARG  77   2.091  -5.264  -5.264
  625   1HH1  ARG  77           HH1      ARG  77  -0.312  -6.274  -6.274
  626   2HH1  ARG  77           HH1      ARG  77   0.677  -7.555  -7.555
  627   1HH2  ARG  77           HH2      ARG  77   3.303  -7.028  -7.028
  628   2HH2  ARG  77           HH2      ARG  77   2.725  -7.980  -7.980
  629    H    SER  78           HN       SER  78  -1.268   0.426   0.426
  630    HA   SER  78           HA       SER  78   1.028   1.185   1.185
  631   1HB   SER  78           HBS      SER  78   0.761   2.155   2.155
  632   2HB   SER  78           HBR      SER  78  -0.871   2.769   2.769
  633    HG   SER  78           HG       SER  78   1.771   3.584   3.584
  634    H    LEU  79           HN       LEU  79  -2.457   1.697   1.697
  635    HA   LEU  79           HA       LEU  79  -2.370   3.420   3.420
  636   1HB   LEU  79           HBS      LEU  79  -4.250   2.070   2.070
  637   2HB   LEU  79           HBR      LEU  79  -4.600   1.593   1.593
  638    HG   LEU  79           HG       LEU  79  -4.996   3.847   3.847
  639   1HD1  LEU  79           HMD      LEU  79  -3.155   4.575   4.575
  640   2HD1  LEU  79           HMD      LEU  79  -4.656   4.979   4.979
  641   3HD1  LEU  79           HMD      LEU  79  -4.333   5.699   5.699
  642   1HD2  LEU  79           HMD      LEU  79  -6.805   2.659   2.659
  643   2HD2  LEU  79           HMD      LEU  79  -6.864   4.403   4.403
  644   3HD2  LEU  79           HMD      LEU  79  -6.223   3.260   3.260
  645    H    TYR  80           HN       TYR  80  -2.353  -0.134  -0.134
  646    HA   TYR  80           HA       TYR  80  -2.610  -0.671  -0.671
  647   1HB   TYR  80           HBS      TYR  80  -3.059  -2.353  -2.353
  648   2HB   TYR  80           HBR      TYR  80  -1.330  -2.341  -2.341
  649    HD1  TYR  80           HD1      TYR  80  -3.603  -3.057  -3.057
  650    HD2  TYR  80           HD2      TYR  80   0.146  -3.807  -3.807
  651    HE1  TYR  80           HE1      TYR  80  -3.190  -4.890  -4.890
  652    HE2  TYR  80           HE2      TYR  80   0.612  -5.580  -5.580
  653    HH   TYR  80           HH       TYR  80  -1.244  -7.214  -7.214
  654    H    ASN  81           HN       ASN  81   0.231  -0.622  -0.622
  655    HA   ASN  81           HA       ASN  81   2.020  -1.457  -1.457
  656   1HB   ASN  81           HBS      ASN  81   3.772  -1.278  -1.278
  657   2HB   ASN  81           HBR      ASN  81   2.356  -1.987  -1.987
  658   1HD2  ASN  81           HD2      ASN  81   4.067   0.613   0.613
  659   2HD2  ASN  81           HD2      ASN  81   4.691  -0.697  -0.697
  660    H    THR  82           HN       THR  82   1.163   1.644   1.644
  661    HA   THR  82           HA       THR  82   2.893   3.151   3.151
  662    HB   THR  82           HB       THR  82   0.520   4.024   4.024
  663    HG1  THR  82           HG1      THR  82   2.038   3.070   3.070
  664   1HG2  THR  82           HMG      THR  82   1.492   5.536   5.536
  665   2HG2  THR  82           HMG      THR  82   2.635   5.971   5.971
  666   3HG2  THR  82           HMG      THR  82   0.883   6.199   6.199
  667    H    ILE  83           HN       ILE  83  -0.172   1.669   1.669
  668    HA   ILE  83           HA       ILE  83  -0.820   3.198   3.198
  669    HB   ILE  83           HB       ILE  83  -2.029   0.968   0.968
  670   1HG1  ILE  83           HG1      ILE  83  -2.668   3.233   3.233
  671   2HG1  ILE  83           HG1      ILE  83  -4.042   2.357   2.357
  672   1HG2  ILE  83           HMG      ILE  83  -1.920   0.250   0.250
  673   2HG2  ILE  83           HMG      ILE  83  -3.345   1.321   1.321
  674   3HG2  ILE  83           HMG      ILE  83  -3.313  -0.072  -0.072
  675   1HD1  ILE  83           HMD      ILE  83  -2.566   3.462   3.462
  676   2HD1  ILE  83           HMD      ILE  83  -2.692   4.748   4.748
  677   3HD1  ILE  83           HMD      ILE  83  -4.169   3.975   3.975
  678    H    ALA  84           HN       ALA  84   0.647   0.024   0.024
  679    HA   ALA  84           HA       ALA  84   0.914  -0.718  -0.718
  680   1HB   ALA  84           HMB      ALA  84   1.497  -1.847  -1.847
  681   2HB   ALA  84           HMB      ALA  84   2.950  -1.990  -1.990
  682   3HB   ALA  84           HMB      ALA  84   1.392  -2.641  -2.641
  683    H    VAL  85           HN       VAL  85   2.913   1.226   1.226
  684    HA   VAL  85           HA       VAL  85   5.131   1.575   1.575
  685    HB   VAL  85           HB       VAL  85   3.981   3.376   3.376
  686   1HG1  VAL  85           HMG      VAL  85   5.393   4.441   4.441
  687   2HG1  VAL  85           HMG      VAL  85   6.763   3.696   3.696
  688   3HG1  VAL  85           HMG      VAL  85   5.714   4.864   4.864
  689   1HG2  VAL  85           HMG      VAL  85   4.873   1.254   1.254
  690   2HG2  VAL  85           HMG      VAL  85   5.850   2.648   2.648
  691   3HG2  VAL  85           HMG      VAL  85   6.429   1.597   1.597
  692    H    LEU  86           HN       LEU  86   2.232   3.574   3.574
  693    HA   LEU  86           HA       LEU  86   2.781   5.422   5.422
  694   1HB   LEU  86           HBS      LEU  86   1.278   5.540   5.540
  695   2HB   LEU  86           HBR      LEU  86   0.029   4.771   4.771
  696    HG   LEU  86           HG       LEU  86  -0.212   6.651   6.651
  697   1HD1  LEU  86           HMD      LEU  86   2.321   7.750   7.750
  698   2HD1  LEU  86           HMD      LEU  86   1.255   8.631   8.631
  699   3HD1  LEU  86           HMD      LEU  86   2.132   7.183   7.183
  700   1HD2  LEU  86           HMD      LEU  86  -1.146   6.846   6.846
  701   2HD2  LEU  86           HMD      LEU  86  -0.642   8.438   8.438
  702   3HD2  LEU  86           HMD      LEU  86   0.368   7.589   7.589
  703    H    TYR  87           HN       TYR  87   1.219   2.301   2.301
  704    HA   TYR  87           HA       TYR  87   0.615   2.486   2.486
  705   1HB   TYR  87           HBS      TYR  87  -0.262   0.768   0.768
  706   2HB   TYR  87           HBR      TYR  87   1.256  -0.127  -0.127
  707    HD1  TYR  87           HD1      TYR  87   1.766  -0.104  -0.104
  708    HD2  TYR  87           HD2      TYR  87  -2.091   0.191   0.191
  709    HE1  TYR  87           HE1      TYR  87   0.733  -0.829  -0.829
  710    HE2  TYR  87           HE2      TYR  87  -3.116   0.009   0.009
  711    HH   TYR  87           HH       TYR  87  -2.054  -1.827  -1.827
  712    H    CYS  88           HN       CYS  88   3.469   1.362   1.362
  713    HA   CYS  88           HA       CYS  88   4.966   0.406   0.406
  714   1HB   CYS  88           HBS      CYS  88   5.312   0.758   0.758
  715   2HB   CYS  88           HBR      CYS  88   6.606   1.710   1.710
  716    H    VAL  89           HN       VAL  89   4.550   3.622   3.622
  717    HA   VAL  89           HA       VAL  89   6.495   4.808   4.808
  718    HB   VAL  89           HB       VAL  89   4.333   6.291   6.291
  719   1HG1  VAL  89           HMG      VAL  89   5.819   7.628   7.628
  720   2HG1  VAL  89           HMG      VAL  89   7.231   6.992   6.992
  721   3HG1  VAL  89           HMG      VAL  89   6.035   7.999   7.999
  722   1HG2  VAL  89           HMG      VAL  89   6.174   4.430   4.430
  723   2HG2  VAL  89           HMG      VAL  89   4.973   5.472   5.472
  724   3HG2  VAL  89           HMG      VAL  89   6.622   6.075   6.075
  725    H    HIS  90           HN       HIS  90   2.935   4.723   4.723
  726    HA   HIS  90           HA       HIS  90   2.618   6.613   6.613
  727   1HB   HIS  90           HBS      HIS  90   0.790   4.401   4.401
  728   2HB   HIS  90           HBR      HIS  90   0.357   5.439   5.439
  729    HD1  HIS  90           HD1      HIS  90   1.606   8.124   8.124
  730    HD2  HIS  90           HD2      HIS  90  -0.891   5.415   5.415
  731    HE1  HIS  90           HE1      HIS  90   0.579   9.362   9.362
  732    HE2  HIS  90           HE2      HIS  90  -0.944   7.732   7.732
  733    H    GLN  91           HN       GLN  91   3.301   3.177   3.177
  734    HA   GLN  91           HA       GLN  91   2.929   2.719   2.719
  735   1HB   GLN  91           HBR      GLN  91   3.887   1.219   1.219
  736   2HB   GLN  91           HBS      GLN  91   5.101   1.168   1.168
  737   1HG   GLN  91           HGS      GLN  91   3.441  -0.700  -0.700
  738   2HG   GLN  91           HGR      GLN  91   3.546   0.255   0.255
  739   1HE2  GLN  91           HE2      GLN  91   0.025  -0.166  -0.166
  740   2HE2  GLN  91           HE2      GLN  91   1.468  -0.961  -0.961
  741    H    ARG  92           HN       ARG  92   5.849   3.424   3.424
  742    HA   ARG  92           HA       ARG  92   7.507   4.620   4.620
  743   1HB   ARG  92           HBR      ARG  92   6.745   2.375   2.375
  744   2HB   ARG  92           HBS      ARG  92   8.075   1.707   1.707
  745   1HG   ARG  92           HGS      ARG  92   9.053   2.265   2.265
  746   2HG   ARG  92           HGR      ARG  92   9.519   3.585   3.585
  747   1HD   ARG  92           HDR      ARG  92   7.652   4.928   4.928
  748   2HD   ARG  92           HDS      ARG  92   7.291   3.622   3.622
  749    HE   ARG  92           HE       ARG  92   9.711   4.038   4.038
  750   1HH1  ARG  92           HH1      ARG  92   7.420   6.500   6.500
  751   2HH1  ARG  92           HH1      ARG  92   8.274   7.787   7.787
  752   1HH2  ARG  92           HH2      ARG  92  10.869   5.765   5.765
  753   2HH2  ARG  92           HH2      ARG  92  10.227   7.371   7.371
  754    H    ILE  93           HN       ILE  93   7.102   1.959   1.959
  755    HA   ILE  93           HA       ILE  93   9.946   1.603   1.603
  756    HB   ILE  93           HB       ILE  93   7.568   0.630   0.630
  757   1HG1  ILE  93           HG1      ILE  93   8.170  -1.531  -1.531
  758   2HG1  ILE  93           HG1      ILE  93   8.545  -0.224  -0.224
  759   1HG2  ILE  93           HMG      ILE  93  10.443  -0.236  -0.236
  760   2HG2  ILE  93           HMG      ILE  93   9.175  -1.320  -1.320
  761   3HG2  ILE  93           HMG      ILE  93   9.516   0.226   0.226
  762   1HD1  ILE  93           HMD      ILE  93   6.056   0.417   0.417
  763   2HD1  ILE  93           HMD      ILE  93   5.999  -1.309  -1.309
  764   3HD1  ILE  93           HMD      ILE  93   6.385  -0.077  -0.077
  765    H    ASP  94           HN       ASP  94  11.099   2.403   2.403
  766    HA   ASP  94           HA       ASP  94   9.657   3.985   3.985
  767   1HB   ASP  94           HBR      ASP  94  12.394   4.724   4.724
  768   2HB   ASP  94           HBS      ASP  94  11.577   5.427   5.427
  769    H    VAL  95           HN       VAL  95  10.376   3.721   3.721
  770    HA   VAL  95           HA       VAL  95  12.017   1.271   1.271
  771    HB   VAL  95           HB       VAL  95  10.411   0.369   0.369
  772   1HG1  VAL  95           HMG      VAL  95   9.790   0.917   0.917
  773   2HG1  VAL  95           HMG      VAL  95   8.387   1.636   1.636
  774   3HG1  VAL  95           HMG      VAL  95   8.792  -0.079  -0.079
  775   1HG2  VAL  95           HMG      VAL  95   9.658   3.111   3.111
  776   2HG2  VAL  95           HMG      VAL  95   9.423   1.617   1.617
  777   3HG2  VAL  95           HMG      VAL  95   8.241   2.077   2.077
  778    H    LYS  96           HN       LYS  96  12.045   1.033   1.033
  779    HA   LYS  96           HA       LYS  96  13.705   3.382   3.382
  780   1HB   LYS  96           HBR      LYS  96  14.260   0.468   0.468
  781   2HB   LYS  96           HBS      LYS  96  15.118   1.880   1.880
  782   1HG   LYS  96           HGR      LYS  96  16.598   1.640   1.640
  783   2HG   LYS  96           HGS      LYS  96  15.322   2.226   2.226
  784   1HD   LYS  96           HDR      LYS  96  15.469  -0.661  -0.661
  785   2HD   LYS  96           HDS      LYS  96  16.587  -0.033  -0.033
  786   1HE   LYS  96           HES      LYS  96  14.499   0.907   0.907
  787   2HE   LYS  96           HER      LYS  96  13.590  -0.178  -0.178
  788   1HZ   LYS  96           HZA      LYS  96  15.588  -1.694  -1.694
  789   2HZ   LYS  96           HZB      LYS  96  15.062  -0.814  -0.814
  790   3HZ   LYS  96           HZC      LYS  96  14.012  -1.737  -1.737
  791    H    ASP  97           HN       ASP  97  12.720   0.378   0.378
  792    HA   ASP  97           HA       ASP  97  10.797   1.975   1.975
  793   1HB   ASP  97           HBS      ASP  97  11.174   0.655   0.655
  794   2HB   ASP  97           HBR      ASP  97  12.787   0.843   0.843
  795    H    THR  98           HN       THR  98   8.912   0.689   0.689
  796    HA   THR  98           HA       THR  98   7.427   0.404   0.404
  797    HB   THR  98           HB       THR  98   6.053  -0.483  -0.483
  798    HG1  THR  98           HG1      THR  98   6.237   1.167   1.167
  799   1HG2  THR  98           HMG      THR  98   5.008   0.295   0.295
  800   2HG2  THR  98           HMG      THR  98   5.413   1.939   1.939
  801   3HG2  THR  98           HMG      THR  98   4.325   0.913   0.913
  802    H    LYS  99           HN       LYS  99   9.000  -1.959  -1.959
  803    HA   LYS  99           HA       LYS  99   7.313  -4.207  -4.207
  804   1HB   LYS  99           HBR      LYS  99   8.663  -4.060  -4.060
  805   2HB   LYS  99           HBS      LYS  99  10.086  -4.420  -4.420
  806   1HG   LYS  99           HGS      LYS  99   8.178  -6.338  -6.338
  807   2HG   LYS  99           HGR      LYS  99   8.026  -6.207  -6.207
  808   1HD   LYS  99           HDS      LYS  99   9.818  -7.491  -7.491
  809   2HD   LYS  99           HDR      LYS  99  10.763  -6.220  -6.220
  810   1HE   LYS  99           HES      LYS  99   9.349  -7.783  -7.783
  811   2HE   LYS  99           HER      LYS  99  10.442  -8.758  -8.758
  812   1HZ   LYS  99           HZA      LYS  99  11.894  -6.584  -6.584
  813   2HZ   LYS  99           HZB      LYS  99  11.074  -6.797  -6.797
  814   3HZ   LYS  99           HZC      LYS  99  11.992  -8.007  -8.007
  815    H    GLU 100           HN       GLU 100  10.191  -2.476  -2.476
  816    HA   GLU 100           HA       GLU 100  11.082  -4.317  -4.317
  817   1HB   GLU 100           HBR      GLU 100  11.788  -1.878  -1.878
  818   2HB   GLU 100           HBS      GLU 100  11.299  -1.436  -1.436
  819   1HG   GLU 100           HGS      GLU 100  13.695  -1.750  -1.750
  820   2HG   GLU 100           HGR      GLU 100  13.040  -2.285  -2.285
  821    H    ALA 101           HN       ALA 101   8.994  -1.403  -1.403
  822    HA   ALA 101           HA       ALA 101   8.233  -1.732  -1.732
  823   1HB   ALA 101           HMB      ALA 101   7.778   0.143   0.143
  824   2HB   ALA 101           HMB      ALA 101   6.174  -0.573  -0.573
  825   3HB   ALA 101           HMB      ALA 101   7.094   0.138   0.138
  826    H    LEU 102           HN       LEU 102   6.600  -2.609  -2.609
  827    HA   LEU 102           HA       LEU 102   4.339  -3.734  -3.734
  828   1HB   LEU 102           HBS      LEU 102   4.712  -2.997  -2.997
  829   2HB   LEU 102           HBR      LEU 102   5.544  -4.556  -4.556
  830    HG   LEU 102           HG       LEU 102   3.281  -5.549  -5.549
  831   1HD1  LEU 102           HMD      LEU 102   2.701  -2.734  -2.734
  832   2HD1  LEU 102           HMD      LEU 102   1.728  -3.663  -3.663
  833   3HD1  LEU 102           HMD      LEU 102   1.653  -4.059  -4.059
  834   1HD2  LEU 102           HMD      LEU 102   4.380  -4.778  -4.778
  835   2HD2  LEU 102           HMD      LEU 102   3.535  -6.272  -6.272
  836   3HD2  LEU 102           HMD      LEU 102   2.600  -4.848  -4.848
  837    H    ASP 103           HN       ASP 103   7.536  -4.960  -4.960
  838    HA   ASP 103           HA       ASP 103   6.836  -7.710  -7.710
  839   1HB   ASP 103           HBR      ASP 103   8.978  -6.847  -6.847
  840   2HB   ASP 103           HBS      ASP 103   9.529  -6.502  -6.502
  841    H    LYS 104           HN       LYS 104   8.475  -5.168  -5.168
  842    HA   LYS 104           HA       LYS 104   8.117  -6.371  -6.371
  843   1HB   LYS 104           HBS      LYS 104   9.324  -4.104  -4.104
  844   2HB   LYS 104           HBR      LYS 104   7.890  -3.408  -3.408
  845   1HG   LYS 104           HGS      LYS 104   8.680  -3.872  -3.872
  846   2HG   LYS 104           HGR      LYS 104   9.244  -5.498  -5.498
  847   1HD   LYS 104           HDR      LYS 104  10.692  -3.038  -3.038
  848   2HD   LYS 104           HDS      LYS 104  10.890  -3.561  -3.561
  849   1HE   LYS 104           HER      LYS 104  11.332  -5.339  -5.339
  850   2HE   LYS 104           HES      LYS 104  12.625  -4.372  -4.372
  851   1HZ   LYS 104           HZC      LYS 104  11.116  -5.979  -5.979
  852   2HZ   LYS 104           HZA      LYS 104  11.947  -6.849  -6.849
  853   3HZ   LYS 104           HZB      LYS 104  12.734  -5.794  -5.794
  854    H    ILE 105           HN       ILE 105   5.795  -4.869  -4.869
  855    HA   ILE 105           HA       ILE 105   3.931  -4.299  -4.299
  856    HB   ILE 105           HB       ILE 105   3.783  -4.161  -4.161
  857   1HG1  ILE 105           HG1      ILE 105   5.222  -2.564  -2.564
  858   2HG1  ILE 105           HG1      ILE 105   3.857  -1.771  -1.771
  859   1HG2  ILE 105           HMG      ILE 105   1.578  -3.843  -3.843
  860   2HG2  ILE 105           HMG      ILE 105   1.697  -2.660  -2.660
  861   3HG2  ILE 105           HMG      ILE 105   1.536  -4.399  -4.399
  862   1HD1  ILE 105           HMD      ILE 105   2.669  -1.894  -1.894
  863   2HD1  ILE 105           HMD      ILE 105   4.299  -2.189  -2.189
  864   3HD1  ILE 105           HMD      ILE 105   3.956  -0.679  -0.679
  865    H    GLU 106           HN       GLU 106   3.763  -6.506  -6.506
  866    HA   GLU 106           HA       GLU 106   1.851  -8.275  -8.275
  867   1HB   GLU 106           HBR      GLU 106   3.586  -8.010  -8.010
  868   2HB   GLU 106           HBS      GLU 106   4.261  -9.312  -9.312
  869   1HG   GLU 106           HGR      GLU 106   2.509 -10.766 -10.766
  870   2HG   GLU 106           HGS      GLU 106   1.465  -9.391  -9.391
  871    H    GLU 107           HN       GLU 107   5.081  -7.784  -7.784
  872    HA   GLU 107           HA       GLU 107   5.394 -10.572 -10.572
  873   1HB   GLU 107           HBR      GLU 107   6.993  -9.251  -9.251
  874   2HB   GLU 107           HBS      GLU 107   7.152  -8.166  -8.166
  875   1HG   GLU 107           HGS      GLU 107   9.011  -9.125  -9.125
  876   2HG   GLU 107           HGR      GLU 107   8.081 -10.147 -10.147
  877    H    GLU 108           HN       GLU 108   4.690  -7.422  -7.422
  878    HA   GLU 108           HA       GLU 108   5.471  -8.217  -8.217
  879   1HB   GLU 108           HBR      GLU 108   6.117  -5.478  -5.478
  880   2HB   GLU 108           HBS      GLU 108   6.588  -6.254  -6.254
  881   1HG   GLU 108           HGS      GLU 108   7.644  -6.857  -6.857
  882   2HG   GLU 108           HGR      GLU 108   8.465  -5.900  -5.900
  883    H    GLN 109           HN       GLN 109   3.986  -5.782  -5.782
  884    HA   GLN 109           HA       GLN 109   1.883  -5.075  -5.075
  885   1HB   GLN 109           HBR      GLN 109   2.610  -4.334  -4.334
  886   2HB   GLN 109           HBS      GLN 109   0.917  -4.901  -4.901
  887   1HG   GLN 109           HGS      GLN 109   1.148  -2.464  -2.464
  888   2HG   GLN 109           HGR      GLN 109   0.316  -3.314  -3.314
  889   1HE2  GLN 109           HE2      GLN 109   3.951  -1.480  -1.480
  890   2HE2  GLN 109           HE2      GLN 109   3.286  -1.750  -1.750
  891    H    ASN 110           HN       ASN 110   2.497  -7.716  -7.716
  892    HA   ASN 110           HA       ASN 110   1.584  -9.782  -9.782
  893   1HB   ASN 110           HBS      ASN 110   2.101  -9.407  -9.407
  894   2HB   ASN 110           HBR      ASN 110   0.328  -9.303  -9.303
  895   1HD2  ASN 110           HD2      ASN 110   2.199 -12.882 -12.882
  896   2HD2  ASN 110           HD2      ASN 110   3.045 -11.377 -11.377
  897    H    LYS 111           HN       LYS 111   0.168 -10.172 -10.172
  898    HA   LYS 111           HA       LYS 111  -2.444 -10.738 -10.738
  899   1HB   LYS 111           HBR      LYS 111  -3.551  -9.027  -9.027
  900   2HB   LYS 111           HBS      LYS 111  -3.316  -8.632  -8.632
  901   1HG   LYS 111           HGR      LYS 111  -1.374  -7.286  -7.286
  902   2HG   LYS 111           HGS      LYS 111  -1.410  -7.800  -7.800
  903   1HD   LYS 111           HDS      LYS 111  -2.273  -5.545  -5.545
  904   2HD   LYS 111           HDR      LYS 111  -3.422  -6.654  -6.654
  905   1HE   LYS 111           HES      LYS 111  -3.421  -6.007  -6.007
  906   2HE   LYS 111           HER      LYS 111  -4.312  -5.056  -5.056
  907   1HZ   LYS 111           HZA      LYS 111  -5.035  -7.550  -7.550
  908   2HZ   LYS 111           HZB      LYS 111  -4.883  -7.649  -7.649
  909   3HZ   LYS 111           HZC      LYS 111  -5.888  -6.544  -6.544
  910    H    SER 112           HN       SER 112  -1.691 -12.567 -12.567
  911    HA   SER 112           HA       SER 112  -2.117 -12.736 -12.736
  912   1HB   SER 112           HBS      SER 112   0.183 -13.171 -13.171
  913   2HB   SER 112           HBR      SER 112  -0.024 -11.497 -11.497
  914    HG   SER 112           HG       SER 112   1.148 -11.790 -11.790
  915    H    LYS 113           HN       LYS 113  -2.802 -14.697 -14.697
  916    HA   LYS 113           HA       LYS 113  -1.477 -17.027 -17.027
  917   1HB   LYS 113           HBR      LYS 113  -2.463 -16.176 -16.176
  918   2HB   LYS 113           HBS      LYS 113  -3.924 -16.997 -16.997
  919   1HG   LYS 113           HGR      LYS 113  -1.507 -18.623 -18.623
  920   2HG   LYS 113           HGS      LYS 113  -1.813 -18.182 -18.182
  921   1HD   LYS 113           HDS      LYS 113  -4.137 -19.003 -19.003
  922   2HD   LYS 113           HDR      LYS 113  -3.761 -19.506 -19.506
  923   1HE   LYS 113           HES      LYS 113  -3.466 -21.478 -21.478
  924   2HE   LYS 113           HER      LYS 113  -1.809 -20.813 -20.813
  925   1HZ   LYS 113           HZC      LYS 113  -2.844 -19.809 -19.809
  926   2HZ   LYS 113           HZA      LYS 113  -3.674 -21.214 -21.214
  927   3HZ   LYS 113           HZB      LYS 113  -2.041 -21.229 -21.229
  928    H    LYS 114           HN       LYS 114  -4.476 -15.356 -15.356
  929    HA   LYS 114           HA       LYS 114  -5.938 -17.709 -17.709
  930   1HB   LYS 114           HBR      LYS 114  -6.915 -15.550 -15.550
  931   2HB   LYS 114           HBS      LYS 114  -6.599 -14.838 -14.838
  932   1HG   LYS 114           HGR      LYS 114  -7.953 -17.247 -17.247
  933   2HG   LYS 114           HGS      LYS 114  -8.792 -16.537 -16.537
  934   1HD   LYS 114           HDS      LYS 114  -8.796 -14.352 -14.352
  935   2HD   LYS 114           HDR      LYS 114  -8.350 -15.328 -15.328
  936   1HE   LYS 114           HES      LYS 114 -10.358 -16.693 -16.693
  937   2HE   LYS 114           HER      LYS 114 -10.821 -15.710 -15.710
  938   1HZ   LYS 114           HZC      LYS 114 -10.611 -13.796 -13.796
  939   2HZ   LYS 114           HZA      LYS 114 -10.749 -14.938 -14.938
  940   3HZ   LYS 114           HZB      LYS 114 -11.944 -14.738 -14.738
  941    H    LYS 115           HN       LYS 115  -5.300 -18.816 -18.816
  942    HA   LYS 115           HA       LYS 115  -5.039 -19.375 -19.375
  943   1HB   LYS 115           HBR      LYS 115  -6.215 -16.618 -16.618
  944   2HB   LYS 115           HBS      LYS 115  -6.076 -17.946 -17.946
  945   1HG   LYS 115           HGR      LYS 115  -7.451 -18.994 -18.994
  946   2HG   LYS 115           HGS      LYS 115  -8.184 -17.406 -17.406
  947   1HD   LYS 115           HDS      LYS 115  -8.120 -18.308 -18.308
  948   2HD   LYS 115           HDR      LYS 115  -8.015 -19.861 -19.861
  949   1HE   LYS 115           HES      LYS 115 -10.137 -19.842 -19.842
  950   2HE   LYS 115           HER      LYS 115 -10.101 -18.088 -18.088
  951   1HZ   LYS 115           HZB      LYS 115 -10.159 -19.142 -19.142
  952   2HZ   LYS 115           HZC      LYS 115 -11.528 -18.856 -18.856
  953   3HZ   LYS 115           HZA      LYS 115 -10.503 -17.629 -17.629
  954    H    ALA 116           HN       ALA 116  -3.962 -18.771 -18.771
  955    HA   ALA 116           HA       ALA 116  -1.835 -16.718 -16.718
  956   1HB   ALA 116           HMB      ALA 116  -0.921 -19.011 -19.011
  957   2HB   ALA 116           HMB      ALA 116  -1.660 -19.245 -19.245
  958   3HB   ALA 116           HMB      ALA 116  -0.393 -18.013 -18.013
  959    H    GLN 117           HN       GLN 117  -0.980 -16.876 -16.876
  960    HA   GLN 117           HA       GLN 117  -3.279 -15.486 -15.486
  961   1HB   GLN 117           HBR      GLN 117  -1.473 -14.420 -14.420
  962   2HB   GLN 117           HBS      GLN 117  -1.696 -13.817 -13.817
  963   1HG   GLN 117           HGS      GLN 117   0.201 -15.668 -15.668
  964   2HG   GLN 117           HGR      GLN 117   0.593 -15.246 -15.246
  965   1HE2  GLN 117           HE2      GLN 117   2.140 -13.063 -13.063
  966   2HE2  GLN 117           HE2      GLN 117   1.758 -14.753 -14.753
  967    H    GLN 118           HN       GLN 118  -0.234 -17.129 -17.129
  968    HA   GLN 118           HA       GLN 118  -1.406 -17.826 -17.826
  969   1HB   GLN 118           HBR      GLN 118   0.783 -18.866 -18.866
  970   2HB   GLN 118           HBS      GLN 118   0.871 -17.148 -17.148
  971   1HG   GLN 118           HGS      GLN 118   1.162 -18.527 -18.527
  972   2HG   GLN 118           HGR      GLN 118   2.074 -19.514 -19.514
  973   1HE2  GLN 118           HE2      GLN 118   3.959 -16.572 -16.572
  974   2HE2  GLN 118           HE2      GLN 118   2.765 -17.640 -17.640
  975    H    ALA 119           HN       ALA 119  -1.251 -20.000 -20.000
  976    HA   ALA 119           HA       ALA 119  -2.114 -22.024 -22.024
  977   1HB   ALA 119           HMB      ALA 119  -2.995 -21.503 -21.503
  978   2HB   ALA 119           HMB      ALA 119  -3.159 -23.113 -23.113
  979   3HB   ALA 119           HMB      ALA 119  -3.973 -21.706 -21.706
  980    H    ALA 120           HN       ALA 120  -0.908 -21.998 -21.998
  981    HA   ALA 120           HA       ALA 120   1.445 -23.518 -23.518
  982   1HB   ALA 120           HMB      ALA 120  -0.862 -24.935 -24.935
  983   2HB   ALA 120           HMB      ALA 120   0.333 -24.986 -24.986
  984   3HB   ALA 120           HMB      ALA 120   0.782 -25.551 -25.551
  985    H    ALA 121           HN       ALA 121  -0.203 -23.553 -23.553
  986    HA   ALA 121           HA       ALA 121   1.721 -21.506 -21.506
  987   1HB   ALA 121           HMB      ALA 121   1.549 -24.286 -24.286
  988   2HB   ALA 121           HMB      ALA 121   1.032 -23.379 -23.379
  989   3HB   ALA 121           HMB      ALA 121   2.621 -23.051 -23.051
  990    H    ASP 122           HN       ASP 122   0.970 -21.189 -21.189
  991    HA   ASP 122           HA       ASP 122  -1.905 -20.486 -20.486
  992   1HB   ASP 122           HBS      ASP 122  -1.440 -18.637 -18.637
  993   2HB   ASP 122           HBR      ASP 122  -0.430 -18.574 -18.574
  994    H    THR 123           HN       THR 123  -2.964 -22.099 -22.099
  995    HA   THR 123           HA       THR 123  -1.944 -23.606 -23.606
  996    HB   THR 123           HB       THR 123  -3.355 -24.695 -24.695
  997    HG1  THR 123           HG1      THR 123  -3.038 -25.436 -25.436
  998   1HG2  THR 123           HMG      THR 123  -5.020 -22.590 -22.590
  999   2HG2  THR 123           HMG      THR 123  -5.866 -23.672 -23.672
 1000   3HG2  THR 123           HMG      THR 123  -5.521 -24.218 -24.218
 1001    H    GLY 124           HN       GLY 124  -4.380 -23.925 -23.925
 1002   1HA   GLY 124           HAR      GLY 124  -5.376 -21.502 -21.502
 1003   2HA   GLY 124           HAS      GLY 124  -3.901 -22.027 -22.027
 1004    H    ASN 125           HN       ASN 125  -4.304 -24.857 -24.857
 1005    HA   ASN 125           HA       ASN 125  -5.388 -26.693 -26.693
 1006   1HB   ASN 125           HBS      ASN 125  -7.441 -25.786 -25.786
 1007   2HB   ASN 125           HBR      ASN 125  -7.790 -24.946 -24.946
 1008   1HD2  ASN 125           HD2      ASN 125  -7.955 -29.089 -29.089
 1009   2HD2  ASN 125           HD2      ASN 125  -6.831 -28.235 -28.235
 1010    H    ASN 126           HN       ASN 126  -5.214 -27.692 -27.692
 1011    HA   ASN 126           HA       ASN 126  -5.339 -26.410 -26.410
 1012   1HB   ASN 126           HBS      ASN 126  -3.274 -25.433 -25.433
 1013   2HB   ASN 126           HBR      ASN 126  -2.508 -26.939 -26.939
 1014   1HD2  ASN 126           HD2      ASN 126  -2.670 -23.790 -23.790
 1015   2HD2  ASN 126           HD2      ASN 126  -2.784 -23.765 -23.765
 1016    H    SER 127           HN       SER 127  -3.910 -28.954 -28.954
 1017    HA   SER 127           HA       SER 127  -3.955 -31.221 -31.221
 1018   1HB   SER 127           HBS      SER 127  -6.305 -30.268 -30.268
 1019   2HB   SER 127           HBR      SER 127  -5.764 -31.928 -31.928
 1020    HG   SER 127           HG       SER 127  -6.184 -30.777 -30.777
 1021    H    GLN 128           HN       GLN 128  -4.853 -30.642 -30.642
 1022    HA   GLN 128           HA       GLN 128  -2.226 -31.327 -31.327
 1023   1HB   GLN 128           HBR      GLN 128  -3.724 -33.460 -33.460
 1024   2HB   GLN 128           HBS      GLN 128  -4.122 -33.381 -33.381
 1025   1HG   GLN 128           HGS      GLN 128  -2.271 -34.843 -34.843
 1026   2HG   GLN 128           HGR      GLN 128  -1.642 -33.306 -33.306
 1027   1HE2  GLN 128           HE2      GLN 128   0.860 -33.205 -33.205
 1028   2HE2  GLN 128           HE2      GLN 128   0.313 -32.985 -32.985
 1029    H    VAL 129           HN       VAL 129  -5.449 -32.218 -32.218
 1030    HA   VAL 129           HA       VAL 129  -5.614 -29.906 -29.906
 1031    HB   VAL 129           HB       VAL 129  -5.776 -31.381 -31.381
 1032   1HG1  VAL 129           HMG      VAL 129  -3.967 -29.608 -29.608
 1033   2HG1  VAL 129           HMG      VAL 129  -2.922 -31.049 -31.049
 1034   3HG1  VAL 129           HMG      VAL 129  -3.764 -30.570 -30.570
 1035   1HG2  VAL 129           HMG      VAL 129  -4.580 -33.257 -33.257
 1036   2HG2  VAL 129           HMG      VAL 129  -5.383 -33.548 -33.548
 1037   3HG2  VAL 129           HMG      VAL 129  -3.665 -33.086 -33.086
 1038    H    SER 130           HN       SER 130  -6.724 -33.312 -33.312
 1039    HA   SER 130           HA       SER 130  -9.410 -32.810 -32.810
 1040   1HB   SER 130           HBS      SER 130 -10.358 -33.148 -33.148
 1041   2HB   SER 130           HBR      SER 130  -9.845 -31.514 -31.514
 1042    HG   SER 130           HG       SER 130  -7.924 -31.672 -31.672
 1043    H    GLN 131           HN       GLN 131  -7.151 -34.638 -34.638
 1044    HA   GLN 131           HA       GLN 131  -6.884 -36.877 -36.877
 1045   1HB   GLN 131           HBR      GLN 131  -7.806 -36.941 -36.941
 1046   2HB   GLN 131           HBS      GLN 131  -9.080 -37.855 -37.855
 1047   1HG   GLN 131           HGS      GLN 131  -7.268 -39.285 -39.285
 1048   2HG   GLN 131           HGR      GLN 131  -7.466 -39.411 -39.411
 1049   1HE2  GLN 131           HE2      GLN 131  -4.159 -37.508 -37.508
 1050   2HE2  GLN 131           HE2      GLN 131  -5.655 -37.558 -37.558
 1051    H    ASN 132           HN       ASN 132 -10.365 -36.394 -36.394
 1052    HA   ASN 132           HA       ASN 132 -12.228 -36.895 -36.895
 1053   1HB   ASN 132           HBS      ASN 132 -12.338 -35.856 -35.856
 1054   2HB   ASN 132           HBR      ASN 132 -11.336 -34.861 -34.861
 1055   1HD2  ASN 132           HD2      ASN 132  -8.368 -35.132 -35.132
 1056   2HD2  ASN 132           HD2      ASN 132  -9.082 -34.708 -34.708
 1057    H    TYR 133           HN       TYR 133 -12.562 -39.006 -39.006
 1058    HA   TYR 133           HA       TYR 133 -12.953 -41.138 -41.138
 1059   1HB   TYR 133           HBS      TYR 133 -12.438 -39.686 -39.686
 1060   2HB   TYR 133           HBR      TYR 133 -11.995 -41.416 -41.416
 1061    HD1  TYR 133           HD1      TYR 133 -14.847 -39.632 -39.632
 1062    HD2  TYR 133           HD2      TYR 133 -13.647 -42.547 -42.547
 1063    HE1  TYR 133           HE1      TYR 133 -17.202 -40.217 -40.217
 1064    HE2  TYR 133           HE2      TYR 133 -15.997 -43.120 -43.120
 1065    HH   TYR 133           HH       TYR 133 -18.195 -42.958 -42.958

  Start of MODEL   14
    1   1H    HIS   1           HNB      HIS   1  -1.891  15.879  15.879
    2   2H    HIS   1           HNC      HIS   1  -2.759  15.236  15.236
    3   3H    HIS   1           HN       HIS   1  -3.346  15.198  15.198
    4    HA   HIS   1           HA       HIS   1  -1.846  13.654  13.654
    5   1HB   HIS   1           HBS      HIS   1  -2.244  12.571  12.571
    6   2HB   HIS   1           HBR      HIS   1  -2.397  11.752  11.752
    7    HD1  HIS   1           HD1      HIS   1  -4.555  12.456  12.456
    8    HD2  HIS   1           HD2      HIS   1  -4.668  13.504  13.504
    9    HE1  HIS   1           HE1      HIS   1  -6.922  13.119  13.119
   10    HE2  HIS   1           HE2      HIS   1  -6.992  13.776  13.776
   11    H    MET   2           HN       MET   2  -1.104  13.917  13.917
   12    HA   MET   2           HA       MET   2   1.762  13.645  13.645
   13   1HB   MET   2           HBS      MET   2   0.097  12.756  12.756
   14   2HB   MET   2           HBR      MET   2   1.871  12.930  12.930
   15   1HG   MET   2           HGR      MET   2   2.244  11.328  11.328
   16   2HG   MET   2           HGS      MET   2   0.523  11.299  11.299
   17   1HE   MET   2           HME      MET   2   0.473   9.055   9.055
   18   2HE   MET   2           HME      MET   2  -0.870   8.840   8.840
   19   3HE   MET   2           HME      MET   2   0.623   7.884   7.884
   20    H    GLY   3           HN       GLY   3  -0.548  15.800  15.800
   21   1HA   GLY   3           HAS      GLY   3   1.131  18.069  18.069
   22   2HA   GLY   3           HAR      GLY   3   1.179  17.337  17.337
   23    H    ALA   4           HN       ALA   4   0.195  19.662  19.662
   24    HA   ALA   4           HA       ALA   4  -2.679  19.892  19.892
   25   1HB   ALA   4           HMB      ALA   4  -0.572  21.370  21.370
   26   2HB   ALA   4           HMB      ALA   4  -2.307  21.673  21.673
   27   3HB   ALA   4           HMB      ALA   4  -1.594  21.933  21.933
   28    H    ARG   5           HN       ARG   5  -0.435  18.776  18.776
   29    HA   ARG   5           HA       ARG   5  -2.310  16.866  16.866
   30   1HB   ARG   5           HBS      ARG   5  -2.275  19.472  19.472
   31   2HB   ARG   5           HBR      ARG   5  -2.031  18.050  18.050
   32   1HG   ARG   5           HGS      ARG   5  -4.122  17.067  17.067
   33   2HG   ARG   5           HGR      ARG   5  -4.393  18.658  18.658
   34   1HD   ARG   5           HDS      ARG   5  -3.849  19.238  19.238
   35   2HD   ARG   5           HDR      ARG   5  -4.879  17.779  17.779
   36    HE   ARG   5           HE       ARG   5  -6.653  19.023  19.023
   37   1HH1  ARG   5           HH1      ARG   5  -3.725  20.981  20.981
   38   2HH1  ARG   5           HH1      ARG   5  -4.539  22.425  22.425
   39   1HH2  ARG   5           HH2      ARG   5  -7.659  20.902  20.902
   40   2HH2  ARG   5           HH2      ARG   5  -6.764  22.381  22.381
   41    H    ALA   6           HN       ALA   6   0.076  18.870  18.870
   42    HA   ALA   6           HA       ALA   6   1.973  18.323  18.323
   43   1HB   ALA   6           HMB      ALA   6   2.047  16.091  16.091
   44   2HB   ALA   6           HMB      ALA   6   3.276  16.302  16.302
   45   3HB   ALA   6           HMB      ALA   6   3.022  17.580  17.580
   46    H    SER   7           HN       SER   7   0.521  18.049  18.049
   47    HA   SER   7           HA       SER   7  -0.835  16.973  16.973
   48   1HB   SER   7           HBR      SER   7   1.938  16.039  16.039
   49   2HB   SER   7           HBS      SER   7   0.988  15.149  15.149
   50    HG   SER   7           HG       SER   7   2.288  17.468  17.468
   51    H    VAL   8           HN       VAL   8  -0.572  14.293  14.293
   52    HA   VAL   8           HA       VAL   8  -1.917  12.434  12.434
   53    HB   VAL   8           HB       VAL   8   0.132  12.319  12.319
   54   1HG1  VAL   8           HMG      VAL   8   0.502  10.316  10.316
   55   2HG1  VAL   8           HMG      VAL   8  -1.213   9.874   9.874
   56   3HG1  VAL   8           HMG      VAL   8  -0.154   9.909   9.909
   57   1HG2  VAL   8           HMG      VAL   8  -2.540  12.829  12.829
   58   2HG2  VAL   8           HMG      VAL   8  -1.566  12.205  12.205
   59   3HG2  VAL   8           HMG      VAL   8  -2.501  11.081  11.081
   60    H    LEU   9           HN       LEU   9   1.526  13.258  13.258
   61    HA   LEU   9           HA       LEU   9   2.134  10.915  10.915
   62   1HB   LEU   9           HBR      LEU   9   3.432  12.588  12.588
   63   2HB   LEU   9           HBS      LEU   9   4.463  11.549  11.549
   64    HG   LEU   9           HG       LEU   9   2.145  10.596  10.596
   65   1HD1  LEU   9           HMD      LEU   9   5.148  10.530  10.530
   66   2HD1  LEU   9           HMD      LEU   9   3.992   9.528   9.528
   67   3HD1  LEU   9           HMD      LEU   9   3.920  11.305  11.305
   68   1HD2  LEU   9           HMD      LEU   9   3.949   9.403   9.403
   69   2HD2  LEU   9           HMD      LEU   9   2.293   8.953   8.953
   70   3HD2  LEU   9           HMD      LEU   9   3.677   8.438   8.438
   71    H    SER  10           HN       SER  10   4.785  11.471  11.471
   72    HA   SER  10           HA       SER  10   4.481  13.630  13.630
   73   1HB   SER  10           HBS      SER  10   5.594  12.452  12.452
   74   2HB   SER  10           HBR      SER  10   4.448  11.261  11.261
   75    HG   SER  10           HG       SER  10   7.228  11.366  11.366
   76    H    GLY  11           HN       GLY  11   6.501  14.631  14.631
   77   1HA   GLY  11           HAR      GLY  11   7.730  15.627  15.627
   78   2HA   GLY  11           HAS      GLY  11   8.409  15.795  15.795
   79    H    GLY  12           HN       GLY  12   9.006  13.106  13.106
   80   1HA   GLY  12           HAR      GLY  12  11.425  12.684  12.684
   81   2HA   GLY  12           HAS      GLY  12  10.778  11.637  11.637
   82    H    GLU  13           HN       GLU  13   8.267  11.032  11.032
   83    HA   GLU  13           HA       GLU  13   8.707   8.898   8.898
   84   1HB   GLU  13           HBR      GLU  13   6.336  10.601  10.601
   85   2HB   GLU  13           HBS      GLU  13   6.214   9.405   9.405
   86   1HG   GLU  13           HGS      GLU  13   6.483   7.674   7.674
   87   2HG   GLU  13           HGR      GLU  13   7.096   8.655   8.655
   88    H    LEU  14           HN       LEU  14   8.202  12.307  12.307
   89    HA   LEU  14           HA       LEU  14   7.422  11.878  11.878
   90   1HB   LEU  14           HBS      LEU  14   6.780  13.631  13.631
   91   2HB   LEU  14           HBR      LEU  14   8.079  14.571  14.571
   92    HG   LEU  14           HG       LEU  14   6.884  14.678  14.678
   93   1HD1  LEU  14           HMD      LEU  14   5.614  12.293  12.293
   94   2HD1  LEU  14           HMD      LEU  14   4.380  13.493  13.493
   95   3HD1  LEU  14           HMD      LEU  14   5.602  12.972  12.972
   96   1HD2  LEU  14           HMD      LEU  14   5.616  15.373  15.373
   97   2HD2  LEU  14           HMD      LEU  14   5.915  16.373  16.373
   98   3HD2  LEU  14           HMD      LEU  14   4.484  15.312  15.312
   99    H    ASP  15           HN       ASP  15  10.224  13.416  13.416
  100    HA   ASP  15           HA       ASP  15  11.900  13.544  13.544
  101   1HB   ASP  15           HBS      ASP  15  12.302  14.505  14.505
  102   2HB   ASP  15           HBR      ASP  15  12.891  12.879  12.879
  103    H    LYS  16           HN       LYS  16  10.567  10.860  10.860
  104    HA   LYS  16           HA       LYS  16  12.367   8.997   8.997
  105   1HB   LYS  16           HBS      LYS  16  10.607   8.909   8.909
  106   2HB   LYS  16           HBR      LYS  16  10.190   7.608   7.608
  107   1HG   LYS  16           HGR      LYS  16  12.911   8.139   8.139
  108   2HG   LYS  16           HGS      LYS  16  11.807   6.782   6.782
  109   1HD   LYS  16           HDR      LYS  16  12.726   5.576   5.576
  110   2HD   LYS  16           HDS      LYS  16  12.193   6.696   6.696
  111   1HE   LYS  16           HES      LYS  16  14.686   7.315   7.315
  112   2HE   LYS  16           HER      LYS  16  14.715   6.037   6.037
  113   1HZ   LYS  16           HZA      LYS  16  13.486   7.996   7.996
  114   2HZ   LYS  16           HZB      LYS  16  14.459   8.879   8.879
  115   3HZ   LYS  16           HZC      LYS  16  15.103   7.773   7.773
  116    H    TRP  17           HN       TRP  17   9.192  10.412  10.412
  117    HA   TRP  17           HA       TRP  17   8.272   8.394   8.394
  118   1HB   TRP  17           HBS      TRP  17   6.614   9.353   9.353
  119   2HB   TRP  17           HBR      TRP  17   7.026  11.003  11.003
  120    HD1  TRP  17           HD1      TRP  17   6.443  11.496  11.496
  121    HE1  TRP  17           HE1      TRP  17   4.933  10.315  10.315
  122    HE3  TRP  17           HE3      TRP  17   5.235   7.401   7.401
  123    HZ2  TRP  17           HZ2      TRP  17   3.366   7.990   7.990
  124    HZ3  TRP  17           HZ3      TRP  17   3.570   5.835   5.835
  125    HH2  TRP  17           HH2      TRP  17   2.693   6.083   6.083
  126    H    GLU  18           HN       GLU  18  10.075  11.323  11.323
  127    HA   GLU  18           HA       GLU  18   9.194  12.675  12.675
  128   1HB   GLU  18           HBR      GLU  18  11.955  12.303  12.303
  129   2HB   GLU  18           HBS      GLU  18  11.727  13.264  13.264
  130   1HG   GLU  18           HGR      GLU  18  10.670  13.861  13.861
  131   2HG