*HEADER    VIRUS/VIRAL PROTEIN                     12-JUL-06   2HN8              
*TITLE     STRUCTURAL CHARACTERIZATION AND OLIGOMERIZATION OF PB1-F2,            
*TITLE    2 A PRO-APOPTOTIC INFLUENZA A VIRUS PROTEIN                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN PB1-F2;                                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: C-TERMINAL DOMAIN, AMINO ACID RESIDUES 50-87;              
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE OF THE PEPTIDE IS NATURALLY EXPRESSED/FOUND IN              
*SOURCE   5 CELLS INFECTED WITH HOMO SAPIENS (HUMAN) INFLUENZA A VIRUS           
*SOURCE   6 STRAIN A/PUERTO RICO/8/34 (H1N1).                                    
*KEYWDS    PRO-APOPTOTIC MITOCHONDRIAL TARGETING PROTEIN                         
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    K.BRUNS, N.STUDTRUCKER, A.SHARMA, T.FOSSEN, D.MITZNER,                
*AUTHOR   2 A.EISSMANN, U.TESSMER, R.RODER, P.HENKLEIN, V.WRAY,                  
*AUTHOR   3 U.SCHUBERT                                                           
*REVDAT   1   07-NOV-06 2HN8    0                                                


assign (resid   1 and  name    ha)(resid   1 and  name    hb) 2.7 0.5 0.5
assign (resid   1 and  name    ha)(resid   1 and  name    hb) 2.8 0.5 0.5
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assign (resid   1 and  name    hb)(resid   2 and  name    hn) 2.6 0.5 0.5
assign (resid   1 and  name    hb)(resid   2 and  name    hn) 2.6 0.5 0.5
assign (resid   2 and  name    hn)(resid   2 and  name    ha) 2.9 0.5 0.5
assign (resid   2 and  name    hn)(resid   2 and  name   hb1) 2.7 0.5 0.5
assign (resid   2 and  name    hn)(resid   2 and  name   hb2) 2.6 0.5 0.5
assign (resid   2 and  name    hn)(resid   2 and  name   hg*) 2.8 0.5 0.5
assign (resid   2 and  name    hn)(resid   2 and  name   hg*) 2.9 0.5 0.5
assign (resid   2 and  name    ha)(resid   2 and  name   hb1) 2.5 0.5 0.5
assign (resid   2 and  name    ha)(resid   2 and  name   hb1) 2.6 0.5 0.5
assign (resid   2 and  name    ha)(resid   2 and  name   hb2) 2.6 0.5 0.5
assign (resid   2 and  name    ha)(resid   2 and  name   hb2) 2.9 0.5 0.5
assign (resid   2 and  name    ha)(resid   2 and  name   hg*) 2.8 0.5 0.5
assign (resid   2 and  name    ha)(resid   2 and  name   hg*) 2.9 0.5 0.5
assign (resid   3 and  name    ha)(resid   4 and  name    hn) 2.9 0.5 0.5
assign (resid   3 and  name   hb*)(resid   4 and  name    hn) 2.8 0.5 0.5
assign (resid   3 and  name   hb1)(resid   4 and  name    hn) 3.5 0.5 0.5
assign (resid   3 and  name   hg2)(resid   4 and  name    hn) 2.4 0.5 0.5
assign (resid   3 and  name    ha)(resid   6 and  name    hn) 3.4 0.5 0.5
assign (resid   3 and  name    ha)(resid   7 and  name    hn) 3.8 0.5 0.5
assign (resid   4 and  name    hn)(resid   4 and  name    ha) 2.4 0.5 0.5
assign (resid   4 and  name    hn)(resid   4 and  name   hb*) 2.8 0.5 0.5
assign (resid   4 and  name    hn)(resid   5 and  name    hn) 2.6 0.5 0.5
assign (resid   4 and  name    hn)(resid   5 and  name    hn) 2.7 0.5 0.5
assign (resid   4 and  name    ha)(resid   5 and  name    hn) 3.1 0.5 0.5
assign (resid   4 and  name   hb*)(resid   5 and  name    hn) 2.8 0.5 0.5
assign (resid   4 and  name    hn)(resid   6 and  name    hn) 3.3 0.5 0.5
assign (resid   4 and  name    hn)(resid   6 and  name    hn) 3.4 0.5 0.5
assign (resid   4 and  name    ha)(resid   8 and  name    hn) 3.0 0.5 0.5
assign (resid   5 and  name    hn)(resid   5 and  name    ha) 2.6 0.5 0.5
assign (resid   5 and  name    hn)(resid   5 and  name   hb1) 2.4 0.5 0.5
assign (resid   5 and  name    hn)(resid   5 and  name   hb1) 2.6 0.5 0.5
assign (resid   5 and  name    hn)(resid   5 and  name   hg1) 2.8 0.5 0.5
assign (resid   5 and  name    hn)(resid   5 and  name   hg1) 2.9 0.5 0.5
assign (resid   5 and  name   hb2)(resid   5 and  name  he21) 2.8 0.5 0.5
assign (resid   5 and  name   hb2)(resid   5 and  name  he21) 3.0 0.5 0.5
assign (resid   5 and  name   hb2)(resid   5 and  name  he22) 3.4 0.5 0.5
assign (resid   5 and  name   hb2)(resid   5 and  name  he22) 3.6 0.5 0.5
assign (resid   5 and  name   hg1)(resid   5 and  name  he21) 2.8 0.5 0.5
assign (resid   5 and  name   hg1)(resid   5 and  name  he22) 3.3 0.5 0.5
assign (resid   5 and  name   hg1)(resid   5 and  name  he22) 3.3 0.5 0.5
assign (resid   5 and  name   hg2)(resid   5 and  name  he21) 2.9 0.5 0.5
assign (resid   5 and  name   hg2)(resid   5 and  name  he21) 3.1 0.5 0.5
assign (resid   5 and  name   hg2)(resid   5 and  name  he22) 3.3 0.5 0.5
assign (resid   5 and  name   hg2)(resid   5 and  name  he22) 3.3 0.5 0.5
assign (resid   5 and  name  he21)(resid   5 and  name  he22) 1.9 0.5 0.5
assign (resid   5 and  name  he21)(resid   5 and  name  he22) 1.9 0.5 0.5
assign (resid   5 and  name    hn)(resid   6 and  name    hn) 2.6 0.5 0.5
assign (resid   5 and  name    hn)(resid   6 and  name    hn) 2.6 0.5 0.5
assign (resid   5 and  name    ha)(resid   6 and  name    hn) 2.8 0.5 0.5
assign (resid   5 and  name   hb1)(resid   6 and  name    hn) 2.8 0.5 0.5
assign (resid   5 and  name   hb1)(resid   6 and  name    hn) 3.0 0.5 0.5
assign (resid   5 and  name   hg1)(resid   6 and  name    hn) 3.3 0.5 0.5
assign (resid   5 and  name   hg1)(resid   6 and  name    hn) 3.3 0.5 0.5
assign (resid   5 and  name    hn)(resid   7 and  name    hn) 3.2 0.5 0.5
assign (resid   5 and  name    hn)(resid   7 and  name    hn) 3.3 0.5 0.5
assign (resid   5 and  name    ha)(resid   8 and  name    hn) 2.8 0.5 0.5
assign (resid   5 and  name    ha)(resid   8 and  name   hb*) 2.5 0.5 0.5
assign (resid   5 and  name    ha)(resid   8 and  name   hb*) 2.5 0.5 0.5
assign (resid   5 and  name    ha)(resid   9 and  name    hn) 4.1 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name    ha) 2.5 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name    hb) 3.0 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name    hb) 2.9 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name  hg11) 2.6 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name  hg11) 2.5 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name  hg12) 2.9 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name  hg12) 2.9 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name  hg2*) 3.0 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name  hg2*) 3.0 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name   hd*) 3.0 0.5 0.5
assign (resid   6 and  name    hn)(resid   6 and  name   hd*) 3.1 0.5 0.5
assign (resid   6 and  name    hn)(resid   7 and  name    hn) 2.6 0.5 0.5
assign (resid   6 and  name    hn)(resid   7 and  name    hn) 2.6 0.5 0.5
assign (resid   6 and  name    ha)(resid   7 and  name    hn) 3.0 0.5 0.5
assign (resid   6 and  name  hg11)(resid   7 and  name    hn) 3.1 0.5 0.5
assign (resid   6 and  name  hg11)(resid   7 and  name    hn) 3.3 0.5 0.5
assign (resid   6 and  name  hg12)(resid   7 and  name    hn) 3.7 0.5 0.5
assign (resid   6 and  name  hg12)(resid   7 and  name    hn) 3.8 0.5 0.5
assign (resid   6 and  name    hn)(resid   8 and  name    hn) 3.5 0.5 0.5
assign (resid   6 and  name    hn)(resid   8 and  name    hn) 3.6 0.5 0.5
assign (resid   6 and  name    hn)(resid   9 and  name    hn) 3.7 0.5 0.5
assign (resid   6 and  name    hn)(resid   9 and  name    hn) 3.9 0.5 0.5
assign (resid   6 and  name    ha)(resid   9 and  name    hn) 3.1 0.5 0.5
assign (resid   6 and  name    ha)(resid   9 and  name   hb*) 2.6 0.5 0.5
assign (resid   6 and  name    ha)(resid   9 and  name   hb*) 2.7 0.5 0.5
assign (resid   6 and  name    ha)(resid  10 and  name    hn) 4.1 0.5 0.5
assign (resid   6 and  name  hg2*)(resid  10 and  name    hn) 5.0 0.5 0.5
assign (resid   6 and  name  hg2*)(resid  10 and  name    hn) 5.2 0.5 0.5
assign (resid   6 and  name   hd*)(resid  10 and  name    hn) 4.8 0.5 0.5
assign (resid   7 and  name    hn)(resid   7 and  name    ha) 2.6 0.5 0.5
assign (resid   7 and  name    hn)(resid   7 and  name    hb) 2.5 0.5 0.5
assign (resid   7 and  name    hn)(resid   7 and  name    hb) 2.5 0.5 0.5
assign (resid   7 and  name    hn)(resid   7 and  name  hg1*) 2.6 0.5 0.5
assign (resid   7 and  name    hn)(resid   7 and  name  hg1*) 2.5 0.5 0.5
assign (resid   7 and  name    hn)(resid   7 and  name  hg2*) 3.7 0.5 0.5
assign (resid   7 and  name    hn)(resid   8 and  name    hn) 2.7 0.5 0.5
assign (resid   7 and  name    hn)(resid   8 and  name    hn) 2.7 0.5 0.5
assign (resid   7 and  name    ha)(resid   8 and  name    hn) 3.1 0.5 0.5
assign (resid   7 and  name    hb)(resid   8 and  name    hn) 3.4 0.5 0.5
assign (resid   7 and  name  hg1*)(resid   8 and  name    hn) 2.8 0.5 0.5
assign (resid   7 and  name  hg1*)(resid   8 and  name    hn) 2.8 0.5 0.5
assign (resid   7 and  name  hg2*)(resid   8 and  name    hn) 4.2 0.5 0.5
assign (resid   7 and  name  hg2*)(resid   8 and  name    hn) 4.2 0.5 0.5
assign (resid   7 and  name    hn)(resid   9 and  name    hn) 3.1 0.5 0.5
assign (resid   7 and  name    hn)(resid   9 and  name    hn) 3.1 0.5 0.5
assign (resid   7 and  name    ha)(resid  10 and  name    hn) 3.5 0.5 0.5
assign (resid   7 and  name    ha)(resid  10 and  name   hb1) 2.2 0.5 0.5
assign (resid   7 and  name    ha)(resid  10 and  name   hb2) 2.8 0.5 0.5
assign (resid   7 and  name  hg1*)(resid  11 and  name    hn) 5.0 0.5 0.5
assign (resid   7 and  name  hg1*)(resid  11 and  name    hn) 5.0 0.5 0.5
assign (resid   7 and  name  hg2*)(resid  11 and  name    hn) 5.1 0.5 0.5
assign (resid   7 and  name  hg2*)(resid  11 and  name    hn) 5.1 0.5 0.5
assign (resid   8 and  name    hn)(resid   8 and  name    ha) 2.6 0.5 0.5
assign (resid   8 and  name    ha)(resid   8 and  name   hd*) 2.6 0.5 0.5
assign (resid   8 and  name    ha)(resid   8 and  name   hd*) 2.8 0.5 0.5
assign (resid   8 and  name    ha)(resid   8 and  name   he*) 3.8 0.5 0.5
assign (resid   8 and  name    ha)(resid   8 and  name   he*) 3.7 0.5 0.5
assign (resid   8 and  name   hb*)(resid   8 and  name   hd*) 2.2 0.5 0.5
assign (resid   8 and  name   hb*)(resid   8 and  name   hd*) 2.4 0.5 0.5
assign (resid   8 and  name   hb*)(resid   8 and  name   he*) 4.3 0.5 0.5
assign (resid   8 and  name   hb*)(resid   8 and  name   he*) 4.4 0.5 0.5
assign (resid   8 and  name   hd*)(resid   8 and  name   he*) 2.0 0.5 0.5
assign (resid   8 and  name   hd*)(resid   8 and  name   he*) 2.0 0.5 0.5
assign (resid   8 and  name    hn)(resid   9 and  name    hn) 2.7 0.5 0.5
assign (resid   8 and  name    ha)(resid   9 and  name    hn) 3.0 0.5 0.5
assign (resid   8 and  name   hb*)(resid   9 and  name    hn) 3.0 0.5 0.5
assign (resid   8 and  name    hn)(resid  10 and  name    hn) 3.6 0.5 0.5
assign (resid   8 and  name    hn)(resid  10 and  name    hn) 3.6 0.5 0.5
assign (resid   8 and  name   hb*)(resid  10 and  name    hn) 4.6 0.5 0.5
assign (resid   8 and  name   hb*)(resid  10 and  name    hn) 4.6 0.5 0.5
assign (resid   8 and  name    hn)(resid  11 and  name    hn) 3.6 0.5 0.5
assign (resid   8 and  name    hn)(resid  11 and  name    hn) 3.6 0.5 0.5
assign (resid   8 and  name    ha)(resid  11 and  name    hn) 4.2 0.5 0.5
assign (resid   8 and  name    ha)(resid  12 and  name    hn) 4.2 0.5 0.5
assign (resid   9 and  name    hn)(resid   9 and  name    ha) 3.1 0.5 0.5
assign (resid   9 and  name    hn)(resid   9 and  name   hb*) 2.3 0.5 0.5
assign (resid   9 and  name    hn)(resid   9 and  name   hb*) 2.3 0.5 0.5
assign (resid   9 and  name    hn)(resid   9 and  name   hd1) 3.1 0.5 0.5
assign (resid   9 and  name    hn)(resid   9 and  name   hd1) 3.3 0.5 0.5
assign (resid   9 and  name    hn)(resid   9 and  name   he3) 4.4 0.5 0.5
assign (resid   9 and  name    ha)(resid   9 and  name   hd1) 3.7 0.5 0.5
assign (resid   9 and  name    ha)(resid   9 and  name   hd1) 3.8 0.5 0.5
assign (resid   9 and  name    ha)(resid   9 and  name   he3) 2.7 0.5 0.5
assign (resid   9 and  name    ha)(resid   9 and  name   he3) 2.8 0.5 0.5
assign (resid   9 and  name   hb*)(resid   9 and  name   he3) 2.6 0.5 0.5
assign (resid   9 and  name   hb*)(resid   9 and  name   he3) 2.6 0.5 0.5
assign (resid   9 and  name   hb*)(resid   9 and  name   hd1) 2.5 0.5 0.5
assign (resid   9 and  name   hb*)(resid   9 and  name   hd1) 2.7 0.5 0.5
assign (resid   9 and  name   hb*)(resid   9 and  name   he1) 4.3 0.5 0.5
assign (resid   9 and  name   hb*)(resid   9 and  name   he1) 4.4 0.5 0.5
assign (resid   9 and  name   hb*)(resid   9 and  name   hz3) 4.7 0.5 0.5
assign (resid   9 and  name   hd1)(resid   9 and  name   he1) 2.3 0.5 0.5
assign (resid   9 and  name   hd1)(resid   9 and  name   he1) 2.4 0.5 0.5
assign (resid   9 and  name   he1)(resid   9 and  name   he3) 4.6 0.5 0.5
assign (resid   9 and  name   he1)(resid   9 and  name   hz2) 2.4 0.5 0.5
assign (resid   9 and  name   he1)(resid   9 and  name   hz2) 2.7 0.5 0.5
assign (resid   9 and  name   he1)(resid   9 and  name   hh2) 4.2 0.5 0.5
assign (resid   9 and  name   he1)(resid   9 and  name   hh2) 4.3 0.5 0.5
assign (resid   9 and  name   he3)(resid   9 and  name   hz3) 2.4 0.5 0.5
assign (resid   9 and  name   he3)(resid   9 and  name   hz3) 2.4 0.5 0.5
assign (resid   9 and  name   hz2)(resid   9 and  name   hz3) 3.7 0.5 0.5
assign (resid   9 and  name   hz2)(resid   9 and  name   hz3) 3.8 0.5 0.5
assign (resid   9 and  name   hz3)(resid   9 and  name   hh2) 2.3 0.5 0.5
assign (resid   9 and  name   hz3)(resid   9 and  name   hh2) 2.3 0.5 0.5
assign (resid   9 and  name    hn)(resid  10 and  name    hn) 2.7 0.5 0.5
assign (resid   9 and  name    hn)(resid  10 and  name    hn) 2.8 0.5 0.5
assign (resid   9 and  name    ha)(resid  10 and  name    hn) 3.7 0.5 0.5
assign (resid   9 and  name   hb*)(resid  10 and  name    hn) 2.7 0.5 0.5
assign (resid   9 and  name   hd1)(resid  10 and  name    hn) 4.1 0.5 0.5
assign (resid   9 and  name   hd1)(resid  10 and  name    hn) 4.1 0.5 0.5
assign (resid   9 and  name   he3)(resid  10 and  name    hn) 3.8 0.5 0.5
assign (resid   9 and  name   he3)(resid  10 and  name    hn) 3.8 0.5 0.5
assign (resid   9 and  name    hn)(resid  11 and  name    hn) 3.5 0.5 0.5
assign (resid   9 and  name    hn)(resid  11 and  name    hn) 3.6 0.5 0.5
assign (resid   9 and  name    ha)(resid  12 and  name    hn) 3.4 0.5 0.5
assign (resid   9 and  name    ha)(resid  12 and  name   hb1) 2.3 0.5 0.5
assign (resid   9 and  name    ha)(resid  12 and  name   hb1) 2.5 0.5 0.5
assign (resid   9 and  name    ha)(resid  12 and  name   hb2) 2.8 0.5 0.5
assign (resid   9 and  name    ha)(resid  12 and  name   hb2) 3.1 0.5 0.5
assign (resid   9 and  name   he3)(resid  12 and  name    hn) 4.5 0.5 0.5
assign (resid   9 and  name    ha)(resid  13 and  name    hn) 3.8 0.5 0.5
assign (resid  10 and  name    hn)(resid  10 and  name    ha) 2.5 0.5 0.5
assign (resid  10 and  name    hn)(resid  10 and  name   hb1) 2.4 0.5 0.5
assign (resid  10 and  name    hn)(resid  10 and  name   hb1) 2.5 0.5 0.5
assign (resid  10 and  name    hn)(resid  10 and  name   hb2) 2.6 0.5 0.5
assign (resid  10 and  name    hn)(resid  10 and  name   hb2) 2.7 0.5 0.5
assign (resid  10 and  name    hn)(resid  10 and  name   hg*) 3.8 0.5 0.5
assign (resid  10 and  name    hn)(resid  10 and  name   hd*) 4.2 0.5 0.5
assign (resid  10 and  name    hn)(resid  11 and  name    hn) 2.5 0.5 0.5
assign (resid  10 and  name    hn)(resid  11 and  name    hn) 2.7 0.5 0.5
assign (resid  10 and  name    ha)(resid  11 and  name    hn) 3.0 0.5 0.5
assign (resid  10 and  name   hb1)(resid  11 and  name    hn) 2.2 0.5 0.5
assign (resid  10 and  name   hb1)(resid  11 and  name    hn) 2.4 0.5 0.5
assign (resid  10 and  name   hb2)(resid  11 and  name    hn) 3.6 0.5 0.5
assign (resid  10 and  name   hg*)(resid  11 and  name    hn) 3.3 0.5 0.5
assign (resid  10 and  name   hd*)(resid  11 and  name    hn) 3.1 0.5 0.5
assign (resid  10 and  name    ha)(resid  13 and  name    hn) 2.9 0.5 0.5
assign (resid  10 and  name    ha)(resid  14 and  name    hn) 3.2 0.5 0.5
assign (resid  11 and  name    hn)(resid  11 and  name    ha) 2.6 0.5 0.5
assign (resid  11 and  name    hn)(resid  11 and  name   hb1) 3.0 0.5 0.5
assign (resid  11 and  name    hn)(resid  11 and  name   hb2) 3.0 0.5 0.5
assign (resid  11 and  name    hn)(resid  11 and  name   hg1) 2.9 0.5 0.5
assign (resid  11 and  name    hn)(resid  11 and  name   hg1) 2.9 0.5 0.5
assign (resid  11 and  name    hn)(resid  11 and  name   hg2) 2.3 0.5 0.5
assign (resid  11 and  name    hn)(resid  11 and  name   hg2) 2.4 0.5 0.5
assign (resid  11 and  name   hg1)(resid  11 and  name  he21) 3.4 0.5 0.5
assign (resid  11 and  name   hg1)(resid  11 and  name  he21) 3.8 0.5 0.5
assign (resid  11 and  name   hg1)(resid  11 and  name  he22) 3.6 0.5 0.5
assign (resid  11 and  name   hg1)(resid  11 and  name  he22) 3.8 0.5 0.5
assign (resid  11 and  name   hg2)(resid  11 and  name  he21) 3.5 0.5 0.5
assign (resid  11 and  name   hg2)(resid  11 and  name  he21) 4.0 0.5 0.5
assign (resid  11 and  name   hg2)(resid  11 and  name  he22) 3.6 0.5 0.5
assign (resid  11 and  name  he21)(resid  11 and  name  he22) 1.9 0.5 0.5
assign (resid  11 and  name  he21)(resid  11 and  name  he22) 1.9 0.5 0.5
assign (resid  11 and  name    hn)(resid  12 and  name    hn) 2.6 0.5 0.5
assign (resid  11 and  name    hn)(resid  12 and  name    hn) 2.6 0.5 0.5
assign (resid  11 and  name    ha)(resid  12 and  name    hn) 2.6 0.5 0.5
assign (resid  11 and  name   hg1)(resid  12 and  name    hn) 3.8 0.5 0.5
assign (resid  11 and  name   hg2)(resid  12 and  name    hn) 3.6 0.5 0.5
assign (resid  11 and  name    hn)(resid  13 and  name    hn) 3.8 0.5 0.5
assign (resid  11 and  name    hn)(resid  13 and  name    hn) 3.8 0.5 0.5
assign (resid  11 and  name    hn)(resid  14 and  name    hn) 4.3 0.5 0.5
assign (resid  11 and  name    ha)(resid  14 and  name   hb2) 2.7 0.5 0.5
assign (resid  11 and  name    ha)(resid  15 and  name    hn) 2.9 0.5 0.5
assign (resid  12 and  name    hn)(resid  12 and  name    ha) 2.5 0.5 0.5
assign (resid  12 and  name    hn)(resid  12 and  name   hb1) 2.5 0.5 0.5
assign (resid  12 and  name    hn)(resid  12 and  name   hb1) 2.5 0.5 0.5
assign (resid  12 and  name    hn)(resid  12 and  name   hb2) 2.5 0.5 0.5
assign (resid  12 and  name    hn)(resid  12 and  name   hb2) 2.5 0.5 0.5
assign (resid  12 and  name    hn)(resid  12 and  name   he3) 3.7 0.5 0.5
assign (resid  12 and  name    hn)(resid  12 and  name   he3) 3.8 0.5 0.5
assign (resid  12 and  name    ha)(resid  12 and  name   hd1) 3.0 0.5 0.5
assign (resid  12 and  name    ha)(resid  12 and  name   hd1) 3.1 0.5 0.5
assign (resid  12 and  name    ha)(resid  12 and  name   he1) 4.3 0.5 0.5
assign (resid  12 and  name    ha)(resid  12 and  name   he3) 3.2 0.5 0.5
assign (resid  12 and  name   hb1)(resid  12 and  name   hd1) 3.0 0.5 0.5
assign (resid  12 and  name   hb1)(resid  12 and  name   hd1) 3.0 0.5 0.5
assign (resid  12 and  name   hb1)(resid  12 and  name   he3) 2.7 0.5 0.5
assign (resid  12 and  name   hb1)(resid  12 and  name   he3) 2.9 0.5 0.5
assign (resid  12 and  name   hb2)(resid  12 and  name   hd1) 2.8 0.5 0.5
assign (resid  12 and  name   hb2)(resid  12 and  name   hd1) 3.0 0.5 0.5
assign (resid  12 and  name   hb2)(resid  12 and  name   he1) 4.1 0.5 0.5
assign (resid  12 and  name   hb2)(resid  12 and  name   he3) 3.3 0.5 0.5
assign (resid  12 and  name   hb2)(resid  12 and  name   he3) 3.3 0.5 0.5
assign (resid  12 and  name   hd1)(resid  12 and  name   he1) 2.3 0.5 0.5
assign (resid  12 and  name   hd1)(resid  12 and  name   he1) 2.3 0.5 0.5
assign (resid  12 and  name   hd1)(resid  12 and  name   hz2) 4.4 0.5 0.5
assign (resid  12 and  name   he1)(resid  12 and  name   hh2) 4.4 0.5 0.5
assign (resid  12 and  name   he1)(resid  12 and  name   hz2) 2.4 0.5 0.5
assign (resid  12 and  name   hz2)(resid  12 and  name   hz3) 3.8 0.5 0.5
assign (resid  12 and  name   hz2)(resid  12 and  name   hz3) 4.0 0.5 0.5
assign (resid  12 and  name   hz2)(resid  12 and  name   hh2) 2.2 0.5 0.5
assign (resid  12 and  name   hz2)(resid  12 and  name   hh2) 2.8 0.5 0.5
assign (resid  12 and  name   hz3)(resid  12 and  name   hh2) 3.1 0.5 0.5
assign (resid  12 and  name   hz3)(resid  12 and  name   hh2) 3.0 0.5 0.5
assign (resid  12 and  name    hn)(resid  13 and  name    hn) 2.7 0.5 0.5
assign (resid  12 and  name    hn)(resid  13 and  name    hn) 2.7 0.5 0.5
assign (resid  12 and  name    ha)(resid  13 and  name    hn) 3.2 0.5 0.5
assign (resid  12 and  name   hb1)(resid  13 and  name    hn) 2.7 0.5 0.5
assign (resid  12 and  name   hb2)(resid  13 and  name    hn) 3.2 0.5 0.5
assign (resid  12 and  name   he3)(resid  13 and  name    hn) 3.4 0.5 0.5
assign (resid  12 and  name   he3)(resid  13 and  name    hn) 3.5 0.5 0.5
assign (resid  12 and  name    hn)(resid  14 and  name    hn) 2.8 0.5 0.5
assign (resid  12 and  name    hn)(resid  14 and  name    hn) 3.1 0.5 0.5
assign (resid  12 and  name    ha)(resid  15 and  name    hn) 3.5 0.5 0.5
assign (resid  12 and  name    ha)(resid  15 and  name   hb2) 3.2 0.5 0.5
assign (resid  12 and  name    ha)(resid  16 and  name    hn) 2.9 0.5 0.5
assign (resid  13 and  name    hn)(resid  13 and  name    ha) 2.7 0.5 0.5
assign (resid  13 and  name    hn)(resid  13 and  name   hb*) 2.3 0.5 0.5
assign (resid  13 and  name    hn)(resid  13 and  name   hb*) 2.7 0.5 0.5
assign (resid  13 and  name    hn)(resid  14 and  name    hn) 2.7 0.5 0.5
assign (resid  13 and  name    hn)(resid  14 and  name    hn) 2.7 0.5 0.5
assign (resid  13 and  name    hn)(resid  14 and  name    ha) 4.2 0.5 0.5
assign (resid  13 and  name    hn)(resid  14 and  name    ha) 4.2 0.5 0.5
assign (resid  13 and  name    ha)(resid  14 and  name    hn) 2.8 0.5 0.5
assign (resid  13 and  name    hg)(resid  14 and  name    hn) 4.1 0.5 0.5
assign (resid  13 and  name    hn)(resid  15 and  name    hn) 3.6 0.5 0.5
assign (resid  13 and  name    hn)(resid  15 and  name    hn) 3.6 0.5 0.5
assign (resid  13 and  name    ha)(resid  16 and  name    hn) 3.5 0.5 0.5
assign (resid  13 and  name    ha)(resid  16 and  name   hb1) 3.5 0.5 0.5
assign (resid  13 and  name    ha)(resid  16 and  name   hb2) 3.4 0.5 0.5
assign (resid  13 and  name    ha)(resid  17 and  name    hn) 2.9 0.5 0.5
assign (resid  14 and  name    hn)(resid  14 and  name    ha) 2.5 0.5 0.5
assign (resid  14 and  name    hn)(resid  14 and  name   hb1) 2.5 0.5 0.5
assign (resid  14 and  name    hn)(resid  14 and  name   hb2) 2.7 0.5 0.5
assign (resid  14 and  name    hn)(resid  15 and  name    hn) 2.6 0.5 0.5
assign (resid  14 and  name    hn)(resid  15 and  name    hn) 2.6 0.5 0.5
assign (resid  14 and  name    ha)(resid  15 and  name    hn) 2.9 0.5 0.5
assign (resid  14 and  name   hb2)(resid  15 and  name    hn) 2.8 0.5 0.5
assign (resid  14 and  name    hn)(resid  16 and  name    hn) 3.5 0.5 0.5
assign (resid  14 and  name    hn)(resid  16 and  name    hn) 3.5 0.5 0.5
assign (resid  14 and  name    ha)(resid  17 and  name    hn) 4.0 0.5 0.5
assign (resid  14 and  name    ha)(resid  17 and  name   hb1) 3.5 0.5 0.5
assign (resid  14 and  name    ha)(resid  17 and  name   hb2) 3.4 0.5 0.5
assign (resid  14 and  name    ha)(resid  17 and  name   hb2) 3.5 0.5 0.5
assign (resid  15 and  name    hn)(resid  15 and  name    ha) 2.3 0.5 0.5
assign (resid  15 and  name    hn)(resid  15 and  name   hb1) 2.9 0.5 0.5
assign (resid  15 and  name    hn)(resid  15 and  name   hb1) 3.0 0.5 0.5
assign (resid  15 and  name    hn)(resid  15 and  name   hb2) 2.5 0.5 0.5
assign (resid  15 and  name    hn)(resid  15 and  name    hg) 3.3 0.5 0.5
assign (resid  15 and  name    hn)(resid  15 and  name    hg) 3.3 0.5 0.5
assign (resid  15 and  name    hn)(resid  15 and  name  hd1*) 2.6 0.5 0.5
assign (resid  15 and  name    hn)(resid  15 and  name  hd2*) 2.4 0.5 0.5
assign (resid  15 and  name    hn)(resid  16 and  name    hn) 2.8 0.5 0.5
assign (resid  15 and  name    hn)(resid  16 and  name    hn) 2.8 0.5 0.5
assign (resid  15 and  name    ha)(resid  16 and  name    hn) 2.9 0.5 0.5
assign (resid  15 and  name   hb2)(resid  16 and  name    hn) 2.7 0.5 0.5
assign (resid  15 and  name  hd2*)(resid  16 and  name    hn) 3.0 0.5 0.5
assign (resid  15 and  name  hd2*)(resid  16 and  name    hn) 3.1 0.5 0.5
assign (resid  15 and  name    ha)(resid  19 and  name    hn) 3.7 0.5 0.5
assign (resid  16 and  name    hn)(resid  16 and  name    ha) 2.3 0.5 0.5
assign (resid  16 and  name    hn)(resid  16 and  name    ha) 2.2 0.5 0.5
assign (resid  16 and  name    hn)(resid  16 and  name   hb2) 2.4 0.5 0.5
assign (resid  16 and  name    hn)(resid  16 and  name   hb2) 2.6 0.5 0.5
assign (resid  16 and  name    hn)(resid  16 and  name   hg*) 2.6 0.5 0.5
assign (resid  16 and  name    hn)(resid  16 and  name   hg*) 2.6 0.5 0.5
assign (resid  16 and  name    hn)(resid  16 and  name   hd1) 3.1 0.5 0.5
assign (resid  16 and  name    hn)(resid  16 and  name   hd1) 3.6 0.5 0.5
assign (resid  16 and  name    hn)(resid  17 and  name    hn) 2.4 0.5 0.5
assign (resid  16 and  name    hn)(resid  17 and  name    hn) 2.7 0.5 0.5
assign (resid  16 and  name    ha)(resid  17 and  name    hn) 2.8 0.5 0.5
assign (resid  16 and  name   hb1)(resid  17 and  name    hn) 3.1 0.5 0.5
assign (resid  16 and  name   hb2)(resid  17 and  name    hn) 2.8 0.5 0.5
assign (resid  16 and  name   hg*)(resid  17 and  name    hn) 4.4 0.5 0.5
assign (resid  16 and  name    ha)(resid  19 and  name    hn) 3.3 0.5 0.5
assign (resid  16 and  name    ha)(resid  19 and  name    hb) 2.8 0.5 0.5
assign (resid  16 and  name    ha)(resid  20 and  name    hn) 3.6 0.5 0.5
assign (resid  17 and  name    hn)(resid  17 and  name    ha) 3.0 0.5 0.5
assign (resid  17 and  name    hn)(resid  17 and  name   hb1) 2.6 0.5 0.5
assign (resid  17 and  name    hn)(resid  17 and  name   hb1) 2.7 0.5 0.5
assign (resid  17 and  name    hn)(resid  17 and  name   hb2) 2.5 0.5 0.5
assign (resid  17 and  name    hn)(resid  17 and  name   hb2) 2.6 0.5 0.5
assign (resid  17 and  name   hb1)(resid  17 and  name  hd21) 2.5 0.5 0.5
assign (resid  17 and  name   hb1)(resid  17 and  name  hd21) 2.6 0.5 0.5
assign (resid  17 and  name   hb1)(resid  17 and  name  hd22) 3.0 0.5 0.5
assign (resid  17 and  name   hb1)(resid  17 and  name  hd22) 3.1 0.5 0.5
assign (resid  17 and  name   hb2)(resid  17 and  name  hd21) 2.5 0.5 0.5
assign (resid  17 and  name   hb2)(resid  17 and  name  hd21) 2.6 0.5 0.5
assign (resid  17 and  name   hb2)(resid  17 and  name  hd22) 3.0 0.5 0.5
assign (resid  17 and  name   hb2)(resid  17 and  name  hd22) 3.2 0.5 0.5
assign (resid  17 and  name  hd21)(resid  17 and  name  hd22) 2.0 0.5 0.5
assign (resid  17 and  name  hd21)(resid  17 and  name  hd22) 2.0 0.5 0.5
assign (resid  17 and  name    hn)(resid  19 and  name    hn) 3.5 0.5 0.5
assign (resid  17 and  name    hn)(resid  19 and  name    hn) 3.7 0.5 0.5
assign (resid  17 and  name    ha)(resid  19 and  name    hn) 3.5 0.5 0.5
assign (resid  17 and  name    ha)(resid  19 and  name    hn) 3.7 0.5 0.5
assign (resid  17 and  name   hb1)(resid  19 and  name    hn) 3.8 0.5 0.5
assign (resid  17 and  name   hb2)(resid  19 and  name    hn) 3.8 0.5 0.5
assign (resid  17 and  name   hb2)(resid  19 and  name    hn) 3.8 0.5 0.5
assign (resid  17 and  name    ha)(resid  20 and  name    hn) 3.6 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hb1) 2.2 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hb1) 2.3 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hb2) 2.3 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hb2) 2.3 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hg*) 3.2 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hg*) 3.3 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hd1) 2.6 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hd1) 2.6 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hd2) 3.3 0.5 0.5
assign (resid  18 and  name    ha)(resid  18 and  name   hd2) 3.4 0.5 0.5
assign (resid  18 and  name    ha)(resid  19 and  name    hn) 2.8 0.5 0.5
assign (resid  18 and  name   hb1)(resid  19 and  name    hn) 3.7 0.5 0.5
assign (resid  18 and  name    ha)(resid  21 and  name    hn) 2.8 0.5 0.5
assign (resid  18 and  name    ha)(resid  21 and  name    hb) 2.9 0.5 0.5
assign (resid  18 and  name    ha)(resid  22 and  name    hn) 3.7 0.5 0.5
assign (resid  19 and  name    hn)(resid  19 and  name    ha) 2.4 0.5 0.5
assign (resid  19 and  name    hn)(resid  19 and  name    hb) 2.2 0.5 0.5
assign (resid  19 and  name    hn)(resid  19 and  name    hb) 2.2 0.5 0.5
assign (resid  19 and  name    hn)(resid  19 and  name  hg11) 2.1 0.5 0.5
assign (resid  19 and  name    hn)(resid  19 and  name  hg11) 2.3 0.5 0.5
assign (resid  19 and  name    hn)(resid  19 and  name  hg12) 2.8 0.5 0.5
assign (resid  19 and  name    hn)(resid  19 and  name  hg12) 2.9 0.5 0.5
assign (resid  19 and  name    hn)(resid  20 and  name    hn) 1.9 0.5 0.5
assign (resid  19 and  name    hn)(resid  20 and  name    hn) 2.3 0.5 0.5
assign (resid  19 and  name    hn)(resid  20 and  name    hn) 2.3 0.5 0.5
assign (resid  19 and  name    ha)(resid  20 and  name    hn) 2.8 0.5 0.5
assign (resid  19 and  name    hb)(resid  20 and  name    hn) 2.4 0.5 0.5
assign (resid  19 and  name    ha)(resid  22 and  name   hb1) 2.5 0.5 0.5
assign (resid  19 and  name    ha)(resid  22 and  name   hb1) 2.6 0.5 0.5
assign (resid  19 and  name    ha)(resid  22 and  name   hb2) 2.8 0.5 0.5
assign (resid  19 and  name    ha)(resid  22 and  name   hb2) 2.9 0.5 0.5
assign (resid  19 and  name    ha)(resid  23 and  name    hn) 3.7 0.5 0.5
assign (resid  20 and  name    hn)(resid  20 and  name    ha) 2.6 0.5 0.5
assign (resid  20 and  name    hn)(resid  20 and  name   hb*) 2.4 0.5 0.5
assign (resid  20 and  name    hn)(resid  20 and  name   hb*) 2.4 0.5 0.5
assign (resid  20 and  name    hn)(resid  20 and  name    hg) 2.2 0.5 0.5
assign (resid  20 and  name    hn)(resid  20 and  name    hg) 2.2 0.5 0.5
assign (resid  20 and  name    hn)(resid  20 and  name  hd2*) 2.2 0.5 0.5
assign (resid  20 and  name    hn)(resid  20 and  name  hd2*) 2.6 0.5 0.5
assign (resid  20 and  name    hn)(resid  21 and  name    hn) 2.6 0.5 0.5
assign (resid  20 and  name    hn)(resid  21 and  name    hn) 2.8 0.5 0.5
assign (resid  20 and  name    hn)(resid  21 and  name    hb) 3.4 0.5 0.5
assign (resid  20 and  name    hn)(resid  21 and  name    hb) 3.6 0.5 0.5
assign (resid  20 and  name    ha)(resid  21 and  name    hn) 2.9 0.5 0.5
assign (resid  20 and  name   hb*)(resid  21 and  name    hn) 3.2 0.5 0.5
assign (resid  20 and  name    hn)(resid  22 and  name    hn) 3.2 0.5 0.5
assign (resid  20 and  name    hn)(resid  22 and  name    hn) 3.3 0.5 0.5
assign (resid  20 and  name    hn)(resid  23 and  name    hn) 3.8 0.5 0.5
assign (resid  20 and  name    hn)(resid  23 and  name    hn) 3.8 0.5 0.5
assign (resid  20 and  name    ha)(resid  23 and  name    hn) 2.9 0.5 0.5
assign (resid  20 and  name    ha)(resid  23 and  name   hb*) 2.6 0.5 0.5
assign (resid  20 and  name    ha)(resid  23 and  name   hb*) 2.5 0.5 0.5
assign (resid  20 and  name    ha)(resid  24 and  name    hn) 3.9 0.5 0.5
assign (resid  21 and  name    hn)(resid  21 and  name    ha) 2.7 0.5 0.5
assign (resid  21 and  name    hn)(resid  21 and  name    hb) 2.4 0.5 0.5
assign (resid  21 and  name    hn)(resid  21 and  name    hb) 2.4 0.5 0.5
assign (resid  21 and  name    hn)(resid  21 and  name  hg1*) 3.6 0.5 0.5
assign (resid  21 and  name    hn)(resid  21 and  name  hg1*) 3.7 0.5 0.5
assign (resid  21 and  name    hn)(resid  21 and  name  hg2*) 2.2 0.5 0.5
assign (resid  21 and  name    hn)(resid  21 and  name  hg2*) 2.4 0.5 0.5
assign (resid  21 and  name    hn)(resid  22 and  name    hn) 2.3 0.5 0.5
assign (resid  21 and  name    hn)(resid  22 and  name    hn) 2.5 0.5 0.5
assign (resid  21 and  name    ha)(resid  22 and  name    hn) 2.9 0.5 0.5
assign (resid  21 and  name    hb)(resid  22 and  name    hn) 2.5 0.5 0.5
assign (resid  21 and  name    hn)(resid  23 and  name    hn) 3.1 0.5 0.5
assign (resid  21 and  name    hn)(resid  23 and  name    hn) 3.2 0.5 0.5
assign (resid  21 and  name    ha)(resid  23 and  name    hn) 3.4 0.5 0.5
assign (resid  21 and  name    ha)(resid  23 and  name    hn) 3.8 0.5 0.5
assign (resid  21 and  name    hb)(resid  23 and  name    hn) 3.8 0.5 0.5
assign (resid  21 and  name    hb)(resid  23 and  name    hn) 3.8 0.5 0.5
assign (resid  21 and  name  hg1*)(resid  23 and  name    hn) 4.2 0.5 0.5
assign (resid  21 and  name  hg1*)(resid  23 and  name    hn) 4.2 0.5 0.5
assign (resid  21 and  name    ha)(resid  24 and  name    hn) 3.0 0.5 0.5
assign (resid  21 and  name    ha)(resid  24 and  name   hb1) 2.4 0.5 0.5
assign (resid  21 and  name    ha)(resid  24 and  name   hb1) 2.5 0.5 0.5
assign (resid  21 and  name    ha)(resid  24 and  name   hb2) 2.6 0.5 0.5
assign (resid  21 and  name    ha)(resid  24 and  name   hb2) 2.6 0.5 0.5
assign (resid  21 and  name  hg1*)(resid  24 and  name    hn) 4.3 0.5 0.5
assign (resid  21 and  name    ha)(resid  25 and  name    hn) 4.5 0.5 0.5
assign (resid  22 and  name    hn)(resid  22 and  name    ha) 2.5 0.5 0.5
assign (resid  22 and  name    hn)(resid  22 and  name   hb1) 2.3 0.5 0.5
assign (resid  22 and  name    hn)(resid  22 and  name   hb1) 2.4 0.5 0.5
assign (resid  22 and  name    hn)(resid  22 and  name   hb2) 2.4 0.5 0.5
assign (resid  22 and  name    hn)(resid  22 and  name   hb2) 2.4 0.5 0.5
assign (resid  22 and  name    hn)(resid  22 and  name   hd*) 3.4 0.5 0.5
assign (resid  22 and  name    hn)(resid  22 and  name   hd*) 3.4 0.5 0.5
assign (resid  22 and  name    ha)(resid  22 and  name   hd*) 2.5 0.5 0.5
assign (resid  22 and  name    ha)(resid  22 and  name   hd*) 2.6 0.5 0.5
assign (resid  22 and  name    ha)(resid  22 and  name   he*) 4.9 0.5 0.5
assign (resid  22 and  name   hb1)(resid  22 and  name   hd*) 2.3 0.5 0.5
assign (resid  22 and  name   hb1)(resid  22 and  name   hd*) 2.4 0.5 0.5
assign (resid  22 and  name   hb1)(resid  22 and  name   he*) 4.2 0.5 0.5
assign (resid  22 and  name   hb2)(resid  22 and  name   hd*) 2.4 0.5 0.5
assign (resid  22 and  name   hb2)(resid  22 and  name   hd*) 2.4 0.5 0.5
assign (resid  22 and  name   hb2)(resid  22 and  name   he*) 4.3 0.5 0.5
assign (resid  22 and  name    hn)(resid  23 and  name    hn) 2.6 0.5 0.5
assign (resid  22 and  name    hn)(resid  23 and  name    hn) 2.8 0.5 0.5
assign (resid  22 and  name    ha)(resid  23 and  name    hn) 3.0 0.5 0.5
assign (resid  22 and  name   hb1)(resid  23 and  name    hn) 2.7 0.5 0.5
assign (resid  22 and  name   hb2)(resid  23 and  name    hn) 3.7 0.5 0.5
assign (resid  22 and  name   hd*)(resid  23 and  name    hn) 3.2 0.5 0.5
assign (resid  22 and  name   hd*)(resid  23 and  name    hn) 3.2 0.5 0.5
assign (resid  22 and  name    hz)(resid  23 and  name    hn) 5.5 0.5 0.5
assign (resid  22 and  name    hn)(resid  24 and  name    hn) 3.5 0.5 0.5
assign (resid  22 and  name    hn)(resid  24 and  name    hn) 3.7 0.5 0.5
assign (resid  22 and  name    ha)(resid  25 and  name    hn) 3.1 0.5 0.5
assign (resid  22 and  name    ha)(resid  26 and  name    hn) 3.6 0.5 0.5
assign (resid  23 and  name    hn)(resid  23 and  name    ha) 2.5 0.5 0.5
assign (resid  23 and  name    hn)(resid  23 and  name   hb*) 2.2 0.5 0.5
assign (resid  23 and  name    hn)(resid  23 and  name   hb*) 2.2 0.5 0.5
assign (resid  23 and  name    hn)(resid  23 and  name    hg) 3.2 0.5 0.5
assign (resid  23 and  name    hn)(resid  23 and  name    hg) 3.2 0.5 0.5
assign (resid  23 and  name    hn)(resid  23 and  name   hd*) 2.5 0.5 0.5
assign (resid  23 and  name    hn)(resid  23 and  name   hd*) 2.5 0.5 0.5
assign (resid  23 and  name    hn)(resid  24 and  name    hn) 2.6 0.5 0.5
assign (resid  23 and  name    hn)(resid  24 and  name    hn) 2.7 0.5 0.5
assign (resid  23 and  name    ha)(resid  24 and  name    hn) 2.9 0.5 0.5
assign (resid  23 and  name   hd*)(resid  24 and  name    hn) 4.2 0.5 0.5
assign (resid  23 and  name   hd*)(resid  24 and  name    hn) 4.2 0.5 0.5
assign (resid  23 and  name    hn)(resid  25 and  name    hn) 3.3 0.5 0.5
assign (resid  23 and  name    hn)(resid  25 and  name    hn) 3.5 0.5 0.5
assign (resid  23 and  name    hn)(resid  26 and  name    hn) 4.0 0.5 0.5
assign (resid  23 and  name    ha)(resid  26 and  name    hn) 3.3 0.5 0.5
assign (resid  23 and  name    ha)(resid  26 and  name   hb*) 3.1 0.5 0.5
assign (resid  23 and  name    ha)(resid  27 and  name    hn) 3.4 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name    ha) 2.3 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name    ha) 2.3 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name   hb1) 2.6 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name   hb2) 2.5 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name   hb2) 2.5 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name   hg*) 3.4 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name   hg*) 3.4 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name   hd*) 2.6 0.5 0.5
assign (resid  24 and  name    hn)(resid  24 and  name   hd*) 2.6 0.5 0.5
assign (resid  24 and  name    hn)(resid  25 and  name    hn) 2.5 0.5 0.5
assign (resid  24 and  name    hn)(resid  25 and  name    hn) 2.6 0.5 0.5
assign (resid  24 and  name    ha)(resid  25 and  name    hn) 2.9 0.5 0.5
assign (resid  24 and  name   hb1)(resid  25 and  name    hn) 2.3 0.5 0.5
assign (resid  24 and  name    hn)(resid  26 and  name    hn) 3.3 0.5 0.5
assign (resid  24 and  name    hn)(resid  26 and  name    hn) 3.6 0.5 0.5
assign (resid  24 and  name    ha)(resid  27 and  name    hb) 2.3 0.5 0.5
assign (resid  25 and  name   hg*)(resid  24 and  name    hn) 3.5 0.5 0.5
assign (resid  25 and  name   hg*)(resid  24 and  name    hn) 3.6 0.5 0.5
assign (resid  25 and  name    hn)(resid  25 and  name    ha) 2.2 0.5 0.5
assign (resid  25 and  name    hn)(resid  25 and  name    hb) 2.4 0.5 0.5
assign (resid  25 and  name    hn)(resid  25 and  name   hg*) 2.5 0.5 0.5
assign (resid  25 and  name    hn)(resid  25 and  name   hg*) 2.6 0.5 0.5
assign (resid  25 and  name    hn)(resid  26 and  name    hn) 2.5 0.5 0.5
assign (resid  25 and  name    hn)(resid  26 and  name    hn) 2.8 0.5 0.5
assign (resid  25 and  name    hb)(resid  26 and  name    hn) 3.4 0.5 0.5
assign (resid  25 and  name   hg*)(resid  26 and  name    hn) 2.9 0.5 0.5
assign (resid  25 and  name   hg*)(resid  26 and  name    hn) 3.0 0.5 0.5
assign (resid  25 and  name    ha)(resid  28 and  name   hb1) 2.0 0.5 0.5
assign (resid  25 and  name    ha)(resid  28 and  name   hb1) 2.0 0.5 0.5
assign (resid  25 and  name    ha)(resid  28 and  name   hb2) 2.7 0.5 0.5
assign (resid  26 and  name    hn)(resid  26 and  name    ha) 2.3 0.5 0.5
assign (resid  26 and  name    hn)(resid  26 and  name   hb*) 2.0 0.5 0.5
assign (resid  26 and  name    hn)(resid  26 and  name   hb*) 2.2 0.5 0.5
assign (resid  26 and  name    hn)(resid  26 and  name   hg1) 3.3 0.5 0.5
assign (resid  26 and  name    hn)(resid  26 and  name   hg2) 2.7 0.5 0.5
assign (resid  26 and  name    hn)(resid  26 and  name   hg2) 2.7 0.5 0.5
assign (resid  26 and  name    hn)(resid  26 and  name   hd*) 3.0 0.5 0.5
assign (resid  26 and  name    hn)(resid  26 and  name   hd*) 3.1 0.5 0.5
assign (resid  26 and  name    hn)(resid  27 and  name    hn) 2.6 0.5 0.5
assign (resid  26 and  name    hn)(resid  27 and  name    hn) 2.9 0.5 0.5
assign (resid  26 and  name    ha)(resid  27 and  name    hn) 3.0 0.5 0.5
assign (resid  26 and  name   hb*)(resid  27 and  name    hn) 2.2 0.5 0.5
assign (resid  26 and  name    hn)(resid  28 and  name    hn) 3.4 0.5 0.5
assign (resid  26 and  name    hn)(resid  28 and  name    hn) 3.7 0.5 0.5
assign (resid  26 and  name    ha)(resid  29 and  name    hn) 3.1 0.5 0.5
assign (resid  26 and  name    ha)(resid  30 and  name    hn) 3.7 0.5 0.5
assign (resid  27 and  name    hn)(resid  27 and  name    ha) 2.4 0.5 0.5
assign (resid  27 and  name    hn)(resid  27 and  name    hb) 2.3 0.5 0.5
assign (resid  27 and  name    hn)(resid  27 and  name    hb) 2.4 0.5 0.5
assign (resid  27 and  name    hn)(resid  27 and  name  hg1*) 3.5 0.5 0.5
assign (resid  27 and  name    hn)(resid  27 and  name  hg1*) 3.6 0.5 0.5
assign (resid  27 and  name    hn)(resid  27 and  name  hg2*) 2.8 0.5 0.5
assign (resid  27 and  name    hn)(resid  27 and  name  hg2*) 2.9 0.5 0.5
assign (resid  27 and  name    hn)(resid  28 and  name    hn) 2.2 0.5 0.5
assign (resid  27 and  name    hn)(resid  28 and  name    hn) 2.5 0.5 0.5
assign (resid  27 and  name    ha)(resid  28 and  name    hn) 2.9 0.5 0.5
assign (resid  27 and  name    hb)(resid  28 and  name    hn) 2.5 0.5 0.5
assign (resid  27 and  name    hn)(resid  29 and  name    hn) 3.5 0.5 0.5
assign (resid  27 and  name    hn)(resid  29 and  name    hn) 3.6 0.5 0.5
assign (resid  27 and  name    ha)(resid  30 and  name    hn) 3.4 0.5 0.5
assign (resid  27 and  name    ha)(resid  30 and  name   hb1) 2.7 0.5 0.5
assign (resid  27 and  name    ha)(resid  30 and  name   hb1) 2.8 0.5 0.5
assign (resid  27 and  name    ha)(resid  30 and  name   hb2) 2.8 0.5 0.5
assign (resid  28 and  name    hn)(resid  28 and  name    ha) 2.4 0.5 0.5
assign (resid  28 and  name    hn)(resid  28 and  name   hb1) 2.1 0.5 0.5
assign (resid  28 and  name    hn)(resid  28 and  name   hb1) 2.1 0.5 0.5
assign (resid  28 and  name    hn)(resid  28 and  name   hb2) 2.8 0.5 0.5
assign (resid  28 and  name    hn)(resid  28 and  name   hb2) 2.8 0.5 0.5
assign (resid  28 and  name    hn)(resid  28 and  name    hg) 2.4 0.5 0.5
assign (resid  28 and  name    hn)(resid  28 and  name    hg) 2.4 0.5 0.5
assign (resid  28 and  name    hn)(resid  29 and  name    hn) 2.5 0.5 0.5
assign (resid  28 and  name    hn)(resid  29 and  name    hn) 2.6 0.5 0.5
assign (resid  28 and  name    ha)(resid  29 and  name    hn) 2.8 0.5 0.5
assign (resid  28 and  name   hb1)(resid  29 and  name    hn) 2.8 0.5 0.5
assign (resid  28 and  name   hb2)(resid  29 and  name    hn) 3.4 0.5 0.5
assign (resid  28 and  name   hd*)(resid  29 and  name    hn) 2.9 0.5 0.5
assign (resid  28 and  name   hd*)(resid  29 and  name    hn) 2.9 0.5 0.5
assign (resid  28 and  name    hg)(resid  29 and  name    hn) 2.4 0.5 0.5
assign (resid  28 and  name    hg)(resid  29 and  name    hn) 2.4 0.5 0.5
assign (resid  28 and  name    hn)(resid  30 and  name    hn) 2.6 0.5 0.5
assign (resid  28 and  name    hn)(resid  31 and  name    hn) 3.4 0.5 0.5
assign (resid  28 and  name    hn)(resid  31 and  name    hn) 3.5 0.5 0.5
assign (resid  28 and  name    ha)(resid  31 and  name    hn) 2.6 0.5 0.5
assign (resid  28 and  name    ha)(resid  31 and  name   hb1) 2.5 0.5 0.5
assign (resid  28 and  name    ha)(resid  31 and  name   hb1) 2.5 0.5 0.5
assign (resid  28 and  name    ha)(resid  31 and  name   hb2) 2.6 0.5 0.5
assign (resid  28 and  name    ha)(resid  32 and  name    hn) 3.9 0.5 0.5
assign (resid  29 and  name    hn)(resid  29 and  name    ha) 2.3 0.5 0.5
assign (resid  29 and  name    hn)(resid  29 and  name   hb1) 2.0 0.5 0.5
assign (resid  29 and  name    hn)(resid  29 and  name   hb1) 2.2 0.5 0.5
assign (resid  29 and  name    hn)(resid  29 and  name   hg*) 2.7 0.5 0.5
assign (resid  29 and  name    hn)(resid  29 and  name   hg*) 3.0 0.5 0.5
assign (resid  29 and  name    hn)(resid  30 and  name    hn) 2.4 0.5 0.5
assign (resid  29 and  name    hn)(resid  30 and  name    hn) 2.5 0.5 0.5
assign (resid  29 and  name    ha)(resid  30 and  name    hn) 2.7 0.5 0.5
assign (resid  29 and  name   hg*)(resid  30 and  name    hn) 3.4 0.5 0.5
assign (resid  29 and  name    hn)(resid  32 and  name    hn) 3.7 0.5 0.5
assign (resid  29 and  name    hn)(resid  32 and  name    hn) 3.7 0.5 0.5
assign (resid  29 and  name    ha)(resid  32 and  name    hn) 3.2 0.5 0.5
assign (resid  29 and  name    ha)(resid  33 and  name    hn) 3.6 0.5 0.5
assign (resid  30 and  name    hn)(resid  30 and  name    ha) 2.2 0.5 0.5
assign (resid  30 and  name    hn)(resid  30 and  name   hb*) 2.0 0.5 0.5
assign (resid  30 and  name    hn)(resid  30 and  name   hb*) 2.0 0.5 0.5
assign (resid  30 and  name    hn)(resid  30 and  name   hg1) 2.7 0.5 0.5
assign (resid  30 and  name    hn)(resid  30 and  name   hg2) 2.6 0.5 0.5
assign (resid  30 and  name    hn)(resid  31 and  name    hn) 2.2 0.5 0.5
assign (resid  30 and  name    hn)(resid  31 and  name    hn) 2.5 0.5 0.5
assign (resid  30 and  name    hn)(resid  31 and  name   hd1) 4.5 0.5 0.5
assign (resid  30 and  name    ha)(resid  31 and  name    hn) 2.8 0.5 0.5
assign (resid  30 and  name   hb1)(resid  31 and  name    hn) 2.9 0.5 0.5
assign (resid  30 and  name   hb2)(resid  31 and  name    hn) 3.4 0.5 0.5
assign (resid  30 and  name    hn)(resid  32 and  name    hn) 2.9 0.5 0.5
assign (resid  30 and  name    hn)(resid  32 and  name    hn) 3.4 0.5 0.5
assign (resid  30 and  name    ha)(resid  33 and  name    hn) 3.2 0.5 0.5
assign (resid  30 and  name    ha)(resid  33 and  name   hb1) 2.6 0.5 0.5
assign (resid  30 and  name    ha)(resid  33 and  name   hb1) 2.6 0.5 0.5
assign (resid  30 and  name    ha)(resid  33 and  name   hb2) 2.5 0.5 0.5
assign (resid  30 and  name    ha)(resid  33 and  name   hb2) 2.5 0.5 0.5
assign (resid  30 and  name    ha)(resid  34 and  name    hn) 4.3 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name    ha) 2.4 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name   hb1) 2.4 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name   hb1) 2.5 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name   hb2) 2.2 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name   hb2) 2.3 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name   hd1) 3.0 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name   hd1) 3.1 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name   he3) 4.3 0.5 0.5
assign (resid  31 and  name    hn)(resid  31 and  name   he3) 4.3 0.5 0.5
assign (resid  31 and  name    ha)(resid  31 and  name   hd1) 2.8 0.5 0.5
assign (resid  31 and  name    ha)(resid  31 and  name   hd1) 2.9 0.5 0.5
assign (resid  31 and  name    ha)(resid  31 and  name   he1) 4.1 0.5 0.5
assign (resid  31 and  name    ha)(resid  31 and  name   he3) 2.8 0.5 0.5
assign (resid  31 and  name    ha)(resid  31 and  name   he3) 2.8 0.5 0.5
assign (resid  31 and  name   hb1)(resid  31 and  name   hd1) 3.0 0.5 0.5
assign (resid  31 and  name   hb1)(resid  31 and  name   hd1) 3.0 0.5 0.5
assign (resid  31 and  name   hb1)(resid  31 and  name   he1) 4.5 0.5 0.5
assign (resid  31 and  name   hb1)(resid  31 and  name   he1) 4.6 0.5 0.5
assign (resid  31 and  name   hb1)(resid  31 and  name   he3) 2.7 0.5 0.5
assign (resid  31 and  name   hb1)(resid  31 and  name   he3) 2.8 0.5 0.5
assign (resid  31 and  name   hb2)(resid  31 and  name   hd1) 2.7 0.5 0.5
assign (resid  31 and  name   hb2)(resid  31 and  name   he1) 4.2 0.5 0.5
assign (resid  31 and  name   hb2)(resid  31 and  name   he3) 3.2 0.5 0.5
assign (resid  31 and  name   hb2)(resid  31 and  name   he3) 3.3 0.5 0.5
assign (resid  31 and  name   hd1)(resid  31 and  name   he1) 2.2 0.5 0.5
assign (resid  31 and  name   hd1)(resid  31 and  name   he1) 2.2 0.5 0.5
assign (resid  31 and  name   hd1)(resid  31 and  name   he3) 4.3 0.5 0.5
assign (resid  31 and  name   hd1)(resid  31 and  name   he3) 4.3 0.5 0.5
assign (resid  31 and  name   hd1)(resid  31 and  name   hz2) 4.4 0.5 0.5
assign (resid  31 and  name   hd1)(resid  31 and  name   hz2) 4.4 0.5 0.5
assign (resid  31 and  name   he1)(resid  31 and  name   hz2) 2.5 0.5 0.5
assign (resid  31 and  name   he1)(resid  31 and  name   hz2) 2.6 0.5 0.5
assign (resid  31 and  name   he3)(resid  31 and  name   hz3) 2.3 0.5 0.5
assign (resid  31 and  name   he3)(resid  31 and  name   hz3) 2.3 0.5 0.5
assign (resid  31 and  name   hz3)(resid  31 and  name   hh2) 2.0 0.5 0.5
assign (resid  31 and  name   hz3)(resid  31 and  name   hh2) 2.4 0.5 0.5
assign (resid  31 and  name    hn)(resid  32 and  name    hn) 2.8 0.5 0.5
assign (resid  31 and  name    hn)(resid  32 and  name    hn) 2.8 0.5 0.5
assign (resid  31 and  name    ha)(resid  32 and  name    hn) 3.1 0.5 0.5
assign (resid  31 and  name   hb1)(resid  32 and  name    hn) 2.8 0.5 0.5
assign (resid  31 and  name   hb2)(resid  32 and  name    hn) 3.2 0.5 0.5
assign (resid  31 and  name    ha)(resid  34 and  name   hb1) 2.6 0.5 0.5
assign (resid  31 and  name    ha)(resid  34 and  name   hb2) 2.7 0.5 0.5
assign (resid  31 and  name    hn)(resid  35 and  name    hn) 4.8 0.5 0.5
assign (resid  31 and  name    hn)(resid  35 and  name    hn) 4.8 0.5 0.5
assign (resid  32 and  name    hn)(resid  32 and  name    ha) 2.7 0.5 0.5
assign (resid  32 and  name    hn)(resid  32 and  name   hb*) 1.9 0.5 0.5
assign (resid  32 and  name    hn)(resid  32 and  name   hg1) 2.6 0.5 0.5
assign (resid  32 and  name    hn)(resid  32 and  name   hg1) 2.6 0.5 0.5
assign (resid  32 and  name    hn)(resid  32 and  name   hg2) 2.7 0.5 0.5
assign (resid  32 and  name    hn)(resid  32 and  name   hd*) 3.3 0.5 0.5
assign (resid  32 and  name    hn)(resid  32 and  name   hd*) 3.4 0.5 0.5
assign (resid  32 and  name    hn)(resid  33 and  name    hn) 2.2 0.5 0.5
assign (resid  32 and  name    hn)(resid  33 and  name    hn) 2.5 0.5 0.5
assign (resid  32 and  name    ha)(resid  33 and  name    hn) 2.9 0.5 0.5
assign (resid  32 and  name   hb*)(resid  33 and  name    hn) 2.4 0.5 0.5
assign (resid  32 and  name    hn)(resid  34 and  name    hn) 3.5 0.5 0.5
assign (resid  32 and  name    hn)(resid  34 and  name    hn) 3.7 0.5 0.5
assign (resid  32 and  name    ha)(resid  35 and  name   hb1) 3.8 0.5 0.5
assign (resid  32 and  name    ha)(resid  35 and  name   hb2) 3.2 0.5 0.5
assign (resid  32 and  name    ha)(resid  35 and  name   hb2) 3.3 0.5 0.5
assign (resid  32 and  name    ha)(resid  36 and  name    hn) 3.7 0.5 0.5
assign (resid  32 and  name    ha)(resid  36 and  name    hn) 3.8 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name    ha) 2.3 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name   hb1) 2.6 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name   hb1) 2.7 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name   hb2) 2.4 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name   hb2) 2.4 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name    hg) 2.4 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name    hg) 2.5 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name  hd2*) 2.6 0.5 0.5
assign (resid  33 and  name    hn)(resid  33 and  name  hd2*) 3.0 0.5 0.5
assign (resid  33 and  name    hn)(resid  34 and  name    hn) 2.2 0.5 0.5
assign (resid  33 and  name    hn)(resid  34 and  name    hn) 2.5 0.5 0.5
assign (resid  33 and  name    ha)(resid  34 and  name    hn) 2.8 0.5 0.5
assign (resid  33 and  name   hb1)(resid  34 and  name    hn) 2.8 0.5 0.5
assign (resid  33 and  name   hb2)(resid  34 and  name    hn) 3.0 0.5 0.5
assign (resid  33 and  name  hd2*)(resid  34 and  name    hn) 4.1 0.5 0.5
assign (resid  33 and  name  hd2*)(resid  34 and  name    hn) 4.1 0.5 0.5
assign (resid  33 and  name    hn)(resid  35 and  name    hn) 3.5 0.5 0.5
assign (resid  33 and  name    hn)(resid  35 and  name    hn) 3.6 0.5 0.5
assign (resid  33 and  name   hb1)(resid  35 and  name    hn) 4.1 0.5 0.5
assign (resid  33 and  name   hb2)(resid  35 and  name    hn) 4.4 0.5 0.5
assign (resid  33 and  name    hg)(resid  35 and  name    hn) 5.5 0.5 0.5
assign (resid  33 and  name    hn)(resid  36 and  name    hn) 3.7 0.5 0.5
assign (resid  33 and  name    hn)(resid  36 and  name    hn) 3.7 0.5 0.5
assign (resid  33 and  name    ha)(resid  37 and  name    hn) 3.7 0.5 0.5
assign (resid  34 and  name    hn)(resid  32 and  name   hb2) 3.8 0.5 0.5
assign (resid  34 and  name    hn)(resid  32 and  name   hb2) 3.8 0.5 0.5
assign (resid  34 and  name    hn)(resid  34 and  name    ha) 2.4 0.5 0.5
assign (resid  34 and  name    hn)(resid  34 and  name   hb1) 2.8 0.5 0.5
assign (resid  34 and  name    hn)(resid  34 and  name   hb1) 2.8 0.5 0.5
assign (resid  34 and  name    hn)(resid  34 and  name   hd*) 2.9 0.5 0.5
assign (resid  34 and  name    hn)(resid  34 and  name   hd*) 3.0 0.5 0.5
assign (resid  34 and  name    ha)(resid  34 and  name   hb1) 2.2 0.5 0.5
assign (resid  34 and  name    ha)(resid  34 and  name   hb1) 2.3 0.5 0.5
assign (resid  34 and  name    ha)(resid  34 and  name   hb2) 2.2 0.5 0.5
assign (resid  34 and  name    ha)(resid  34 and  name   hb2) 2.4 0.5 0.5
assign (resid  34 and  name    ha)(resid  34 and  name   hd*) 2.6 0.5 0.5
assign (resid  34 and  name    ha)(resid  34 and  name   hd*) 2.6 0.5 0.5
assign (resid  34 and  name    ha)(resid  34 and  name   he*) 3.8 0.5 0.5
assign (resid  34 and  name   hb1)(resid  34 and  name   hd*) 2.6 0.5 0.5
assign (resid  34 and  name   hb1)(resid  34 and  name   he*) 4.2 0.5 0.5
assign (resid  34 and  name   hb2)(resid  34 and  name   hd*) 2.6 0.5 0.5
assign (resid  34 and  name   hb2)(resid  34 and  name   hd*) 2.8 0.5 0.5
assign (resid  34 and  name   hb2)(resid  34 and  name   he*) 4.4 0.5 0.5
assign (resid  34 and  name    hn)(resid  35 and  name    hn) 2.4 0.5 0.5
assign (resid  34 and  name    hn)(resid  35 and  name    hn) 2.8 0.5 0.5
assign (resid  34 and  name    ha)(resid  35 and  name    hn) 2.7 0.5 0.5
assign (resid  34 and  name   hb1)(resid  35 and  name    hn) 3.0 0.5 0.5
assign (resid  34 and  name   hb2)(resid  35 and  name    hn) 3.0 0.5 0.5
assign (resid  34 and  name   hd*)(resid  35 and  name    hn) 4.2 0.5 0.5
assign (resid  34 and  name   hd*)(resid  35 and  name    hn) 4.2 0.5 0.5
assign (resid  34 and  name    hn)(resid  36 and  name    hn) 3.4 0.5 0.5
assign (resid  34 and  name    hn)(resid  36 and  name    hn) 3.7 0.5 0.5
assign (resid  34 and  name    ha)(resid  37 and  name    hn) 3.6 0.5 0.5
assign (resid  34 and  name    ha)(resid  38 and  name    hn) 3.7 0.5 0.5
assign (resid  35 and  name    hn)(resid  35 and  name    ha) 2.5 0.5 0.5
assign (resid  35 and  name    hn)(resid  35 and  name   hb1) 2.7 0.5 0.5
assign (resid  35 and  name    hn)(resid  35 and  name   hb1) 2.8 0.5 0.5
assign (resid  35 and  name    hn)(resid  35 and  name   hb2) 2.7 0.5 0.5
assign (resid  35 and  name    hn)(resid  35 and  name   hb2) 3.0 0.5 0.5
assign (resid  35 and  name    hn)(resid  36 and  name    hn) 2.5 0.5 0.5
assign (resid  35 and  name    hn)(resid  36 and  name    hn) 2.6 0.5 0.5
assign (resid  35 and  name    ha)(resid  36 and  name    hn) 3.0 0.5 0.5
assign (resid  35 and  name   hb1)(resid  36 and  name    hn) 3.1 0.5 0.5
assign (resid  35 and  name   hb2)(resid  36 and  name    hn) 3.2 0.5 0.5
assign (resid  35 and  name    hn)(resid  37 and  name    hn) 3.4 0.5 0.5
assign (resid  35 and  name    hn)(resid  37 and  name    hn) 3.6 0.5 0.5
assign (resid  35 and  name    ha)(resid  38 and  name    hn) 3.3 0.5 0.5
assign (resid  36 and  name    hn)(resid  36 and  name    ha) 2.4 0.5 0.5
assign (resid  36 and  name    hn)(resid  36 and  name   hb*) 2.4 0.5 0.5
assign (resid  36 and  name    hn)(resid  36 and  name   hb*) 2.5 0.5 0.5
assign (resid  36 and  name    hn)(resid  36 and  name   hg*) 3.1 0.5 0.5
assign (resid  36 and  name    hn)(resid  36 and  name   hg*) 3.1 0.5 0.5
assign (resid  36 and  name    hn)(resid  36 and  name   he*) 3.8 0.5 0.5
assign (resid  36 and  name    hn)(resid  36 and  name   he*) 3.8 0.5 0.5
assign (resid  36 and  name    hn)(resid  37 and  name    hn) 2.4 0.5 0.5
assign (resid  36 and  name    hn)(resid  37 and  name    hn) 2.5 0.5 0.5
assign (resid  36 and  name    ha)(resid  37 and  name    hn) 2.8 0.5 0.5
assign (resid  36 and  name   hb*)(resid  37 and  name    hn) 3.4 0.5 0.5
assign (resid  36 and  name   hg*)(resid  37 and  name    hn) 3.5 0.5 0.5
assign (resid  37 and  name    hn)(resid  37 and  name    ha) 2.9 0.5 0.5
assign (resid  37 and  name    hn)(resid  37 and  name   hb1) 2.7 0.5 0.5
assign (resid  37 and  name    hn)(resid  37 and  name   hb2) 2.6 0.5 0.5
assign (resid  37 and  name    hn)(resid  37 and  name   hb2) 2.6 0.5 0.5
assign (resid  37 and  name    hn)(resid  37 and  name   hd2) 3.1 0.5 0.5
assign (resid  37 and  name    hn)(resid  37 and  name   hd2) 3.7 0.5 0.5
assign (resid  37 and  name    hn)(resid  38 and  name    hn) 2.9 0.5 0.5
assign (resid  37 and  name    hn)(resid  38 and  name    hn) 3.1 0.5 0.5
assign (resid  37 and  name    ha)(resid  38 and  name    hn) 3.0 0.5 0.5
assign (resid  37 and  name   hb1)(resid  38 and  name    hn) 3.3 0.5 0.5
assign (resid  37 and  name   hb2)(resid  38 and  name    hn) 3.1 0.5 0.5
assign (resid  38 and  name    hn)(resid  38 and  name    ha) 2.7 0.5 0.5
assign (resid  38 and  name    hn)(resid  38 and  name   hb1) 2.9 0.5 0.5
assign (resid  38 and  name    hn)(resid  38 and  name   hb1) 3.1 0.5 0.5
assign (resid  38 and  name    hn)(resid  38 and  name   hg*) 3.1 0.5 0.5
assign (resid  38 and  name    hn)(resid  38 and  name   hg*) 3.1 0.5 0.5


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    VAL   1          HT1       VAL   1 -27.086   2.084   1.171
    2   2H    VAL   1          HT2       VAL   1 -26.599   2.782  -0.320
    3   3H    VAL   1          HT3       VAL   1 -25.588   2.912   1.061
    4    HA   VAL   1           HA       VAL   1 -26.124   0.629  -0.667
    5    HB   VAL   1           HB       VAL   1 -23.531   1.247   0.679
    6   1HG1  VAL   1          HG11      VAL   1 -22.946   0.601  -1.859
    7   2HG1  VAL   1          HG12      VAL   1 -24.496  -0.222  -1.689
    8   3HG1  VAL   1          HG13      VAL   1 -23.175  -0.592  -0.581
    9   1HG2  VAL   1          HG21      VAL   1 -23.696   3.377  -0.094
   10   2HG2  VAL   1          HG22      VAL   1 -24.873   2.952  -1.337
   11   3HG2  VAL   1          HG23      VAL   1 -23.161   2.609  -1.589
   12    H    MET   2           HN       MET   2 -25.024  -1.420   0.128
   13    HA   MET   2           HA       MET   2 -26.264  -2.277   2.479
   14   1HB   MET   2          HB2       MET   2 -24.504  -3.388   0.416
   15   2HB   MET   2          HB1       MET   2 -24.343  -4.143   1.983
   16   1HG   MET   2          HG2       MET   2 -27.027  -3.727   0.762
   17   2HG   MET   2          HG1       MET   2 -26.025  -5.099   0.293
   18   1HE   MET   2          HE1       MET   2 -24.987  -6.552   3.419
   19   2HE   MET   2          HE2       MET   2 -25.046  -6.643   1.659
   20   3HE   MET   2          HE3       MET   2 -26.169  -7.596   2.629
   21    HA   PRO   3           HA       PRO   3 -23.527  -0.407   5.525
   22   1HB   PRO   3          HB2       PRO   3 -24.251  -2.450   7.366
   23   2HB   PRO   3          HB1       PRO   3 -24.864  -0.805   7.286
   24   1HG   PRO   3          HG2       PRO   3 -26.027  -3.306   6.223
   25   2HG   PRO   3          HG1       PRO   3 -26.845  -1.835   6.783
   26   1HD   PRO   3          HD2       PRO   3 -26.693  -2.432   4.188
   27   2HD   PRO   3          HD1       PRO   3 -26.540  -0.751   4.747
   28    H    LYS   4           HN       LYS   4 -23.592  -3.740   4.663
   29    HA   LYS   4           HA       LYS   4 -20.998  -4.267   5.905
   30   1HB   LYS   4          HB2       LYS   4 -22.919  -6.075   4.440
   31   2HB   LYS   4          HB1       LYS   4 -21.422  -6.606   5.196
   32   1HG   LYS   4          HG2       LYS   4 -22.249  -6.364   7.326
   33   2HG   LYS   4          HG1       LYS   4 -23.450  -5.166   6.837
   34   1HD   LYS   4          HD2       LYS   4 -24.637  -7.162   7.331
   35   2HD   LYS   4          HD1       LYS   4 -24.611  -7.009   5.573
   36   1HE   LYS   4          HE2       LYS   4 -22.372  -8.513   6.757
   37   2HE   LYS   4          HE1       LYS   4 -23.960  -9.265   6.910
   38   1HZ   LYS   4          HZ1       LYS   4 -23.461 -10.048   4.879
   39   2HZ   LYS   4          HZ2       LYS   4 -22.338  -8.828   4.546
   40   3HZ   LYS   4          HZ3       LYS   4 -23.991  -8.531   4.349
   41    H    GLN   5           HN       GLN   5 -22.296  -3.498   2.817
   42    HA   GLN   5           HA       GLN   5 -20.034  -4.626   1.427
   43   1HB   GLN   5          HB2       GLN   5 -21.557  -4.794  -0.217
   44   2HB   GLN   5          HB1       GLN   5 -22.702  -3.952   0.802
   45   1HG   GLN   5          HG2       GLN   5 -22.720  -2.661  -1.054
   46   2HG   GLN   5          HG1       GLN   5 -21.553  -1.810  -0.078
   47   1HE2  GLN   5          HE21      GLN   5 -19.449  -3.705  -0.620
   48   2HE2  GLN   5          HE22      GLN   5 -19.032  -3.486  -2.261
   49    H    ILE   6           HN       ILE   6 -21.104  -1.575   2.635
   50    HA   ILE   6           HA       ILE   6 -19.080  -0.152   1.159
   51    HB   ILE   6           HB       ILE   6 -19.838   1.757   2.706
   52   1HG1  ILE   6          HG12      ILE   6 -22.142   1.645   3.434
   53   2HG1  ILE   6          HG11      ILE   6 -22.270  -0.010   2.910
   54   1HG2  ILE   6          HG21      ILE   6 -20.150   1.594   0.310
   55   2HG2  ILE   6          HG22      ILE   6 -21.542   2.347   1.096
   56   3HG2  ILE   6          HG23      ILE   6 -21.626   0.663   0.573
   57   1HD1  ILE   6          HD11      ILE   6 -21.058  -0.785   4.677
   58   2HD1  ILE   6          HD12      ILE   6 -21.825   0.615   5.415
   59   3HD1  ILE   6          HD13      ILE   6 -20.152   0.710   4.859
   60    H    VAL   7           HN       VAL   7 -19.601  -1.616   4.241
   61    HA   VAL   7           HA       VAL   7 -17.448  -0.348   5.631
   62    HB   VAL   7           HB       VAL   7 -19.604  -1.602   6.532
   63   1HG1  VAL   7          HG11      VAL   7 -17.579  -3.835   6.508
   64   2HG1  VAL   7          HG12      VAL   7 -19.059  -3.777   5.551
   65   3HG1  VAL   7          HG13      VAL   7 -19.149  -3.859   7.310
   66   1HG2  VAL   7          HG21      VAL   7 -18.683  -1.511   8.620
   67   2HG2  VAL   7          HG22      VAL   7 -17.623  -0.447   7.698
   68   3HG2  VAL   7          HG23      VAL   7 -17.114  -2.093   8.070
   69    H    TYR   8           HN       TYR   8 -18.122  -3.282   3.893
   70    HA   TYR   8           HA       TYR   8 -15.718  -4.713   4.165
   71   1HB   TYR   8          HB2       TYR   8 -18.085  -5.011   2.727
   72   2HB   TYR   8          HB1       TYR   8 -16.854  -4.831   1.483
   73    HD1  TYR   8           HD1      TYR   8 -16.698  -6.359   4.842
   74    HD2  TYR   8           HD2      TYR   8 -16.419  -6.960   0.659
   75    HE1  TYR   8           HE1      TYR   8 -15.936  -8.556   5.233
   76    HE2  TYR   8           HE2      TYR   8 -15.665  -9.218   1.031
   77    HH   TYR   8           HH       TYR   8 -14.348 -10.375   3.363
   78    H    TRP   9           HN       TRP   9 -16.927  -2.346   1.851
   79    HA   TRP   9           HA       TRP   9 -14.650  -2.067   0.209
   80   1HB   TRP   9          HB2       TRP   9 -17.129  -0.583   0.798
   81   2HB   TRP   9          HB1       TRP   9 -15.774   0.455   0.354
   82    HD1  TRP   9           HD1      TRP   9 -18.440  -1.472  -1.143
   83    HE1  TRP   9           HE1      TRP   9 -17.956  -1.713  -3.692
   84    HE3  TRP   9           HE3      TRP   9 -13.708   0.006  -1.150
   85    HZ2  TRP   9           HZ2      TRP   9 -15.822  -1.309  -5.446
   86    HZ3  TRP   9           HZ3      TRP   9 -12.445   0.090  -3.271
   87    HH2  TRP   9           HH2      TRP   9 -13.516  -0.572  -5.380
   88    H    LYS  10           HN       LYS  10 -15.951  -0.037   2.635
   89    HA   LYS  10           HA       LYS  10 -13.933   1.725   3.172
   90   1HB   LYS  10          HB2       LYS  10 -15.773   2.275   4.404
   91   2HB   LYS  10          HB1       LYS  10 -16.205   0.604   4.676
   92   1HG   LYS  10          HG2       LYS  10 -15.605   2.042   6.695
   93   2HG   LYS  10          HG1       LYS  10 -14.896   0.432   6.581
   94   1HD   LYS  10          HD2       LYS  10 -12.829   1.242   6.489
   95   2HD   LYS  10          HD1       LYS  10 -13.270   2.448   5.280
   96   1HE   LYS  10          HE2       LYS  10 -13.511   2.651   8.276
   97   2HE   LYS  10          HE1       LYS  10 -12.515   3.633   7.202
   98   1HZ   LYS  10          HZ1       LYS  10 -14.244   5.043   7.441
   99   2HZ   LYS  10          HZ2       LYS  10 -15.362   3.821   7.783
  100   3HZ   LYS  10          HZ3       LYS  10 -14.904   4.123   6.183
  101    H    GLN  11           HN       GLN  11 -14.399  -1.398   4.820
  102    HA   GLN  11           HA       GLN  11 -11.913  -1.153   6.221
  103   1HB   GLN  11          HB2       GLN  11 -12.396  -3.277   7.154
  104   2HB   GLN  11          HB1       GLN  11 -13.941  -2.462   7.010
  105   1HG   GLN  11          HG2       GLN  11 -14.463  -3.725   5.023
  106   2HG   GLN  11          HG1       GLN  11 -12.874  -4.470   5.047
  107   1HE2  GLN  11          HE21      GLN  11 -13.564  -4.368   8.236
  108   2HE2  GLN  11          HE22      GLN  11 -14.390  -5.873   8.407
  109    H    TRP  12           HN       TRP  12 -12.362  -1.550   3.117
  110    HA   TRP  12           HA       TRP  12 -10.063  -3.358   2.750
  111   1HB   TRP  12          HB2       TRP  12 -12.308  -3.915   1.664
  112   2HB   TRP  12          HB1       TRP  12 -12.042  -2.574   0.618
  113    HD1  TRP  12           HD1      TRP  12 -11.203  -6.096   1.027
  114    HE1  TRP  12           HE1      TRP  12  -9.473  -6.781  -0.733
  115    HE3  TRP  12           HE3      TRP  12 -10.106  -1.555  -0.577
  116    HZ2  TRP  12           HZ2      TRP  12  -7.838  -5.482  -2.637
  117    HZ3  TRP  12           HZ3      TRP  12  -8.440  -1.234  -2.410
  118    HH2  TRP  12           HH2      TRP  12  -7.317  -3.212  -3.423
  119    H    LEU  13           HN       LEU  13 -11.440  -0.192   1.873
  120    HA   LEU  13           HA       LEU  13  -8.929   0.452   0.523
  121   1HB   LEU  13          HB2       LEU  13 -11.133   0.974  -0.565
  122   2HB   LEU  13          HB1       LEU  13 -11.444   2.116   0.728
  123    HG   LEU  13           HG       LEU  13  -9.020   2.989  -0.144
  124   1HD1  LEU  13          HD11      LEU  13  -8.908   1.421  -1.976
  125   2HD1  LEU  13          HD12      LEU  13  -9.133   3.054  -2.605
  126   3HD1  LEU  13          HD13      LEU  13 -10.495   1.934  -2.551
  127   1HD2  LEU  13          HD21      LEU  13 -11.341   4.014  -1.652
  128   2HD2  LEU  13          HD22      LEU  13 -10.152   4.872  -0.672
  129   3HD2  LEU  13          HD23      LEU  13 -11.485   4.018   0.106
  130    H    SER  14           HN       SER  14 -10.351   0.702   3.560
  131    HA   SER  14           HA       SER  14  -9.064   3.200   4.228
  132   1HB   SER  14          HB2       SER  14 -11.250   1.910   5.294
  133   2HB   SER  14          HB1       SER  14  -9.996   1.541   6.465
  134    HG   SER  14           HG       SER  14 -10.330   3.474   7.192
  135    H    LEU  15           HN       LEU  15  -8.724  -0.215   4.962
  136    HA   LEU  15           HA       LEU  15  -6.289   0.202   6.404
  137   1HB   LEU  15          HB2       LEU  15  -7.575  -2.363   5.494
  138   2HB   LEU  15          HB1       LEU  15  -6.330  -2.181   6.711
  139    HG   LEU  15           HG       LEU  15  -8.211  -2.440   8.018
  140   1HD1  LEU  15          HD11      LEU  15  -8.797  -0.284   8.959
  141   2HD1  LEU  15          HD12      LEU  15  -8.175   0.532   7.522
  142   3HD1  LEU  15          HD13      LEU  15  -7.069  -0.325   8.600
  143   1HD2  LEU  15          HD21      LEU  15 -10.177  -2.449   7.010
  144   2HD2  LEU  15          HD22      LEU  15  -9.471  -1.618   5.614
  145   3HD2  LEU  15          HD23      LEU  15 -10.144  -0.684   6.958
  146    H    ARG  16           HN       ARG  16  -7.170  -1.640   3.521
  147    HA   ARG  16           HA       ARG  16  -4.655  -2.327   2.668
  148   1HB   ARG  16          HB2       ARG  16  -7.131  -1.664   1.164
  149   2HB   ARG  16          HB1       ARG  16  -5.665  -1.993   0.279
  150   1HG   ARG  16          HG2       ARG  16  -7.158  -3.833   2.126
  151   2HG   ARG  16          HG1       ARG  16  -6.914  -4.008   0.387
  152   1HD   ARG  16          HD2       ARG  16  -4.427  -4.107   0.903
  153   2HD   ARG  16          HD1       ARG  16  -4.893  -4.294   2.594
  154    HE   ARG  16           HE       ARG  16  -6.314  -6.227   1.357
  155   1HH1  ARG  16          1HH1      ARG  16  -2.932  -5.368   1.304
  156   2HH1  ARG  16          2HH1      ARG  16  -2.396  -6.990   1.020
  157   1HH2  ARG  16          1HH2      ARG  16  -5.611  -8.361   0.983
  158   2HH2  ARG  16          2HH2      ARG  16  -3.916  -8.689   0.838
  159    H    ASN  17           HN       ASN  17  -6.171   0.738   2.513
  160    HA   ASN  17           HA       ASN  17  -4.584   2.049   0.662
  161   1HB   ASN  17          HB2       ASN  17  -6.515   2.689   2.693
  162   2HB   ASN  17          HB1       ASN  17  -5.296   3.899   2.610
  163   1HD2  ASN  17          HD21      ASN  17  -7.430   4.976   2.012
  164   2HD2  ASN  17          HD22      ASN  17  -7.732   5.101   0.324
  165    HA   PRO  18           HA       PRO  18  -1.780   3.891   4.079
  166   1HB   PRO  18          HB2       PRO  18  -2.057   2.689   6.565
  167   2HB   PRO  18          HB1       PRO  18  -2.638   4.297   6.120
  168   1HG   PRO  18          HG2       PRO  18  -4.089   1.702   6.137
  169   2HG   PRO  18          HG1       PRO  18  -4.653   3.308   6.632
  170   1HD   PRO  18          HD2       PRO  18  -5.382   2.313   4.296
  171   2HD   PRO  18          HD1       PRO  18  -4.923   4.018   4.429
  172    H    ILE  19           HN       ILE  19  -2.794   0.639   3.976
  173    HA   ILE  19           HA       ILE  19  -0.297  -0.484   4.870
  174    HB   ILE  19           HB       ILE  19  -2.625  -1.759   3.446
  175   1HG1  ILE  19          HG12      ILE  19  -1.717  -1.525   6.292
  176   2HG1  ILE  19          HG11      ILE  19  -3.312  -1.252   5.620
  177   1HG2  ILE  19          HG21      ILE  19  -0.156  -3.082   4.567
  178   2HG2  ILE  19          HG22      ILE  19  -0.605  -2.981   2.865
  179   3HG2  ILE  19          HG23      ILE  19  -1.589  -3.926   3.981
  180   1HD1  ILE  19          HD11      ILE  19  -3.372  -3.762   5.183
  181   2HD1  ILE  19          HD12      ILE  19  -3.517  -3.215   6.853
  182   3HD1  ILE  19          HD13      ILE  19  -1.981  -3.852   6.264
  183    H    LEU  20           HN       LEU  20  -1.632   0.400   1.813
  184    HA   LEU  20           HA       LEU  20   0.333  -0.887   0.192
  185   1HB   LEU  20          HB2       LEU  20  -1.395   1.506  -0.469
  186   2HB   LEU  20          HB1       LEU  20  -0.463   0.573  -1.622
  187    HG   LEU  20           HG       LEU  20  -3.098   0.046  -0.466
  188   1HD1  LEU  20          HD11      LEU  20  -3.601  -0.580  -2.579
  189   2HD1  LEU  20          HD12      LEU  20  -2.055  -1.391  -2.827
  190   3HD1  LEU  20          HD13      LEU  20  -2.158   0.366  -2.941
  191   1HD2  LEU  20          HD21      LEU  20  -1.850  -1.670   0.728
  192   2HD2  LEU  20          HD22      LEU  20  -1.146  -2.230  -0.790
  193   3HD2  LEU  20          HD23      LEU  20  -2.880  -2.389  -0.511
  194    H    VAL  21           HN       VAL  21  -0.213   2.283   1.517
  195    HA   VAL  21           HA       VAL  21   1.959   3.703   0.584
  196    HB   VAL  21           HB       VAL  21   0.280   3.644   3.019
  197   1HG1  VAL  21          HG11      VAL  21   1.467   5.510   3.980
  198   2HG1  VAL  21          HG12      VAL  21   2.630   5.464   2.652
  199   3HG1  VAL  21          HG13      VAL  21   2.523   4.108   3.776
  200   1HG2  VAL  21          HG21      VAL  21  -0.598   4.619   0.988
  201   2HG2  VAL  21          HG22      VAL  21   0.762   5.747   0.916
  202   3HG2  VAL  21          HG23      VAL  21  -0.406   5.854   2.236
  203    H    PHE  22           HN       PHE  22   1.435   1.882   3.524
  204    HA   PHE  22           HA       PHE  22   3.919   2.060   4.741
  205   1HB   PHE  22          HB2       PHE  22   2.433   1.135   6.167
  206   2HB   PHE  22          HB1       PHE  22   1.478   0.476   4.864
  207    HD1  PHE  22           HD1      PHE  22   1.287  -1.643   4.699
  208    HD2  PHE  22           HD2      PHE  22   4.758  -0.016   6.409
  209    HE1  PHE  22           HE1      PHE  22   2.099  -3.928   5.152
  210    HE2  PHE  22           HE2      PHE  22   5.625  -2.262   6.873
  211    HZ   PHE  22           HZ       PHE  22   4.291  -4.237   6.223
  212    H    LEU  23           HN       LEU  23   2.721   0.148   2.150
  213    HA   LEU  23           HA       LEU  23   5.021  -1.671   2.005
  214   1HB   LEU  23          HB2       LEU  23   2.623  -1.172   0.263
  215   2HB   LEU  23          HB1       LEU  23   3.978  -2.085  -0.364
  216    HG   LEU  23           HG       LEU  23   1.886  -3.230   0.788
  217   1HD1  LEU  23          HD11      LEU  23   4.731  -3.936   0.528
  218   2HD1  LEU  23          HD12      LEU  23   3.295  -4.782  -0.050
  219   3HD1  LEU  23          HD13      LEU  23   3.796  -4.943   1.634
  220   1HD2  LEU  23          HD21      LEU  23   2.870  -1.835   2.880
  221   2HD2  LEU  23          HD22      LEU  23   3.632  -3.412   3.119
  222   3HD2  LEU  23          HD23      LEU  23   1.874  -3.288   3.016
  223    H    LYS  24           HN       LYS  24   3.897   1.205   0.640
  224    HA   LYS  24           HA       LYS  24   5.684   1.450  -1.518
  225   1HB   LYS  24          HB2       LYS  24   3.488   2.820  -0.340
  226   2HB   LYS  24          HB1       LYS  24   4.723   3.979  -0.696
  227   1HG   LYS  24          HG2       LYS  24   3.977   3.970  -2.789
  228   2HG   LYS  24          HG1       LYS  24   4.568   2.310  -2.909
  229   1HD   LYS  24          HD2       LYS  24   2.421   1.819  -3.352
  230   2HD   LYS  24          HD1       LYS  24   2.257   1.908  -1.594
  231   1HE   LYS  24          HE2       LYS  24   2.016   4.544  -2.515
  232   2HE   LYS  24          HE1       LYS  24   1.073   3.565  -3.638
  233   1HZ   LYS  24          HZ1       LYS  24   0.610   4.126  -0.827
  234   2HZ   LYS  24          HZ2       LYS  24   0.287   2.540  -1.317
  235   3HZ   LYS  24          HZ3       LYS  24  -0.499   3.834  -2.071
  236    H    THR  25           HN       THR  25   5.572   2.722   1.711
  237    HA   THR  25           HA       THR  25   7.931   4.254   1.541
  238    HB   THR  25           HB       THR  25   6.338   4.892   3.182
  239    HG1  THR  25           HG1      THR  25   7.666   5.112   4.834
  240   1HG2  THR  25          HG21      THR  25   5.260   3.569   4.684
  241   2HG2  THR  25          HG22      THR  25   6.571   2.391   4.755
  242   3HG2  THR  25          HG23      THR  25   5.482   2.417   3.364
  243    H    ARG  26           HN       ARG  26   7.135   1.045   2.859
  244    HA   ARG  26           HA       ARG  26   9.665   0.447   3.919
  245   1HB   ARG  26          HB2       ARG  26   7.483  -1.238   2.726
  246   2HB   ARG  26          HB1       ARG  26   8.934  -1.959   3.413
  247   1HG   ARG  26          HG2       ARG  26   6.736  -0.471   4.796
  248   2HG   ARG  26          HG1       ARG  26   7.370  -2.072   5.133
  249   1HD   ARG  26          HD2       ARG  26   8.862   0.509   5.556
  250   2HD   ARG  26          HD1       ARG  26   8.012  -0.378   6.817
  251    HE   ARG  26           HE       ARG  26  10.531  -1.104   5.562
  252   1HH1  ARG  26          1HH1      ARG  26   7.906  -2.060   7.663
  253   2HH1  ARG  26          2HH1      ARG  26   8.822  -3.306   8.441
  254   1HH2  ARG  26          1HH2      ARG  26  11.729  -2.746   6.587
  255   2HH2  ARG  26          2HH2      ARG  26  10.988  -3.696   7.832
  256    H    VAL  27           HN       VAL  27   8.308   0.128   0.738
  257    HA   VAL  27           HA       VAL  27  10.518  -1.144  -0.533
  258    HB   VAL  27           HB       VAL  27   7.905   0.024  -1.253
  259   1HG1  VAL  27          HG11      VAL  27  10.152  -0.201  -3.211
  260   2HG1  VAL  27          HG12      VAL  27   9.116   1.182  -2.864
  261   3HG1  VAL  27          HG13      VAL  27   8.456  -0.227  -3.693
  262   1HG2  VAL  27          HG21      VAL  27   7.683  -2.104  -2.473
  263   2HG2  VAL  27          HG22      VAL  27   8.106  -2.336  -0.776
  264   3HG2  VAL  27          HG23      VAL  27   9.340  -2.511  -2.025
  265    H    LEU  28           HN       LEU  28   9.669   2.050   0.330
  266    HA   LEU  28           HA       LEU  28  11.215   3.452  -1.590
  267   1HB   LEU  28          HB2       LEU  28   9.975   5.188  -0.903
  268   2HB   LEU  28          HB1       LEU  28   9.038   4.013  -0.055
  269    HG   LEU  28           HG       LEU  28  10.291   4.446   1.984
  270   1HD1  LEU  28          HD11      LEU  28  11.549   6.870   1.564
  271   2HD1  LEU  28          HD12      LEU  28  12.029   5.893   0.176
  272   3HD1  LEU  28          HD13      LEU  28  12.326   5.308   1.812
  273   1HD2  LEU  28          HD21      LEU  28   8.847   6.059   2.510
  274   2HD2  LEU  28          HD22      LEU  28   8.367   6.044   0.814
  275   3HD2  LEU  28          HD23      LEU  28   9.581   7.193   1.376
  276    H    LYS  29           HN       LYS  29  11.278   2.813   1.813
  277    HA   LYS  29           HA       LYS  29  13.809   3.970   2.300
  278   1HB   LYS  29          HB2       LYS  29  13.657   3.114   4.519
  279   2HB   LYS  29          HB1       LYS  29  12.038   3.613   4.058
  280   1HG   LYS  29          HG2       LYS  29  11.415   1.312   3.634
  281   2HG   LYS  29          HG1       LYS  29  13.060   0.780   3.993
  282   1HD   LYS  29          HD2       LYS  29  12.281   2.302   6.202
  283   2HD   LYS  29          HD1       LYS  29  10.868   1.328   5.791
  284   1HE   LYS  29          HE2       LYS  29  12.467  -0.653   5.696
  285   2HE   LYS  29          HE1       LYS  29  13.642   0.399   6.482
  286   1HZ   LYS  29          HZ1       LYS  29  12.165  -1.104   7.924
  287   2HZ   LYS  29          HZ2       LYS  29  10.954   0.042   7.637
  288   3HZ   LYS  29          HZ3       LYS  29  12.389   0.504   8.404
  289    H    ARG  30           HN       ARG  30  12.677   1.029   1.129
  290    HA   ARG  30           HA       ARG  30  15.082  -0.458   1.537
  291   1HB   ARG  30          HB2       ARG  30  12.433  -0.865   0.285
  292   2HB   ARG  30          HB1       ARG  30  13.721  -1.929  -0.204
  293   1HG   ARG  30          HG2       ARG  30  13.598  -1.629   2.655
  294   2HG   ARG  30          HG1       ARG  30  12.057  -2.156   1.993
  295   1HD   ARG  30          HD2       ARG  30  12.936  -4.221   2.090
  296   2HD   ARG  30          HD1       ARG  30  13.818  -3.746   0.639
  297    HE   ARG  30           HE       ARG  30  15.433  -2.892   2.619
  298   1HH1  ARG  30          1HH1      ARG  30  13.890  -5.961   1.998
  299   2HH1  ARG  30          2HH1      ARG  30  15.138  -6.884   2.764
  300   1HH2  ARG  30          1HH2      ARG  30  17.074  -4.104   3.627
  301   2HH2  ARG  30          2HH2      ARG  30  16.945  -5.831   3.690
  302    H    TRP  31           HN       TRP  31  13.511   1.517  -0.792
  303    HA   TRP  31           HA       TRP  31  15.080   0.998  -3.045
  304   1HB   TRP  31          HB2       TRP  31  12.784   2.425  -2.317
  305   2HB   TRP  31          HB1       TRP  31  13.880   3.567  -2.985
  306    HD1  TRP  31           HD1      TRP  31  11.799   0.721  -3.870
  307    HE1  TRP  31           HE1      TRP  31  11.858   0.378  -6.415
  308    HE3  TRP  31           HE3      TRP  31  15.413   3.839  -4.734
  309    HZ2  TRP  31           HZ2      TRP  31  13.382   1.419  -8.568
  310    HZ3  TRP  31           HZ3      TRP  31  16.256   4.230  -7.072
  311    HH2  TRP  31           HH2      TRP  31  15.241   3.017  -8.959
  312    H    ARG  32           HN       ARG  32  14.946   3.349  -0.357
  313    HA   ARG  32           HA       ARG  32  17.073   5.024  -1.148
  314   1HB   ARG  32          HB2       ARG  32  16.032   4.080   1.484
  315   2HB   ARG  32          HB1       ARG  32  17.169   5.424   1.326
  316   1HG   ARG  32          HG2       ARG  32  15.526   6.635  -0.006
  317   2HG   ARG  32          HG1       ARG  32  14.402   5.302   0.151
  318   1HD   ARG  32          HD2       ARG  32  14.005   5.693   2.353
  319   2HD   ARG  32          HD1       ARG  32  15.545   6.502   2.608
  320    HE   ARG  32           HE       ARG  32  13.734   7.926   0.878
  321   1HH1  ARG  32          1HH1      ARG  32  14.736   7.403   4.181
  322   2HH1  ARG  32          2HH1      ARG  32  14.145   8.934   4.733
  323   1HH2  ARG  32          1HH2      ARG  32  12.959   9.940   1.603
  324   2HH2  ARG  32          2HH2      ARG  32  13.136  10.375   3.270
  325    H    LEU  33           HN       LEU  33  16.829   2.202   0.836
  326    HA   LEU  33           HA       LEU  33  19.445   1.777   1.627
  327   1HB   LEU  33          HB2       LEU  33  16.885   0.315   1.331
  328   2HB   LEU  33          HB1       LEU  33  18.286  -0.582   1.750
  329    HG   LEU  33           HG       LEU  33  16.560   0.681   3.432
  330   1HD1  LEU  33          HD11      LEU  33  19.244   0.256   4.548
  331   2HD1  LEU  33          HD12      LEU  33  18.565  -1.121   3.680
  332   3HD1  LEU  33          HD13      LEU  33  17.692  -0.421   5.044
  333   1HD2  LEU  33          HD21      LEU  33  17.585   2.543   4.411
  334   2HD2  LEU  33          HD22      LEU  33  17.691   2.790   2.665
  335   3HD2  LEU  33          HD23      LEU  33  19.104   2.240   3.564
  336    H    PHE  34           HN       PHE  34  17.502   0.728  -0.982
  337    HA   PHE  34           HA       PHE  34  19.402  -1.089  -2.107
  338   1HB   PHE  34          HB2       PHE  34  16.714  -0.217  -2.644
  339   2HB   PHE  34          HB1       PHE  34  17.615  -0.560  -4.091
  340    HD1  PHE  34           HD1      PHE  34  16.646  -2.576  -4.774
  341    HD2  PHE  34           HD2      PHE  34  18.015  -2.002  -0.816
  342    HE1  PHE  34           HE1      PHE  34  16.372  -4.968  -4.353
  343    HE2  PHE  34           HE2      PHE  34  17.754  -4.392  -0.364
  344    HZ   PHE  34           HZ       PHE  34  16.921  -5.909  -2.133
  345    H    SER  35           HN       SER  35  18.735   2.158  -2.131
  346    HA   SER  35           HA       SER  35  20.313   2.650  -4.596
  347   1HB   SER  35          HB2       SER  35  18.133   4.047  -3.529
  348   2HB   SER  35          HB1       SER  35  19.524   5.090  -3.250
  349    HG   SER  35           HG       SER  35  20.023   4.784  -5.505
  350    H    LYS  36           HN       LYS  36  20.513   2.991  -1.124
  351    HA   LYS  36           HA       LYS  36  22.880   4.612  -1.207
  352   1HB   LYS  36          HB2       LYS  36  22.713   4.743   1.067
  353   2HB   LYS  36          HB1       LYS  36  21.060   4.303   0.680
  354   1HG   LYS  36          HG2       LYS  36  21.392   2.064   1.358
  355   2HG   LYS  36          HG1       LYS  36  23.142   2.272   1.436
  356   1HD   LYS  36          HD2       LYS  36  22.031   2.267   3.662
  357   2HD   LYS  36          HD1       LYS  36  22.947   3.737   3.326
  358   1HE   LYS  36          HE2       LYS  36  20.063   3.699   2.612
  359   2HE   LYS  36          HE1       LYS  36  20.486   3.799   4.321
  360   1HZ   LYS  36          HZ1       LYS  36  22.102   5.648   3.322
  361   2HZ   LYS  36          HZ2       LYS  36  20.533   5.989   3.851
  362   3HZ   LYS  36          HZ3       LYS  36  20.838   5.760   2.203
  363    H    HIS  37           HN       HIS  37  22.187   1.285  -1.327
  364    HA   HIS  37           HA       HIS  37  24.740   0.330  -0.495
  365   1HB   HIS  37          HB2       HIS  37  23.459  -1.470  -0.292
  366   2HB   HIS  37          HB1       HIS  37  22.163  -0.763  -1.190
  367    HD1  HIS  37           HD1      HIS  37  24.877  -3.264  -1.449
  368    HD2  HIS  37           HD2      HIS  37  22.120  -1.389  -3.920
  369    HE1  HIS  37           HE1      HIS  37  24.833  -4.637  -3.558
  370    HE2  HIS  37           HE2      HIS  37  23.072  -3.549  -4.999
  371    H    GLU  38           HN       GLU  38  23.062   0.321  -3.590
  372    HA   GLU  38           HA       GLU  38  23.811   0.120  -5.741
  373   1HB   GLU  38          HB2       GLU  38  25.566   1.860  -6.323
  374   2HB   GLU  38          HB1       GLU  38  24.092   2.455  -5.573
  375   1HG   GLU  38          HG2       GLU  38  25.215   2.660  -3.445
  376   2HG   GLU  38          HG1       GLU  38  26.682   1.957  -4.123
  Start of MODEL    2
    1   1H    VAL   1          HT1       VAL   1 -29.865   3.178   0.127
    2   2H    VAL   1          HT2       VAL   1 -28.165   3.329  -0.057
    3   3H    VAL   1          HT3       VAL   1 -28.867   3.344   1.509
    4    HA   VAL   1           HA       VAL   1 -29.775   1.048   0.465
    5    HB   VAL   1           HB       VAL   1 -27.765  -0.121  -0.352
    6   1HG1  VAL   1          HG11      VAL   1 -29.135   0.445  -2.114
    7   2HG1  VAL   1          HG12      VAL   1 -27.626   1.228  -2.585
    8   3HG1  VAL   1          HG13      VAL   1 -28.925   2.178  -1.861
    9   1HG2  VAL   1          HG21      VAL   1 -26.462   2.544  -0.780
   10   2HG2  VAL   1          HG22      VAL   1 -25.745   0.935  -0.842
   11   3HG2  VAL   1          HG23      VAL   1 -26.210   1.634   0.710
   12    H    MET   2           HN       MET   2 -28.472  -0.880   1.475
   13    HA   MET   2           HA       MET   2 -28.175  -0.290   4.234
   14   1HB   MET   2          HB2       MET   2 -28.235  -2.669   2.490
   15   2HB   MET   2          HB1       MET   2 -27.326  -2.838   3.971
   16   1HG   MET   2          HG2       MET   2 -29.286  -2.166   5.261
   17   2HG   MET   2          HG1       MET   2 -30.193  -1.985   3.760
   18   1HE   MET   2          HE1       MET   2 -32.194  -3.822   4.351
   19   2HE   MET   2          HE2       MET   2 -31.813  -5.218   3.342
   20   3HE   MET   2          HE3       MET   2 -31.505  -3.589   2.743
   21    HA   PRO   3           HA       PRO   3 -23.732  -0.038   4.355
   22   1HB   PRO   3          HB2       PRO   3 -23.254  -0.479   6.900
   23   2HB   PRO   3          HB1       PRO   3 -24.490   0.710   6.494
   24   1HG   PRO   3          HG2       PRO   3 -24.844  -2.180   7.205
   25   2HG   PRO   3          HG1       PRO   3 -25.632  -0.764   7.941
   26   1HD   PRO   3          HD2       PRO   3 -26.755  -2.257   5.910
   27   2HD   PRO   3          HD1       PRO   3 -27.130  -0.546   6.202
   28    H    LYS   4           HN       LYS   4 -22.072  -1.732   6.084
   29    HA   LYS   4           HA       LYS   4 -20.947  -3.696   6.126
   30   1HB   LYS   4          HB2       LYS   4 -23.325  -4.599   6.373
   31   2HB   LYS   4          HB1       LYS   4 -23.238  -4.976   4.658
   32   1HG   LYS   4          HG2       LYS   4 -22.515  -6.963   5.437
   33   2HG   LYS   4          HG1       LYS   4 -20.961  -6.125   5.468
   34   1HD   LYS   4          HD2       LYS   4 -22.689  -5.870   7.863
   35   2HD   LYS   4          HD1       LYS   4 -21.929  -7.437   7.579
   36   1HE   LYS   4          HE2       LYS   4 -20.071  -6.637   8.494
   37   2HE   LYS   4          HE1       LYS   4 -19.929  -5.529   7.131
   38   1HZ   LYS   4          HZ1       LYS   4 -21.203  -5.019   9.756
   39   2HZ   LYS   4          HZ2       LYS   4 -21.425  -4.003   8.422
   40   3HZ   LYS   4          HZ3       LYS   4 -19.877  -4.220   9.070
   41    H    GLN   5           HN       GLN   5 -22.309  -2.589   3.101
   42    HA   GLN   5           HA       GLN   5 -20.312  -4.084   1.614
   43   1HB   GLN   5          HB2       GLN   5 -21.937  -4.144   0.053
   44   2HB   GLN   5          HB1       GLN   5 -22.946  -3.160   1.093
   45   1HG   GLN   5          HG2       GLN   5 -22.918  -1.934  -0.812
   46   2HG   GLN   5          HG1       GLN   5 -21.625  -1.172   0.076
   47   1HE2  GLN   5          HE21      GLN   5 -19.741  -3.263  -0.467
   48   2HE2  GLN   5          HE22      GLN   5 -19.381  -3.156  -2.132
   49    H    ILE   6           HN       ILE   6 -21.050  -0.953   2.777
   50    HA   ILE   6           HA       ILE   6 -18.996   0.334   1.238
   51    HB   ILE   6           HB       ILE   6 -19.613   2.277   2.836
   52   1HG1  ILE   6          HG12      ILE   6 -21.912   2.287   3.599
   53   2HG1  ILE   6          HG11      ILE   6 -22.156   0.653   3.039
   54   1HG2  ILE   6          HG21      ILE   6 -21.490   1.309   0.713
   55   2HG2  ILE   6          HG22      ILE   6 -19.976   2.177   0.442
   56   3HG2  ILE   6          HG23      ILE   6 -21.319   2.977   1.265
   57   1HD1  ILE   6          HD11      ILE   6 -21.148  -0.233   4.855
   58   2HD1  ILE   6          HD12      ILE   6 -21.563   1.323   5.569
   59   3HD1  ILE   6          HD13      ILE   6 -19.939   1.051   4.935
   60    H    VAL   7           HN       VAL   7 -19.558  -1.122   4.316
   61    HA   VAL   7           HA       VAL   7 -17.324   0.000   5.699
   62    HB   VAL   7           HB       VAL   7 -19.557  -1.125   6.602
   63   1HG1  VAL   7          HG11      VAL   7 -19.088  -3.327   5.609
   64   2HG1  VAL   7          HG12      VAL   7 -19.247  -3.398   7.363
   65   3HG1  VAL   7          HG13      VAL   7 -17.649  -3.458   6.619
   66   1HG2  VAL   7          HG21      VAL   7 -18.547  -1.277   8.722
   67   2HG2  VAL   7          HG22      VAL   7 -17.701  -0.012   7.833
   68   3HG2  VAL   7          HG23      VAL   7 -16.965  -1.602   8.016
   69    H    TYR   8           HN       TYR   8 -18.178  -2.865   3.943
   70    HA   TYR   8           HA       TYR   8 -15.850  -4.433   4.231
   71   1HB   TYR   8          HB2       TYR   8 -18.254  -4.655   2.869
   72   2HB   TYR   8          HB1       TYR   8 -17.069  -4.511   1.575
   73    HD1  TYR   8           HD1      TYR   8 -16.846  -6.057   4.923
   74    HD2  TYR   8           HD2      TYR   8 -16.718  -6.649   0.731
   75    HE1  TYR   8           HE1      TYR   8 -16.141  -8.278   5.282
   76    HE2  TYR   8           HE2      TYR   8 -16.024  -8.931   1.072
   77    HH   TYR   8           HH       TYR   8 -14.976 -10.329   2.754
   78    H    TRP   9           HN       TRP   9 -16.975  -2.054   1.890
   79    HA   TRP   9           HA       TRP   9 -14.724  -1.936   0.201
   80   1HB   TRP   9          HB2       TRP   9 -17.110  -0.319   0.801
   81   2HB   TRP   9          HB1       TRP   9 -15.715   0.646   0.317
   82    HD1  TRP   9           HD1      TRP   9 -18.492  -1.181  -1.094
   83    HE1  TRP   9           HE1      TRP   9 -18.072  -1.485  -3.650
   84    HE3  TRP   9           HE3      TRP   9 -13.700   0.084  -1.222
   85    HZ2  TRP   9           HZ2      TRP   9 -15.958  -1.204  -5.453
   86    HZ3  TRP   9           HZ3      TRP   9 -12.480   0.079  -3.369
   87    HH2  TRP   9           HH2      TRP   9 -13.622  -0.568  -5.445
   88    H    LYS  10           HN       LYS  10 -15.849   0.235   2.603
   89    HA   LYS  10           HA       LYS  10 -13.691   1.873   2.987
   90   1HB   LYS  10          HB2       LYS  10 -15.789   2.384   3.997
   91   2HB   LYS  10          HB1       LYS  10 -15.783   0.887   4.914
   92   1HG   LYS  10          HG2       LYS  10 -13.491   2.109   5.752
   93   2HG   LYS  10          HG1       LYS  10 -14.596   3.463   5.525
   94   1HD   LYS  10          HD2       LYS  10 -16.111   2.648   7.094
   95   2HD   LYS  10          HD1       LYS  10 -15.475   1.005   6.990
   96   1HE   LYS  10          HE2       LYS  10 -14.822   2.005   9.094
   97   2HE   LYS  10          HE1       LYS  10 -13.401   1.765   8.078
   98   1HZ   LYS  10          HZ1       LYS  10 -14.584   4.217   9.046
   99   2HZ   LYS  10          HZ2       LYS  10 -14.137   4.257   7.415
  100   3HZ   LYS  10          HZ3       LYS  10 -12.986   3.888   8.599
  101    H    GLN  11           HN       GLN  11 -14.388  -1.137   4.773
  102    HA   GLN  11           HA       GLN  11 -11.916  -0.973   6.209
  103   1HB   GLN  11          HB2       GLN  11 -12.520  -3.025   7.212
  104   2HB   GLN  11          HB1       GLN  11 -14.029  -2.163   6.992
  105   1HG   GLN  11          HG2       GLN  11 -14.567  -3.495   5.069
  106   2HG   GLN  11          HG1       GLN  11 -12.992  -4.264   5.113
  107   1HE2  GLN  11          HE21      GLN  11 -13.673  -4.069   8.300
  108   2HE2  GLN  11          HE22      GLN  11 -14.527  -5.552   8.509
  109    H    TRP  12           HN       TRP  12 -12.366  -1.429   3.118
  110    HA   TRP  12           HA       TRP  12 -10.170  -3.373   2.784
  111   1HB   TRP  12          HB2       TRP  12 -12.445  -3.818   1.716
  112   2HB   TRP  12          HB1       TRP  12 -12.131  -2.491   0.667
  113    HD1  TRP  12           HD1      TRP  12 -11.469  -6.049   1.068
  114    HE1  TRP  12           HE1      TRP  12  -9.834  -6.827  -0.741
  115    HE3  TRP  12           HE3      TRP  12 -10.182  -1.579  -0.589
  116    HZ2  TRP  12           HZ2      TRP  12  -8.194  -5.624  -2.702
  117    HZ3  TRP  12           HZ3      TRP  12  -8.562  -1.350  -2.477
  118    HH2  TRP  12           HH2      TRP  12  -7.579  -3.388  -3.515
  119    H    LEU  13           HN       LEU  13 -11.365  -0.161   1.808
  120    HA   LEU  13           HA       LEU  13  -8.761   0.288   0.537
  121   1HB   LEU  13          HB2       LEU  13 -10.748   0.851  -0.794
  122   2HB   LEU  13          HB1       LEU  13 -11.296   1.946   0.462
  123    HG   LEU  13           HG       LEU  13  -8.632   2.669  -0.325
  124   1HD1  LEU  13          HD11      LEU  13  -9.780   1.470  -2.438
  125   2HD1  LEU  13          HD12      LEU  13  -8.662   2.826  -2.572
  126   3HD1  LEU  13          HD13      LEU  13 -10.402   3.107  -2.637
  127   1HD2  LEU  13          HD21      LEU  13  -9.482   4.758  -0.196
  128   2HD2  LEU  13          HD22      LEU  13 -10.804   3.926   0.623
  129   3HD2  LEU  13          HD23      LEU  13 -10.945   4.336  -1.087
  130    H    SER  14           HN       SER  14 -10.190   0.656   3.517
  131    HA   SER  14           HA       SER  14  -8.892   3.187   4.102
  132   1HB   SER  14          HB2       SER  14 -11.152   2.022   5.162
  133   2HB   SER  14          HB1       SER  14  -9.942   1.658   6.382
  134    HG   SER  14           HG       SER  14 -11.171   3.775   6.441
  135    H    LEU  15           HN       LEU  15  -8.692  -0.212   4.924
  136    HA   LEU  15           HA       LEU  15  -6.277   0.154   6.421
  137   1HB   LEU  15          HB2       LEU  15  -7.684  -2.378   5.589
  138   2HB   LEU  15          HB1       LEU  15  -6.446  -2.214   6.818
  139    HG   LEU  15           HG       LEU  15  -8.352  -2.310   8.106
  140   1HD1  LEU  15          HD11      LEU  15  -8.176   0.630   7.470
  141   2HD1  LEU  15          HD12      LEU  15  -7.113  -0.219   8.597
  142   3HD1  LEU  15          HD13      LEU  15  -8.839  -0.090   8.940
  143   1HD2  LEU  15          HD21      LEU  15 -10.182  -0.520   6.933
  144   2HD2  LEU  15          HD22      LEU  15 -10.297  -2.277   7.059
  145   3HD2  LEU  15          HD23      LEU  15  -9.529  -1.539   5.643
  146    H    ARG  16           HN       ARG  16  -7.176  -1.821   3.627
  147    HA   ARG  16           HA       ARG  16  -4.652  -2.592   2.879
  148   1HB   ARG  16          HB2       ARG  16  -7.164  -2.126   1.387
  149   2HB   ARG  16          HB1       ARG  16  -5.712  -2.469   0.474
  150   1HG   ARG  16          HG2       ARG  16  -5.779  -4.631   1.011
  151   2HG   ARG  16          HG1       ARG  16  -6.051  -4.261   2.715
  152   1HD   ARG  16          HD2       ARG  16  -8.319  -4.352   2.522
  153   2HD   ARG  16          HD1       ARG  16  -8.299  -3.854   0.838
  154    HE   ARG  16           HE       ARG  16  -7.859  -6.078   0.201
  155   1HH1  ARG  16          1HH1      ARG  16  -8.251  -5.745   3.661
  156   2HH1  ARG  16          2HH1      ARG  16  -8.532  -7.434   3.911
  157   1HH2  ARG  16          1HH2      ARG  16  -8.227  -8.296   0.541
  158   2HH2  ARG  16          2HH2      ARG  16  -8.518  -8.879   2.145
  159    H    ASN  17           HN       ASN  17  -6.094   0.471   2.524
  160    HA   ASN  17           HA       ASN  17  -4.477   1.574   0.530
  161   1HB   ASN  17          HB2       ASN  17  -6.428   2.431   2.451
  162   2HB   ASN  17          HB1       ASN  17  -5.175   3.601   2.307
  163   1HD2  ASN  17          HD21      ASN  17  -7.177   4.751   1.549
  164   2HD2  ASN  17          HD22      ASN  17  -7.471   4.715  -0.145
  165    HA   PRO  18           HA       PRO  18  -1.773   3.649   3.930
  166   1HB   PRO  18          HB2       PRO  18  -2.115   2.499   6.442
  167   2HB   PRO  18          HB1       PRO  18  -2.659   4.104   5.949
  168   1HG   PRO  18          HG2       PRO  18  -4.151   1.538   6.012
  169   2HG   PRO  18          HG1       PRO  18  -4.707   3.173   6.410
  170   1HD   PRO  18          HD2       PRO  18  -5.370   2.061   4.099
  171   2HD   PRO  18          HD1       PRO  18  -4.917   3.771   4.170
  172    H    ILE  19           HN       ILE  19  -2.769   0.384   3.952
  173    HA   ILE  19           HA       ILE  19  -0.271  -0.694   4.894
  174    HB   ILE  19           HB       ILE  19  -2.535  -2.064   3.449
  175   1HG1  ILE  19          HG12      ILE  19  -1.790  -1.768   6.353
  176   2HG1  ILE  19          HG11      ILE  19  -3.274  -1.264   5.574
  177   1HG2  ILE  19          HG21      ILE  19   0.088  -2.999   3.864
  178   2HG2  ILE  19          HG22      ILE  19  -1.312  -3.916   3.311
  179   3HG2  ILE  19          HG23      ILE  19  -0.933  -3.836   5.030
  180   1HD1  ILE  19          HD11      ILE  19  -2.391  -4.039   6.266
  181   2HD1  ILE  19          HD12      ILE  19  -3.699  -3.726   5.124
  182   3HD1  ILE  19          HD13      ILE  19  -3.836  -3.175   6.794
  183    H    LEU  20           HN       LEU  20  -1.607   0.041   1.796
  184    HA   LEU  20           HA       LEU  20   0.389  -1.281   0.241
  185   1HB   LEU  20          HB2       LEU  20  -1.379   1.044  -0.538
  186   2HB   LEU  20          HB1       LEU  20  -0.428   0.072  -1.642
  187    HG   LEU  20           HG       LEU  20  -3.058  -0.440  -0.474
  188   1HD1  LEU  20          HD11      LEU  20  -1.778  -1.807  -2.811
  189   2HD1  LEU  20          HD12      LEU  20  -2.358  -0.144  -2.919
  190   3HD1  LEU  20          HD13      LEU  20  -3.482  -1.447  -2.530
  191   1HD2  LEU  20          HD21      LEU  20  -1.814  -2.076   0.819
  192   2HD2  LEU  20          HD22      LEU  20  -1.057  -2.689  -0.653
  193   3HD2  LEU  20          HD23      LEU  20  -2.794  -2.878  -0.410
  194    H    VAL  21           HN       VAL  21  -0.222   1.934   1.418
  195    HA   VAL  21           HA       VAL  21   1.929   3.344   0.417
  196    HB   VAL  21           HB       VAL  21   0.241   3.383   2.841
  197   1HG1  VAL  21          HG11      VAL  21   2.475   3.935   3.575
  198   2HG1  VAL  21          HG12      VAL  21   1.381   5.320   3.709
  199   3HG1  VAL  21          HG13      VAL  21   2.549   5.235   2.386
  200   1HG2  VAL  21          HG21      VAL  21   0.685   5.375   0.627
  201   2HG2  VAL  21          HG22      VAL  21  -0.488   5.535   1.937
  202   3HG2  VAL  21          HG23      VAL  21  -0.651   4.227   0.758
  203    H    PHE  22           HN       PHE  22   1.415   1.665   3.446
  204    HA   PHE  22           HA       PHE  22   3.879   1.957   4.675
  205   1HB   PHE  22          HB2       PHE  22   2.402   1.060   6.129
  206   2HB   PHE  22          HB1       PHE  22   1.480   0.314   4.849
  207    HD1  PHE  22           HD1      PHE  22   4.753  -0.013   6.451
  208    HD2  PHE  22           HD2      PHE  22   1.353  -1.811   4.776
  209    HE1  PHE  22           HE1      PHE  22   5.683  -2.212   7.016
  210    HE2  PHE  22           HE2      PHE  22   2.224  -4.052   5.336
  211    HZ   PHE  22           HZ       PHE  22   4.412  -4.250   6.441
  212    H    LEU  23           HN       LEU  23   2.758  -0.103   2.161
  213    HA   LEU  23           HA       LEU  23   5.104  -1.870   2.131
  214   1HB   LEU  23          HB2       LEU  23   2.729  -1.503   0.324
  215   2HB   LEU  23          HB1       LEU  23   4.116  -2.413  -0.233
  216    HG   LEU  23           HG       LEU  23   2.026  -3.552   0.925
  217   1HD1  LEU  23          HD11      LEU  23   3.951  -5.183   1.887
  218   2HD1  LEU  23          HD12      LEU  23   4.889  -4.205   0.758
  219   3HD1  LEU  23          HD13      LEU  23   3.486  -5.107   0.187
  220   1HD2  LEU  23          HD21      LEU  23   1.962  -3.511   3.151
  221   2HD2  LEU  23          HD22      LEU  23   2.935  -2.046   2.976
  222   3HD2  LEU  23          HD23      LEU  23   3.719  -3.596   3.301
  223    H    LYS  24           HN       LYS  24   3.935   0.911   0.617
  224    HA   LYS  24           HA       LYS  24   5.762   1.109  -1.510
  225   1HB   LYS  24          HB2       LYS  24   3.490   2.457  -0.457
  226   2HB   LYS  24          HB1       LYS  24   4.699   3.640  -0.833
  227   1HG   LYS  24          HG2       LYS  24   3.990   3.512  -2.935
  228   2HG   LYS  24          HG1       LYS  24   4.682   1.888  -2.971
  229   1HD   LYS  24          HD2       LYS  24   2.407   1.304  -1.758
  230   2HD   LYS  24          HD1       LYS  24   1.861   2.730  -2.649
  231   1HE   LYS  24          HE2       LYS  24   3.191   1.440  -4.601
  232   2HE   LYS  24          HE1       LYS  24   2.667   0.064  -3.633
  233   1HZ   LYS  24          HZ1       LYS  24   0.520   0.390  -4.172
  234   2HZ   LYS  24          HZ2       LYS  24   1.171   1.177  -5.519
  235   3HZ   LYS  24          HZ3       LYS  24   0.647   2.078  -4.187
  236    H    THR  25           HN       THR  25   5.533   2.537   1.651
  237    HA   THR  25           HA       THR  25   7.841   4.138   1.456
  238    HB   THR  25           HB       THR  25   6.198   4.792   3.040
  239    HG1  THR  25           HG1      THR  25   8.257   3.592   4.569
  240   1HG2  THR  25          HG21      THR  25   5.420   2.302   3.315
  241   2HG2  THR  25          HG22      THR  25   5.139   3.501   4.582
  242   3HG2  THR  25          HG23      THR  25   6.484   2.368   4.723
  243    H    ARG  26           HN       ARG  26   7.128   0.965   2.906
  244    HA   ARG  26           HA       ARG  26   9.661   0.497   4.023
  245   1HB   ARG  26          HB2       ARG  26   7.550  -1.308   2.875
  246   2HB   ARG  26          HB1       ARG  26   9.015  -1.952   3.609
  247   1HG   ARG  26          HG2       ARG  26   6.757  -0.473   4.904
  248   2HG   ARG  26          HG1       ARG  26   7.424  -2.047   5.307
  249   1HD   ARG  26          HD2       ARG  26   8.773   0.616   5.693
  250   2HD   ARG  26          HD1       ARG  26   8.040  -0.366   6.959
  251    HE   ARG  26           HE       ARG  26  10.110  -1.697   5.451
  252   1HH1  ARG  26          1HH1      ARG  26   9.382   0.283   8.234
  253   2HH1  ARG  26          2HH1      ARG  26  10.809  -0.185   9.095
  254   1HH2  ARG  26          1HH2      ARG  26  11.988  -2.311   6.585
  255   2HH2  ARG  26          2HH2      ARG  26  12.288  -1.655   8.160
  256    H    VAL  27           HN       VAL  27   8.364  -0.019   0.834
  257    HA   VAL  27           HA       VAL  27  10.702  -1.226  -0.271
  258    HB   VAL  27           HB       VAL  27   8.028  -0.326  -1.162
  259   1HG1  VAL  27          HG11      VAL  27  10.352  -0.570  -3.025
  260   2HG1  VAL  27          HG12      VAL  27   9.215   0.763  -2.836
  261   3HG1  VAL  27          HG13      VAL  27   8.679  -0.756  -3.551
  262   1HG2  VAL  27          HG21      VAL  27   9.653  -2.814  -1.666
  263   2HG2  VAL  27          HG22      VAL  27   7.983  -2.566  -2.175
  264   3HG2  VAL  27          HG23      VAL  27   8.384  -2.615  -0.458
  265    H    LEU  28           HN       LEU  28   9.593   1.956   0.305
  266    HA   LEU  28           HA       LEU  28  11.069   3.316  -1.689
  267   1HB   LEU  28          HB2       LEU  28   9.799   5.055  -1.047
  268   2HB   LEU  28          HB1       LEU  28   8.903   3.891  -0.142
  269    HG   LEU  28           HG       LEU  28  10.175   4.429   1.859
  270   1HD1  LEU  28          HD11      LEU  28  11.362   6.870   1.318
  271   2HD1  LEU  28          HD12      LEU  28  11.852   5.840  -0.026
  272   3HD1  LEU  28          HD13      LEU  28  12.181   5.341   1.632
  273   1HD2  LEU  28          HD21      LEU  28   9.382   7.131   1.158
  274   2HD2  LEU  28          HD22      LEU  28   8.702   6.027   2.353
  275   3HD2  LEU  28          HD23      LEU  28   8.189   5.928   0.668
  276    H    LYS  29           HN       LYS  29  11.191   2.820   1.730
  277    HA   LYS  29           HA       LYS  29  13.708   4.020   2.156
  278   1HB   LYS  29          HB2       LYS  29  13.578   3.179   4.399
  279   2HB   LYS  29          HB1       LYS  29  11.973   3.728   3.937
  280   1HG   LYS  29          HG2       LYS  29  11.279   1.447   3.522
  281   2HG   LYS  29          HG1       LYS  29  12.902   0.864   3.894
  282   1HD   LYS  29          HD2       LYS  29  11.523   2.530   5.931
  283   2HD   LYS  29          HD1       LYS  29  10.959   0.874   5.702
  284   1HE   LYS  29          HE2       LYS  29  12.567   0.485   7.264
  285   2HE   LYS  29          HE1       LYS  29  13.563   0.377   5.815
  286   1HZ   LYS  29          HZ1       LYS  29  13.238   3.006   7.058
  287   2HZ   LYS  29          HZ2       LYS  29  14.571   2.353   6.247
  288   3HZ   LYS  29          HZ3       LYS  29  14.239   1.887   7.837
  289    H    ARG  30           HN       ARG  30  12.622   1.057   0.985
  290    HA   ARG  30           HA       ARG  30  15.044  -0.395   1.504
  291   1HB   ARG  30          HB2       ARG  30  13.886  -2.205   0.735
  292   2HB   ARG  30          HB1       ARG  30  12.507  -1.197   1.019
  293   1HG   ARG  30          HG2       ARG  30  11.962  -1.265  -1.116
  294   2HG   ARG  30          HG1       ARG  30  13.548  -0.730  -1.608
  295   1HD   ARG  30          HD2       ARG  30  14.170  -3.236  -1.026
  296   2HD   ARG  30          HD1       ARG  30  12.458  -3.478  -1.368
  297    HE   ARG  30           HE       ARG  30  13.554  -1.977  -3.452
  298   1HH1  ARG  30          1HH1      ARG  30  13.805  -5.185  -2.101
  299   2HH1  ARG  30          2HH1      ARG  30  14.226  -5.924  -3.610
  300   1HH2  ARG  30          1HH2      ARG  30  14.107  -2.949  -5.439
  301   2HH2  ARG  30          2HH2      ARG  30  14.398  -4.655  -5.504
  302    H    TRP  31           HN       TRP  31  13.445   1.476  -0.868
  303    HA   TRP  31           HA       TRP  31  15.095   1.120  -3.079
  304   1HB   TRP  31          HB2       TRP  31  12.735   2.419  -2.358
  305   2HB   TRP  31          HB1       TRP  31  13.787   3.645  -2.947
  306    HD1  TRP  31           HD1      TRP  31  11.844   0.767  -4.010
  307    HE1  TRP  31           HE1      TRP  31  11.985   0.531  -6.564
  308    HE3  TRP  31           HE3      TRP  31  15.369   4.037  -4.644
  309    HZ2  TRP  31           HZ2      TRP  31  13.529   1.712  -8.629
  310    HZ3  TRP  31           HZ3      TRP  31  16.261   4.554  -6.941
  311    HH2  TRP  31           HH2      TRP  31  15.339   3.386  -8.902
  312    H    ARG  32           HN       ARG  32  14.852   3.449  -0.378
  313    HA   ARG  32           HA       ARG  32  16.943   5.182  -1.114
  314   1HB   ARG  32          HB2       ARG  32  15.880   4.191   1.494
  315   2HB   ARG  32          HB1       ARG  32  16.978   5.572   1.364
  316   1HG   ARG  32          HG2       ARG  32  15.321   6.742   0.013
  317   2HG   ARG  32          HG1       ARG  32  14.237   5.371   0.134
  318   1HD   ARG  32          HD2       ARG  32  13.844   5.696   2.371
  319   2HD   ARG  32          HD1       ARG  32  15.296   6.661   2.598
  320    HE   ARG  32           HE       ARG  32  13.699   8.094   0.869
  321   1HH1  ARG  32          1HH1      ARG  32  13.434   6.868   4.126
  322   2HH1  ARG  32          2HH1      ARG  32  12.381   8.138   4.652
  323   1HH2  ARG  32          1HH2      ARG  32  12.315   9.767   1.560
  324   2HH2  ARG  32          2HH2      ARG  32  11.746   9.784   3.196
  325    H    LEU  33           HN       LEU  33  16.740   2.341   0.845
  326    HA   LEU  33           HA       LEU  33  19.354   1.978   1.678
  327   1HB   LEU  33          HB2       LEU  33  16.830   0.458   1.344
  328   2HB   LEU  33          HB1       LEU  33  18.248  -0.409   1.777
  329    HG   LEU  33           HG       LEU  33  16.474   0.813   3.441
  330   1HD1  LEU  33          HD11      LEU  33  19.315   0.004   4.039
  331   2HD1  LEU  33          HD12      LEU  33  17.900  -1.049   4.076
  332   3HD1  LEU  33          HD13      LEU  33  18.056   0.260   5.247
  333   1HD2  LEU  33          HD21      LEU  33  17.567   2.947   2.696
  334   2HD2  LEU  33          HD22      LEU  33  18.985   2.423   3.604
  335   3HD2  LEU  33          HD23      LEU  33  17.454   2.691   4.441
  336    H    PHE  34           HN       PHE  34  17.476   0.889  -0.959
  337    HA   PHE  34           HA       PHE  34  19.447  -0.871  -2.062
  338   1HB   PHE  34          HB2       PHE  34  16.727  -0.109  -2.616
  339   2HB   PHE  34          HB1       PHE  34  17.652  -0.427  -4.055
  340    HD1  PHE  34           HD1      PHE  34  18.095  -1.828  -0.769
  341    HD2  PHE  34           HD2      PHE  34  16.755  -2.482  -4.725
  342    HE1  PHE  34           HE1      PHE  34  17.930  -4.226  -0.303
  343    HE2  PHE  34           HE2      PHE  34  16.570  -4.880  -4.288
  344    HZ   PHE  34           HZ       PHE  34  17.156  -5.784  -2.062
  345    H    SER  35           HN       SER  35  18.663   2.348  -2.103
  346    HA   SER  35           HA       SER  35  20.222   2.880  -4.571
  347   1HB   SER  35          HB2       SER  35  17.996   4.213  -3.504
  348   2HB   SER  35          HB1       SER  35  19.356   5.303  -3.251
  349    HG   SER  35           HG       SER  35  19.137   5.766  -5.274
  350    H    LYS  36           HN       LYS  36  20.410   3.234  -1.102
  351    HA   LYS  36           HA       LYS  36  22.732   4.929  -1.213
  352   1HB   LYS  36          HB2       LYS  36  22.526   5.148   1.043
  353   2HB   LYS  36          HB1       LYS  36  20.897   4.611   0.676
  354   1HG   LYS  36          HG2       LYS  36  21.354   2.411   1.433
  355   2HG   LYS  36          HG1       LYS  36  23.087   2.734   1.528
  356   1HD   LYS  36          HD2       LYS  36  22.015   2.756   3.741
  357   2HD   LYS  36          HD1       LYS  36  22.721   4.319   3.327
  358   1HE   LYS  36          HE2       LYS  36  19.892   3.915   2.580
  359   2HE   LYS  36          HE1       LYS  36  20.236   4.024   4.305
  360   1HZ   LYS  36          HZ1       LYS  36  21.261   6.147   3.978
  361   2HZ   LYS  36          HZ2       LYS  36  19.727   6.185   3.265
  362   3HZ   LYS  36          HZ3       LYS  36  21.105   6.030   2.296
  363    H    HIS  37           HN       HIS  37  22.109   1.577  -1.202
  364    HA   HIS  37           HA       HIS  37  24.716   0.745  -0.365
  365   1HB   HIS  37          HB2       HIS  37  22.188  -0.498  -0.983
  366   2HB   HIS  37          HB1       HIS  37  23.500  -1.352  -1.772
  367    HD1  HIS  37           HD1      HIS  37  24.480  -3.140  -0.373
  368    HD2  HIS  37           HD2      HIS  37  22.890  -0.066   1.925
  369    HE1  HIS  37           HE1      HIS  37  24.803  -3.853   2.016
  370    HE2  HIS  37           HE2      HIS  37  23.921  -1.934   3.390
  371    H    GLU  38           HN       GLU  38  23.009   0.801  -3.481
  372    HA   GLU  38           HA       GLU  38  25.473   0.181  -4.883
  373   1HB   GLU  38          HB2       GLU  38  22.589   0.155  -5.516
  374   2HB   GLU  38          HB1       GLU  38  23.647   0.601  -6.845
  375   1HG   GLU  38          HG2       GLU  38  24.962  -1.505  -6.290
  376   2HG   GLU  38          HG1       GLU  38  23.584  -1.958  -5.289
  Start of MODEL    3
    1   1H    VAL   1          HT1       VAL   1 -29.019  -4.815   4.666
    2   2H    VAL   1          HT2       VAL   1 -29.270  -5.693   6.119
    3   3H    VAL   1          HT3       VAL   1 -27.675  -5.371   5.573
    4    HA   VAL   1           HA       VAL   1 -29.656  -3.550   6.718
    5    HB   VAL   1           HB       VAL   1 -26.772  -3.424   7.380
    6   1HG1  VAL   1          HG11      VAL   1 -28.674  -3.689   9.553
    7   2HG1  VAL   1          HG12      VAL   1 -29.139  -2.424   8.416
    8   3HG1  VAL   1          HG13      VAL   1 -27.554  -2.378   9.186
    9   1HG2  VAL   1          HG21      VAL   1 -26.780  -5.745   7.433
   10   2HG2  VAL   1          HG22      VAL   1 -28.462  -5.829   7.954
   11   3HG2  VAL   1          HG23      VAL   1 -27.212  -5.320   9.089
   12    H    MET   2           HN       MET   2 -28.484  -1.284   7.001
   13    HA   MET   2           HA       MET   2 -28.232  -0.227   4.389
   14   1HB   MET   2          HB2       MET   2 -28.362   0.778   7.160
   15   2HB   MET   2          HB1       MET   2 -27.522   1.799   6.019
   16   1HG   MET   2          HG2       MET   2 -30.165   0.724   5.244
   17   2HG   MET   2          HG1       MET   2 -30.108   2.014   6.444
   18   1HE   MET   2          HE1       MET   2 -27.854   2.680   2.496
   19   2HE   MET   2          HE2       MET   2 -28.521   1.091   2.870
   20   3HE   MET   2          HE3       MET   2 -27.275   1.788   3.905
   21    HA   PRO   3           HA       PRO   3 -23.652   0.372   5.517
   22   1HB   PRO   3          HB2       PRO   3 -22.734   0.012   7.960
   23   2HB   PRO   3          HB1       PRO   3 -23.936   1.274   7.705
   24   1HG   PRO   3          HG2       PRO   3 -24.363  -1.537   8.655
   25   2HG   PRO   3          HG1       PRO   3 -24.891  -0.024   9.428
   26   1HD   PRO   3          HD2       PRO   3 -26.486  -1.509   7.748
   27   2HD   PRO   3          HD1       PRO   3 -26.657   0.245   7.969
   28    H    LYS   4           HN       LYS   4 -21.822  -1.383   7.057
   29    HA   LYS   4           HA       LYS   4 -20.879  -3.439   7.068
   30   1HB   LYS   4          HB2       LYS   4 -23.247  -4.189   7.559
   31   2HB   LYS   4          HB1       LYS   4 -23.411  -4.515   5.841
   32   1HG   LYS   4          HG2       LYS   4 -21.020  -5.750   6.758
   33   2HG   LYS   4          HG1       LYS   4 -22.334  -6.183   7.854
   34   1HD   LYS   4          HD2       LYS   4 -22.338  -7.830   6.160
   35   2HD   LYS   4          HD1       LYS   4 -23.685  -6.752   5.785
   36   1HE   LYS   4          HE2       LYS   4 -22.284  -5.580   4.152
   37   2HE   LYS   4          HE1       LYS   4 -20.946  -6.666   4.524
   38   1HZ   LYS   4          HZ1       LYS   4 -21.767  -7.815   2.797
   39   2HZ   LYS   4          HZ2       LYS   4 -23.308  -7.126   2.910
   40   3HZ   LYS   4          HZ3       LYS   4 -22.878  -8.409   3.926
   41    H    GLN   5           HN       GLN   5 -22.475  -2.315   4.154
   42    HA   GLN   5           HA       GLN   5 -20.660  -3.898   2.530
   43   1HB   GLN   5          HB2       GLN   5 -22.413  -3.927   1.110
   44   2HB   GLN   5          HB1       GLN   5 -23.298  -2.898   2.218
   45   1HG   GLN   5          HG2       GLN   5 -23.400  -1.691   0.307
   46   2HG   GLN   5          HG1       GLN   5 -22.004  -0.966   1.059
   47   1HE2  GLN   5          HE21      GLN   5 -20.249  -3.123   0.376
   48   2HE2  GLN   5          HE22      GLN   5 -20.045  -3.053  -1.317
   49    H    ILE   6           HN       ILE   6 -21.195  -0.732   3.698
   50    HA   ILE   6           HA       ILE   6 -19.247   0.475   1.971
   51    HB   ILE   6           HB       ILE   6 -19.666   2.454   3.590
   52   1HG1  ILE   6          HG12      ILE   6 -21.890   2.539   4.550
   53   2HG1  ILE   6          HG11      ILE   6 -22.228   0.907   4.037
   54   1HG2  ILE   6          HG21      ILE   6 -21.747   1.518   1.651
   55   2HG2  ILE   6          HG22      ILE   6 -20.238   2.336   1.238
   56   3HG2  ILE   6          HG23      ILE   6 -21.480   3.187   2.162
   57   1HD1  ILE   6          HD11      ILE   6 -19.844   1.269   5.729
   58   2HD1  ILE   6          HD12      ILE   6 -21.083   0.012   5.767
   59   3HD1  ILE   6          HD13      ILE   6 -21.400   1.585   6.496
   60    H    VAL   7           HN       VAL   7 -19.578  -0.931   5.106
   61    HA   VAL   7           HA       VAL   7 -17.205   0.142   6.279
   62    HB   VAL   7           HB       VAL   7 -19.383  -0.914   7.378
   63   1HG1  VAL   7          HG11      VAL   7 -19.060  -3.136   6.382
   64   2HG1  VAL   7          HG12      VAL   7 -19.055  -3.188   8.143
   65   3HG1  VAL   7          HG13      VAL   7 -17.536  -3.294   7.253
   66   1HG2  VAL   7          HG21      VAL   7 -17.428   0.169   8.451
   67   2HG2  VAL   7          HG22      VAL   7 -16.681  -1.423   8.564
   68   3HG2  VAL   7          HG23      VAL   7 -18.193  -1.094   9.410
   69    H    TYR   8           HN       TYR   8 -18.277  -2.720   4.638
   70    HA   TYR   8           HA       TYR   8 -15.970  -4.342   4.751
   71   1HB   TYR   8          HB2       TYR   8 -18.491  -4.507   3.595
   72   2HB   TYR   8          HB1       TYR   8 -17.405  -4.441   2.211
   73    HD1  TYR   8           HD1      TYR   8 -16.974  -5.906   5.573
   74    HD2  TYR   8           HD2      TYR   8 -17.203  -6.612   1.404
   75    HE1  TYR   8           HE1      TYR   8 -16.324  -8.142   5.941
   76    HE2  TYR   8           HE2      TYR   8 -16.565  -8.909   1.756
   77    HH   TYR   8           HH       TYR   8 -16.664 -10.442   4.672
   78    H    TRP   9           HN       TRP   9 -17.226  -1.951   2.494
   79    HA   TRP   9           HA       TRP   9 -15.118  -1.932   0.615
   80   1HB   TRP   9          HB2       TRP   9 -17.408  -0.240   1.371
   81   2HB   TRP   9          HB1       TRP   9 -16.036   0.673   0.743
   82    HD1  TRP   9           HD1      TRP   9 -18.969  -1.107  -0.380
   83    HE1  TRP   9           HE1      TRP   9 -18.769  -1.497  -2.950
   84    HE3  TRP   9           HE3      TRP   9 -14.169  -0.001  -0.931
   85    HZ2  TRP   9           HZ2      TRP   9 -16.801  -1.336  -4.924
   86    HZ3  TRP   9           HZ3      TRP   9 -13.128  -0.109  -3.168
   87    HH2  TRP   9           HH2      TRP   9 -14.453  -0.778  -5.123
   88    H    LYS  10           HN       LYS  10 -16.000   0.301   3.059
   89    HA   LYS  10           HA       LYS  10 -13.794   1.906   3.239
   90   1HB   LYS  10          HB2       LYS  10 -15.787   2.472   4.411
   91   2HB   LYS  10          HB1       LYS  10 -15.739   0.984   5.343
   92   1HG   LYS  10          HG2       LYS  10 -13.366   2.159   5.987
   93   2HG   LYS  10          HG1       LYS  10 -14.451   3.538   5.825
   94   1HD   LYS  10          HD2       LYS  10 -15.911   2.715   7.477
   95   2HD   LYS  10          HD1       LYS  10 -15.191   1.104   7.419
   96   1HE   LYS  10          HE2       LYS  10 -13.342   3.282   8.119
   97   2HE   LYS  10          HE1       LYS  10 -14.618   2.976   9.296
   98   1HZ   LYS  10          HZ1       LYS  10 -12.718   1.648   9.830
   99   2HZ   LYS  10          HZ2       LYS  10 -12.649   1.006   8.266
  100   3HZ   LYS  10          HZ3       LYS  10 -13.944   0.619   9.283
  101    H    GLN  11           HN       GLN  11 -14.391  -1.076   5.113
  102    HA   GLN  11           HA       GLN  11 -11.821  -0.944   6.364
  103   1HB   GLN  11          HB2       GLN  11 -12.362  -3.009   7.380
  104   2HB   GLN  11          HB1       GLN  11 -13.877  -2.133   7.284
  105   1HG   GLN  11          HG2       GLN  11 -14.560  -3.430   5.382
  106   2HG   GLN  11          HG1       GLN  11 -12.994  -4.216   5.311
  107   1HE2  GLN  11          HE21      GLN  11 -13.469  -4.041   8.539
  108   2HE2  GLN  11          HE22      GLN  11 -14.315  -5.522   8.791
  109    H    TRP  12           HN       TRP  12 -12.506  -1.410   3.298
  110    HA   TRP  12           HA       TRP  12 -10.316  -3.325   2.837
  111   1HB   TRP  12          HB2       TRP  12 -12.659  -3.774   1.902
  112   2HB   TRP  12          HB1       TRP  12 -12.376  -2.473   0.808
  113    HD1  TRP  12           HD1      TRP  12 -11.720  -6.030   1.252
  114    HE1  TRP  12           HE1      TRP  12 -10.138  -6.849  -0.587
  115    HE3  TRP  12           HE3      TRP  12 -10.461  -1.592  -0.515
  116    HZ2  TRP  12           HZ2      TRP  12  -8.544  -5.686  -2.611
  117    HZ3  TRP  12           HZ3      TRP  12  -8.887  -1.406  -2.448
  118    HH2  TRP  12           HH2      TRP  12  -7.940  -3.465  -3.477
  119    H    LEU  13           HN       LEU  13 -11.587  -0.114   1.960
  120    HA   LEU  13           HA       LEU  13  -9.115   0.389   0.478
  121   1HB   LEU  13          HB2       LEU  13 -11.351   0.950  -0.532
  122   2HB   LEU  13          HB1       LEU  13 -11.555   2.156   0.724
  123    HG   LEU  13           HG       LEU  13  -9.123   2.858  -0.312
  124   1HD1  LEU  13          HD11      LEU  13  -8.916   2.441  -2.515
  125   2HD1  LEU  13          HD12      LEU  13 -10.655   2.504  -2.802
  126   3HD1  LEU  13          HD13      LEU  13  -9.924   1.045  -2.133
  127   1HD2  LEU  13          HD21      LEU  13 -10.358   4.671  -1.433
  128   2HD2  LEU  13          HD22      LEU  13 -10.924   4.387   0.213
  129   3HD2  LEU  13          HD23      LEU  13 -11.863   3.793  -1.157
  130    H    SER  14           HN       SER  14 -10.293   0.700   3.581
  131    HA   SER  14           HA       SER  14  -8.938   3.210   4.106
  132   1HB   SER  14          HB2       SER  14 -11.105   2.048   5.325
  133   2HB   SER  14          HB1       SER  14  -9.808   1.624   6.429
  134    HG   SER  14           HG       SER  14  -9.755   3.614   7.076
  135    H    LEU  15           HN       LEU  15  -8.679  -0.197   4.866
  136    HA   LEU  15           HA       LEU  15  -6.147   0.144   6.155
  137   1HB   LEU  15          HB2       LEU  15  -7.603  -2.378   5.393
  138   2HB   LEU  15          HB1       LEU  15  -6.272  -2.229   6.519
  139    HG   LEU  15           HG       LEU  15  -8.069  -2.363   7.955
  140   1HD1  LEU  15          HD11      LEU  15  -8.485  -0.162   8.876
  141   2HD1  LEU  15          HD12      LEU  15  -7.939   0.590   7.374
  142   3HD1  LEU  15          HD13      LEU  15  -6.791  -0.287   8.391
  143   1HD2  LEU  15          HD21      LEU  15  -9.448  -1.534   5.618
  144   2HD2  LEU  15          HD22      LEU  15  -9.988  -0.546   6.984
  145   3HD2  LEU  15          HD23      LEU  15 -10.095  -2.306   7.072
  146    H    ARG  16           HN       ARG  16  -7.282  -1.747   3.391
  147    HA   ARG  16           HA       ARG  16  -4.856  -2.540   2.377
  148   1HB   ARG  16          HB2       ARG  16  -7.418  -1.839   1.039
  149   2HB   ARG  16          HB1       ARG  16  -6.034  -2.259   0.065
  150   1HG   ARG  16          HG2       ARG  16  -7.442  -3.963   2.096
  151   2HG   ARG  16          HG1       ARG  16  -7.351  -4.216   0.352
  152   1HD   ARG  16          HD2       ARG  16  -4.811  -4.348   0.713
  153   2HD   ARG  16          HD1       ARG  16  -5.203  -4.545   2.421
  154    HE   ARG  16           HE       ARG  16  -6.734  -6.421   1.216
  155   1HH1  ARG  16          1HH1      ARG  16  -3.331  -5.661   1.062
  156   2HH1  ARG  16          2HH1      ARG  16  -2.854  -7.294   0.742
  157   1HH2  ARG  16          1HH2      ARG  16  -6.107  -8.569   0.795
  158   2HH2  ARG  16          2HH2      ARG  16  -4.428  -8.946   0.591
  159    H    ASN  17           HN       ASN  17  -6.232   0.580   2.306
  160    HA   ASN  17           HA       ASN  17  -4.732   1.753   0.264
  161   1HB   ASN  17          HB2       ASN  17  -6.571   2.544   2.326
  162   2HB   ASN  17          HB1       ASN  17  -5.331   3.723   2.127
  163   1HD2  ASN  17          HD21      ASN  17  -7.416   4.851   1.538
  164   2HD2  ASN  17          HD22      ASN  17  -7.806   4.864  -0.136
  165    HA   PRO  18           HA       PRO  18  -1.750   3.687   3.468
  166   1HB   PRO  18          HB2       PRO  18  -1.981   2.715   6.045
  167   2HB   PRO  18          HB1       PRO  18  -2.574   4.277   5.478
  168   1HG   PRO  18          HG2       PRO  18  -4.023   1.690   5.722
  169   2HG   PRO  18          HG1       PRO  18  -4.566   3.323   6.155
  170   1HD   PRO  18          HD2       PRO  18  -5.390   2.231   3.901
  171   2HD   PRO  18          HD1       PRO  18  -4.884   3.928   3.921
  172    H    ILE  19           HN       ILE  19  -2.838   0.481   3.507
  173    HA   ILE  19           HA       ILE  19  -0.455  -0.701   4.543
  174    HB   ILE  19           HB       ILE  19  -2.795  -1.877   3.080
  175   1HG1  ILE  19          HG12      ILE  19  -1.884  -1.657   5.918
  176   2HG1  ILE  19          HG11      ILE  19  -3.475  -1.376   5.242
  177   1HG2  ILE  19          HG21      ILE  19  -0.842  -3.206   2.490
  178   2HG2  ILE  19          HG22      ILE  19  -1.876  -4.100   3.602
  179   3HG2  ILE  19          HG23      ILE  19  -0.398  -3.339   4.192
  180   1HD1  ILE  19          HD11      ILE  19  -2.194  -4.062   5.662
  181   2HD1  ILE  19          HD12      ILE  19  -3.793  -3.781   4.972
  182   3HD1  ILE  19          HD13      ILE  19  -3.467  -3.343   6.649
  183    H    LEU  20           HN       LEU  20  -1.656  -0.096   1.344
  184    HA   LEU  20           HA       LEU  20   0.418  -1.460  -0.038
  185   1HB   LEU  20          HB2       LEU  20  -0.351  -0.436  -2.032
  186   2HB   LEU  20          HB1       LEU  20  -1.761  -0.856  -1.086
  187    HG   LEU  20           HG       LEU  20  -1.030   1.831  -0.468
  188   1HD1  LEU  20          HD11      LEU  20  -1.612   1.511  -3.386
  189   2HD1  LEU  20          HD12      LEU  20   0.047   1.571  -2.789
  190   3HD1  LEU  20          HD13      LEU  20  -1.040   2.934  -2.516
  191   1HD2  LEU  20          HD21      LEU  20  -3.283   2.267  -1.089
  192   2HD2  LEU  20          HD22      LEU  20  -3.219   0.701  -0.278
  193   3HD2  LEU  20          HD23      LEU  20  -3.363   0.778  -2.035
  194    H    VAL  21           HN       VAL  21  -0.186   1.740   1.102
  195    HA   VAL  21           HA       VAL  21   1.980   3.147   0.129
  196    HB   VAL  21           HB       VAL  21   0.291   3.148   2.549
  197   1HG1  VAL  21          HG11      VAL  21   1.457   4.918   3.564
  198   2HG1  VAL  21          HG12      VAL  21   2.499   5.124   2.153
  199   3HG1  VAL  21          HG13      VAL  21   2.641   3.673   3.152
  200   1HG2  VAL  21          HG21      VAL  21   0.745   5.185   0.378
  201   2HG2  VAL  21          HG22      VAL  21  -0.423   5.327   1.695
  202   3HG2  VAL  21          HG23      VAL  21  -0.600   4.046   0.488
  203    H    PHE  22           HN       PHE  22   1.396   1.389   3.104
  204    HA   PHE  22           HA       PHE  22   3.832   1.602   4.394
  205   1HB   PHE  22          HB2       PHE  22   2.369   0.630   5.790
  206   2HB   PHE  22          HB1       PHE  22   1.420  -0.013   4.470
  207    HD1  PHE  22           HD1      PHE  22   4.654  -0.493   6.081
  208    HD2  PHE  22           HD2      PHE  22   1.296  -2.168   4.191
  209    HE1  PHE  22           HE1      PHE  22   5.583  -2.729   6.480
  210    HE2  PHE  22           HE2      PHE  22   2.173  -4.436   4.569
  211    HZ   PHE  22           HZ       PHE  22   4.341  -4.725   5.710
  212    H    LEU  23           HN       LEU  23   2.765  -0.358   1.749
  213    HA   LEU  23           HA       LEU  23   5.232  -2.007   1.849
  214   1HB   LEU  23          HB2       LEU  23   2.999  -1.898  -0.164
  215   2HB   LEU  23          HB1       LEU  23   4.406  -2.930  -0.339
  216    HG   LEU  23           HG       LEU  23   3.470  -3.601   2.163
  217   1HD1  LEU  23          HD11      LEU  23   1.482  -2.130   1.084
  218   2HD1  LEU  23          HD12      LEU  23   1.247  -3.398   2.299
  219   3HD1  LEU  23          HD13      LEU  23   1.009  -3.759   0.586
  220   1HD2  LEU  23          HD21      LEU  23   3.327  -5.667   1.254
  221   2HD2  LEU  23          HD22      LEU  23   4.094  -4.885  -0.128
  222   3HD2  LEU  23          HD23      LEU  23   2.346  -5.117  -0.105
  223    H    LYS  24           HN       LYS  24   3.899   0.664   0.194
  224    HA   LYS  24           HA       LYS  24   5.710   0.867  -1.935
  225   1HB   LYS  24          HB2       LYS  24   3.472   2.239  -0.842
  226   2HB   LYS  24          HB1       LYS  24   4.696   3.411  -1.209
  227   1HG   LYS  24          HG2       LYS  24   3.973   3.329  -3.310
  228   2HG   LYS  24          HG1       LYS  24   4.624   1.689  -3.377
  229   1HD   LYS  24          HD2       LYS  24   2.351   1.133  -2.156
  230   2HD   LYS  24          HD1       LYS  24   1.827   2.596  -3.000
  231   1HE   LYS  24          HE2       LYS  24   3.078   0.164  -4.277
  232   2HE   LYS  24          HE1       LYS  24   1.367   0.586  -4.320
  233   1HZ   LYS  24          HZ1       LYS  24   3.201   2.633  -5.255
  234   2HZ   LYS  24          HZ2       LYS  24   1.704   2.154  -5.877
  235   3HZ   LYS  24          HZ3       LYS  24   3.092   1.253  -6.226
  236    H    THR  25           HN       THR  25   5.561   2.214   1.253
  237    HA   THR  25           HA       THR  25   7.867   3.822   1.064
  238    HB   THR  25           HB       THR  25   6.262   4.453   2.687
  239    HG1  THR  25           HG1      THR  25   8.545   4.416   3.387
  240   1HG2  THR  25          HG21      THR  25   5.082   3.129   4.054
  241   2HG2  THR  25          HG22      THR  25   6.455   2.076   4.396
  242   3HG2  THR  25          HG23      THR  25   5.541   1.877   2.898
  243    H    ARG  26           HN       ARG  26   7.155   0.609   2.425
  244    HA   ARG  26           HA       ARG  26   9.665   0.091   3.544
  245   1HB   ARG  26          HB2       ARG  26   7.578  -1.651   2.269
  246   2HB   ARG  26          HB1       ARG  26   9.053  -2.341   2.935
  247   1HG   ARG  26          HG2       ARG  26   6.810  -0.972   4.359
  248   2HG   ARG  26          HG1       ARG  26   7.499  -2.559   4.647
  249   1HD   ARG  26          HD2       ARG  26   9.618  -1.372   5.331
  250   2HD   ARG  26          HD1       ARG  26   8.686   0.124   5.278
  251    HE   ARG  26           HE       ARG  26   8.557  -1.942   7.288
  252   1HH1  ARG  26          1HH1      ARG  26   6.910   0.767   5.827
  253   2HH1  ARG  26          2HH1      ARG  26   5.916   1.070   7.213
  254   1HH2  ARG  26          1HH2      ARG  26   7.250  -1.544   9.110
  255   2HH2  ARG  26          2HH2      ARG  26   6.109  -0.242   9.076
  256    H    VAL  27           HN       VAL  27   8.447  -0.290   0.307
  257    HA   VAL  27           HA       VAL  27  10.777  -1.436  -0.872
  258    HB   VAL  27           HB       VAL  27   8.120  -0.441  -1.686
  259   1HG1  VAL  27          HG11      VAL  27  10.443  -0.524  -3.567
  260   2HG1  VAL  27          HG12      VAL  27   9.297   0.782  -3.272
  261   3HG1  VAL  27          HG13      VAL  27   8.770  -0.677  -4.110
  262   1HG2  VAL  27          HG21      VAL  27   8.068  -2.585  -2.890
  263   2HG2  VAL  27          HG22      VAL  27   8.465  -2.780  -1.182
  264   3HG2  VAL  27          HG23      VAL  27   9.736  -2.883  -2.401
  265    H    LEU  28           HN       LEU  28   9.717   1.711  -0.069
  266    HA   LEU  28           HA       LEU  28  11.275   3.166  -1.947
  267   1HB   LEU  28          HB2       LEU  28   9.886   4.832  -1.378
  268   2HB   LEU  28          HB1       LEU  28   8.981   3.628  -0.536
  269    HG   LEU  28           HG       LEU  28  10.092   4.197   1.544
  270   1HD1  LEU  28          HD11      LEU  28  11.866   5.661  -0.214
  271   2HD1  LEU  28          HD12      LEU  28  12.094   5.162   1.461
  272   3HD1  LEU  28          HD13      LEU  28  11.257   6.670   1.097
  273   1HD2  LEU  28          HD21      LEU  28   9.269   6.878   0.708
  274   2HD2  LEU  28          HD22      LEU  28   8.613   5.827   1.964
  275   3HD2  LEU  28          HD23      LEU  28   8.127   5.603   0.284
  276    H    LYS  29           HN       LYS  29  11.148   2.622   1.479
  277    HA   LYS  29           HA       LYS  29  13.574   3.926   2.090
  278   1HB   LYS  29          HB2       LYS  29  13.337   3.122   4.303
  279   2HB   LYS  29          HB1       LYS  29  11.701   3.406   3.732
  280   1HG   LYS  29          HG2       LYS  29  11.365   1.052   3.370
  281   2HG   LYS  29          HG1       LYS  29  13.050   0.714   3.771
  282   1HD   LYS  29          HD2       LYS  29  12.178   2.112   5.965
  283   2HD   LYS  29          HD1       LYS  29  10.755   1.169   5.521
  284   1HE   LYS  29          HE2       LYS  29  11.932  -0.213   6.996
  285   2HE   LYS  29          HE1       LYS  29  12.341  -0.831   5.396
  286   1HZ   LYS  29          HZ1       LYS  29  14.178  -0.380   7.187
  287   2HZ   LYS  29          HZ2       LYS  29  14.087   1.199   6.586
  288   3HZ   LYS  29          HZ3       LYS  29  14.471  -0.080   5.547
  289    H    ARG  30           HN       ARG  30  12.710   0.886   0.904
  290    HA   ARG  30           HA       ARG  30  15.171  -0.440   1.457
  291   1HB   ARG  30          HB2       ARG  30  12.641  -0.998   0.032
  292   2HB   ARG  30          HB1       ARG  30  14.019  -1.971  -0.399
  293   1HG   ARG  30          HG2       ARG  30  13.720  -1.734   2.451
  294   2HG   ARG  30          HG1       ARG  30  12.256  -2.345   1.695
  295   1HD   ARG  30          HD2       ARG  30  15.033  -3.496   1.493
  296   2HD   ARG  30          HD1       ARG  30  13.635  -4.222   2.283
  297    HE   ARG  30           HE       ARG  30  12.873  -3.871  -0.324
  298   1HH1  ARG  30          1HH1      ARG  30  15.476  -5.534   1.300
  299   2HH1  ARG  30          2HH1      ARG  30  15.616  -6.761   0.085
  300   1HH2  ARG  30          1HH2      ARG  30  13.057  -5.482  -1.922
  301   2HH2  ARG  30          2HH2      ARG  30  14.243  -6.732  -1.745
  302    H    TRP  31           HN       TRP  31  13.663   1.446  -0.983
  303    HA   TRP  31           HA       TRP  31  15.447   1.038  -3.113
  304   1HB   TRP  31          HB2       TRP  31  12.972   2.248  -2.577
  305   2HB   TRP  31          HB1       TRP  31  14.004   3.476  -3.194
  306    HD1  TRP  31           HD1      TRP  31  12.273   0.425  -4.151
  307    HE1  TRP  31           HE1      TRP  31  12.537   0.052  -6.679
  308    HE3  TRP  31           HE3      TRP  31  15.612   3.873  -4.840
  309    HZ2  TRP  31           HZ2      TRP  31  14.095   1.208  -8.748
  310    HZ3  TRP  31           HZ3      TRP  31  16.570   4.313  -7.126
  311    HH2  TRP  31           HH2      TRP  31  15.810   2.977  -9.050
  312    H    ARG  32           HN       ARG  32  14.847   3.349  -0.496
  313    HA   ARG  32           HA       ARG  32  16.824   5.250  -1.041
  314   1HB   ARG  32          HB2       ARG  32  15.624   4.165   1.480
  315   2HB   ARG  32          HB1       ARG  32  16.547   5.668   1.404
  316   1HG   ARG  32          HG2       ARG  32  14.088   5.217  -0.254
  317   2HG   ARG  32          HG1       ARG  32  14.014   5.839   1.374
  318   1HD   ARG  32          HD2       ARG  32  15.747   7.019  -0.741
  319   2HD   ARG  32          HD1       ARG  32  14.064   7.496  -0.548
  320    HE   ARG  32           HE       ARG  32  16.283   8.218   1.148
  321   1HH1  ARG  32          1HH1      ARG  32  12.814   7.898   0.928
  322   2HH1  ARG  32          2HH1      ARG  32  12.504   9.024   2.206
  323   1HH2  ARG  32          1HH2      ARG  32  15.876   9.700   2.831
  324   2HH2  ARG  32          2HH2      ARG  32  14.242  10.047   3.286
  325    H    LEU  33           HN       LEU  33  16.677   2.478   1.042
  326    HA   LEU  33           HA       LEU  33  19.227   2.297   2.044
  327   1HB   LEU  33          HB2       LEU  33  16.870   0.580   1.527
  328   2HB   LEU  33          HB1       LEU  33  18.312  -0.179   2.067
  329    HG   LEU  33           HG       LEU  33  16.338   0.911   3.601
  330   1HD1  LEU  33          HD11      LEU  33  17.727   0.374   5.500
  331   2HD1  LEU  33          HD12      LEU  33  19.171   0.400   4.489
  332   3HD1  LEU  33          HD13      LEU  33  17.952  -0.853   4.254
  333   1HD2  LEU  33          HD21      LEU  33  17.097   2.859   4.639
  334   2HD2  LEU  33          HD22      LEU  33  17.357   3.113   2.911
  335   3HD2  LEU  33          HD23      LEU  33  18.714   2.686   3.951
  336    H    PHE  34           HN       PHE  34  17.694   1.022  -0.736
  337    HA   PHE  34           HA       PHE  34  19.847  -0.581  -1.654
  338   1HB   PHE  34          HB2       PHE  34  17.214   0.159  -2.538
  339   2HB   PHE  34          HB1       PHE  34  18.321  -0.077  -3.856
  340    HD1  PHE  34           HD1      PHE  34  17.520  -2.098  -4.727
  341    HD2  PHE  34           HD2      PHE  34  18.400  -1.644  -0.617
  342    HE1  PHE  34           HE1      PHE  34  17.323  -4.516  -4.437
  343    HE2  PHE  34           HE2      PHE  34  18.214  -4.062  -0.295
  344    HZ   PHE  34           HZ       PHE  34  17.666  -5.532  -2.208
  345    H    SER  35           HN       SER  35  18.945   2.612  -1.687
  346    HA   SER  35           HA       SER  35  20.851   3.312  -3.846
  347   1HB   SER  35          HB2       SER  35  18.425   4.482  -3.152
  348   2HB   SER  35          HB1       SER  35  19.638   5.622  -2.572
  349    HG   SER  35           HG       SER  35  18.804   5.315  -5.028
  350    H    LYS  36           HN       LYS  36  20.577   3.439  -0.356
  351    HA   LYS  36           HA       LYS  36  22.814   5.261  -0.118
  352   1HB   LYS  36          HB2       LYS  36  21.688   3.631   2.132
  353   2HB   LYS  36          HB1       LYS  36  22.522   5.172   2.221
  354   1HG   LYS  36          HG2       LYS  36  19.711   4.575   1.464
  355   2HG   LYS  36          HG1       LYS  36  20.330   5.718   2.647
  356   1HD   LYS  36          HD2       LYS  36  21.148   7.165   0.876
  357   2HD   LYS  36          HD1       LYS  36  20.623   6.005  -0.344
  358   1HE   LYS  36          HE2       LYS  36  18.841   7.424  -0.391
  359   2HE   LYS  36          HE1       LYS  36  18.299   6.324   0.875
  360   1HZ   LYS  36          HZ1       LYS  36  19.853   8.713   1.598
  361   2HZ   LYS  36          HZ2       LYS  36  18.713   7.861   2.511
  362   3HZ   LYS  36          HZ3       LYS  36  18.204   8.868   1.252
  363    H    HIS  37           HN       HIS  37  22.168   1.881   0.328
  364    HA   HIS  37           HA       HIS  37  24.735   1.169   1.290
  365   1HB   HIS  37          HB2       HIS  37  22.275  -0.170   0.686
  366   2HB   HIS  37          HB1       HIS  37  23.600  -1.056  -0.040
  367    HD1  HIS  37           HD1      HIS  37  24.605  -2.736   1.475
  368    HD2  HIS  37           HD2      HIS  37  22.921   0.435   3.565
  369    HE1  HIS  37           HE1      HIS  37  24.905  -3.302   3.907
  370    HE2  HIS  37           HE2      HIS  37  23.808  -1.406   5.153
  371    H    GLU  38           HN       GLU  38  23.421   1.592  -1.920
  372    HA   GLU  38           HA       GLU  38  25.791   0.426  -3.140
  373   1HB   GLU  38          HB2       GLU  38  23.069   1.172  -4.054
  374   2HB   GLU  38          HB1       GLU  38  24.360   1.279  -5.236
  375   1HG   GLU  38          HG2       GLU  38  24.787  -0.999  -5.169
  376   2HG   GLU  38          HG1       GLU  38  23.999  -1.194  -3.603
  Start of MODEL    4
    1   1H    VAL   1          HT1       VAL   1 -27.309   1.482  -0.819
    2   2H    VAL   1          HT2       VAL   1 -26.413   2.580  -1.784
    3   3H    VAL   1          HT3       VAL   1 -26.447   2.764  -0.078
    4    HA   VAL   1           HA       VAL   1 -25.162   0.663  -1.675
    5    HB   VAL   1           HB       VAL   1 -23.166   1.356  -0.385
    6   1HG1  VAL   1          HG11      VAL   1 -23.272   3.846  -1.426
    7   2HG1  VAL   1          HG12      VAL   1 -24.593   3.072  -2.302
    8   3HG1  VAL   1          HG13      VAL   1 -22.969   2.390  -2.374
    9   1HG2  VAL   1          HG21      VAL   1 -24.813   3.703   0.539
   10   2HG2  VAL   1          HG22      VAL   1 -23.147   3.315   0.972
   11   3HG2  VAL   1          HG23      VAL   1 -24.468   2.295   1.542
   12    H    MET   2           HN       MET   2 -24.689  -1.258  -0.728
   13    HA   MET   2           HA       MET   2 -26.148  -2.061   1.531
   14   1HB   MET   2          HB2       MET   2 -24.301  -3.254  -0.410
   15   2HB   MET   2          HB1       MET   2 -24.295  -4.014   1.164
   16   1HG   MET   2          HG2       MET   2 -26.726  -4.316   1.013
   17   2HG   MET   2          HG1       MET   2 -26.689  -3.580  -0.588
   18   1HE   MET   2          HE1       MET   2 -25.366  -4.450  -2.535
   19   2HE   MET   2          HE2       MET   2 -26.906  -5.301  -2.654
   20   3HE   MET   2          HE3       MET   2 -25.396  -6.170  -2.925
   21    HA   PRO   3           HA       PRO   3 -23.559  -0.353   4.777
   22   1HB   PRO   3          HB2       PRO   3 -24.409  -2.425   6.528
   23   2HB   PRO   3          HB1       PRO   3 -25.001  -0.772   6.450
   24   1HG   PRO   3          HG2       PRO   3 -26.124  -3.238   5.268
   25   2HG   PRO   3          HG1       PRO   3 -26.959  -1.771   5.814
   26   1HD   PRO   3          HD2       PRO   3 -26.665  -2.314   3.219
   27   2HD   PRO   3          HD1       PRO   3 -26.534  -0.647   3.822
   28    H    LYS   4           HN       LYS   4 -23.612  -3.669   3.843
   29    HA   LYS   4           HA       LYS   4 -21.092  -4.240   5.212
   30   1HB   LYS   4          HB2       LYS   4 -22.892  -6.038   3.592
   31   2HB   LYS   4          HB1       LYS   4 -21.501  -6.560   4.532
   32   1HG   LYS   4          HG2       LYS   4 -22.603  -5.858   6.585
   33   2HG   LYS   4          HG1       LYS   4 -23.991  -5.288   5.655
   34   1HD   LYS   4          HD2       LYS   4 -23.758  -7.846   4.759
   35   2HD   LYS   4          HD1       LYS   4 -23.223  -8.016   6.432
   36   1HE   LYS   4          HE2       LYS   4 -25.285  -7.684   7.245
   37   2HE   LYS   4          HE1       LYS   4 -25.613  -6.364   6.124
   38   1HZ   LYS   4          HZ1       LYS   4 -26.634  -8.926   6.030
   39   2HZ   LYS   4          HZ2       LYS   4 -25.534  -8.841   4.748
   40   3HZ   LYS   4          HZ3       LYS   4 -26.796  -7.720   4.854
   41    H    GLN   5           HN       GLN   5 -22.221  -3.409   2.078
   42    HA   GLN   5           HA       GLN   5 -19.907  -4.549   0.788
   43   1HB   GLN   5          HB2       GLN   5 -21.350  -4.674  -0.930
   44   2HB   GLN   5          HB1       GLN   5 -22.532  -3.823   0.040
   45   1HG   GLN   5          HG2       GLN   5 -22.431  -2.511  -1.799
   46   2HG   GLN   5          HG1       GLN   5 -21.303  -1.693  -0.750
   47   1HE2  GLN   5          HE21      GLN   5 -19.206  -3.622  -1.206
   48   2HE2  GLN   5          HE22      GLN   5 -18.697  -3.387  -2.819
   49    H    ILE   6           HN       ILE   6 -20.998  -1.502   1.991
   50    HA   ILE   6           HA       ILE   6 -18.878  -0.086   0.646
   51    HB   ILE   6           HB       ILE   6 -19.697   1.813   2.170
   52   1HG1  ILE   6          HG12      ILE   6 -22.032   1.721   2.785
   53   2HG1  ILE   6          HG11      ILE   6 -22.156   0.076   2.229
   54   1HG2  ILE   6          HG21      ILE   6 -19.893   1.763  -0.216
   55   2HG2  ILE   6          HG22      ILE   6 -21.384   2.395   0.492
   56   3HG2  ILE   6          HG23      ILE   6 -21.319   0.732  -0.099
   57   1HD1  ILE   6          HD11      ILE   6 -21.052  -0.744   4.044
   58   2HD1  ILE   6          HD12      ILE   6 -21.822   0.664   4.764
   59   3HD1  ILE   6          HD13      ILE   6 -20.123   0.728   4.286
   60    H    VAL   7           HN       VAL   7 -19.586  -1.598   3.665
   61    HA   VAL   7           HA       VAL   7 -17.511  -0.377   5.204
   62    HB   VAL   7           HB       VAL   7 -19.720  -1.591   5.980
   63   1HG1  VAL   7          HG11      VAL   7 -19.391  -3.880   6.700
   64   2HG1  VAL   7          HG12      VAL   7 -17.766  -3.887   6.013
   65   3HG1  VAL   7          HG13      VAL   7 -19.171  -3.760   4.954
   66   1HG2  VAL   7          HG21      VAL   7 -17.214  -2.087   7.524
   67   2HG2  VAL   7          HG22      VAL   7 -18.831  -1.738   8.133
   68   3HG2  VAL   7          HG23      VAL   7 -17.909  -0.484   7.307
   69    H    TYR   8           HN       TYR   8 -18.102  -3.257   3.358
   70    HA   TYR   8           HA       TYR   8 -15.720  -4.714   3.781
   71   1HB   TYR   8          HB2       TYR   8 -18.010  -4.990   2.212
   72   2HB   TYR   8          HB1       TYR   8 -16.705  -4.826   1.044
   73    HD1  TYR   8           HD1      TYR   8 -16.264  -6.969   0.249
   74    HD2  TYR   8           HD2      TYR   8 -16.752  -6.344   4.409
   75    HE1  TYR   8           HE1      TYR   8 -15.554  -9.232   0.670
   76    HE2  TYR   8           HE2      TYR   8 -16.048  -8.552   4.848
   77    HH   TYR   8           HH       TYR   8 -15.928 -10.762   3.699
   78    H    TRP   9           HN       TRP   9 -16.806  -2.351   1.402
   79    HA   TRP   9           HA       TRP   9 -14.455  -2.087  -0.129
   80   1HB   TRP   9          HB2       TRP   9 -16.944  -0.582   0.341
   81   2HB   TRP   9          HB1       TRP   9 -15.561   0.445  -0.038
   82    HD1  TRP   9           HD1      TRP   9 -18.182  -1.402  -1.665
   83    HE1  TRP   9           HE1      TRP   9 -17.577  -1.671  -4.187
   84    HE3  TRP   9           HE3      TRP   9 -13.408  -0.084  -1.436
   85    HZ2  TRP   9           HZ2      TRP   9 -15.344  -1.346  -5.830
   86    HZ3  TRP   9           HZ3      TRP   9 -12.040  -0.050  -3.487
   87    HH2  TRP   9           HH2      TRP   9 -13.021  -0.683  -5.647
   88    H    LYS  10           HN       LYS  10 -15.836  -0.022   2.230
   89    HA   LYS  10           HA       LYS  10 -13.800   1.714   2.783
   90   1HB   LYS  10          HB2       LYS  10 -15.971   2.105   3.670
   91   2HB   LYS  10          HB1       LYS  10 -15.964   0.580   4.542
   92   1HG   LYS  10          HG2       LYS  10 -13.792   1.870   5.575
   93   2HG   LYS  10          HG1       LYS  10 -14.939   3.182   5.310
   94   1HD   LYS  10          HD2       LYS  10 -16.559   2.183   6.697
   95   2HD   LYS  10          HD1       LYS  10 -15.723   0.630   6.685
   96   1HE   LYS  10          HE2       LYS  10 -14.565   3.135   7.892
   97   2HE   LYS  10          HE1       LYS  10 -15.506   1.960   8.810
   98   1HZ   LYS  10          HZ1       LYS  10 -13.828   0.478   8.805
   99   2HZ   LYS  10          HZ2       LYS  10 -12.867   1.853   8.583
  100   3HZ   LYS  10          HZ3       LYS  10 -13.293   0.894   7.255
  101    H    GLN  11           HN       GLN  11 -14.438  -1.383   4.450
  102    HA   GLN  11           HA       GLN  11 -12.057  -1.122   6.038
  103   1HB   GLN  11          HB2       GLN  11 -12.618  -3.229   6.956
  104   2HB   GLN  11          HB1       GLN  11 -14.150  -2.427   6.677
  105   1HG   GLN  11          HG2       GLN  11 -14.499  -3.717   4.668
  106   2HG   GLN  11          HG1       GLN  11 -12.914  -4.448   4.832
  107   1HE2  GLN  11          HE21      GLN  11 -13.867  -4.314   7.952
  108   2HE2  GLN  11          HE22      GLN  11 -14.694  -5.823   8.072
  109    H    TRP  12           HN       TRP  12 -12.308  -1.534   2.912
  110    HA   TRP  12           HA       TRP  12  -9.991  -3.342   2.695
  111   1HB   TRP  12          HB2       TRP  12 -12.169  -3.900   1.474
  112   2HB   TRP  12          HB1       TRP  12 -11.831  -2.566   0.440
  113    HD1  TRP  12           HD1      TRP  12 -11.031  -6.088   0.920
  114    HE1  TRP  12           HE1      TRP  12  -9.193  -6.785  -0.723
  115    HE3  TRP  12           HE3      TRP  12  -9.821  -1.556  -0.633
  116    HZ2  TRP  12           HZ2      TRP  12  -7.436  -5.500  -2.525
  117    HZ3  TRP  12           HZ3      TRP  12  -8.039  -1.249  -2.357
  118    HH2  TRP  12           HH2      TRP  12  -6.859  -3.234  -3.286
  119    H    LEU  13           HN       LEU  13 -11.313  -0.185   1.706
  120    HA   LEU  13           HA       LEU  13  -8.725   0.469   0.523
  121   1HB   LEU  13          HB2       LEU  13 -10.886   0.948  -0.698
  122   2HB   LEU  13          HB1       LEU  13 -11.240   2.141   0.539
  123    HG   LEU  13           HG       LEU  13  -8.962   3.182  -0.122
  124   1HD1  LEU  13          HD11      LEU  13  -9.496   1.972  -2.789
  125   2HD1  LEU  13          HD12      LEU  13  -8.565   1.055  -1.605
  126   3HD1  LEU  13          HD13      LEU  13  -8.004   2.643  -2.130
  127   1HD2  LEU  13          HD21      LEU  13 -10.744   4.533  -0.596
  128   2HD2  LEU  13          HD22      LEU  13 -11.562   3.304  -1.562
  129   3HD2  LEU  13          HD23      LEU  13 -10.185   4.180  -2.232
  130    H    SER  14           HN       SER  14 -10.288   0.676   3.472
  131    HA   SER  14           HA       SER  14  -9.106   3.220   4.195
  132   1HB   SER  14          HB2       SER  14 -11.332   1.932   5.148
  133   2HB   SER  14          HB1       SER  14 -10.141   1.530   6.375
  134    HG   SER  14           HG       SER  14  -9.868   3.657   6.822
  135    H    LEU  15           HN       LEU  15  -8.782  -0.186   4.962
  136    HA   LEU  15           HA       LEU  15  -6.415   0.244   6.514
  137   1HB   LEU  15          HB2       LEU  15  -7.641  -2.333   5.553
  138   2HB   LEU  15          HB1       LEU  15  -6.464  -2.136   6.833
  139    HG   LEU  15           HG       LEU  15  -8.410  -2.405   8.039
  140   1HD1  LEU  15          HD11      LEU  15  -8.374   0.567   7.539
  141   2HD1  LEU  15          HD12      LEU  15  -7.314  -0.278   8.671
  142   3HD1  LEU  15          HD13      LEU  15  -9.057  -0.253   8.944
  143   1HD2  LEU  15          HD21      LEU  15 -10.297  -0.665   6.865
  144   2HD2  LEU  15          HD22      LEU  15 -10.324  -2.429   6.935
  145   3HD2  LEU  15          HD23      LEU  15  -9.550  -1.607   5.569
  146    H    ARG  16           HN       ARG  16  -7.142  -1.623   3.604
  147    HA   ARG  16           HA       ARG  16  -4.576  -2.275   2.875
  148   1HB   ARG  16          HB2       ARG  16  -6.995  -1.683   1.253
  149   2HB   ARG  16          HB1       ARG  16  -5.485  -2.009   0.446
  150   1HG   ARG  16          HG2       ARG  16  -7.022  -3.826   2.276
  151   2HG   ARG  16          HG1       ARG  16  -6.726  -4.036   0.549
  152   1HD   ARG  16          HD2       ARG  16  -4.261  -4.112   1.119
  153   2HD   ARG  16          HD1       ARG  16  -4.750  -4.223   2.810
  154    HE   ARG  16           HE       ARG  16  -4.922  -6.290   0.805
  155   1HH1  ARG  16          1HH1      ARG  16  -6.087  -5.164   3.898
  156   2HH1  ARG  16          2HH1      ARG  16  -6.578  -6.738   4.425
  157   1HH2  ARG  16          1HH2      ARG  16  -5.568  -8.360   1.499
  158   2HH2  ARG  16          2HH2      ARG  16  -6.283  -8.552   3.065
  159    H    ASN  17           HN       ASN  17  -6.102   0.770   2.700
  160    HA   ASN  17           HA       ASN  17  -4.510   2.083   0.853
  161   1HB   ASN  17          HB2       ASN  17  -6.508   2.725   2.799
  162   2HB   ASN  17          HB1       ASN  17  -5.298   3.947   2.757
  163   1HD2  ASN  17          HD21      ASN  17  -7.368   5.040   2.059
  164   2HD2  ASN  17          HD22      ASN  17  -7.620   5.131   0.361
  165    HA   PRO  18           HA       PRO  18  -1.748   4.022   4.205
  166   1HB   PRO  18          HB2       PRO  18  -2.082   3.051   6.770
  167   2HB   PRO  18          HB1       PRO  18  -2.672   4.605   6.175
  168   1HG   PRO  18          HG2       PRO  18  -4.091   1.995   6.362
  169   2HG   PRO  18          HG1       PRO  18  -4.678   3.621   6.759
  170   1HD   PRO  18          HD2       PRO  18  -5.378   2.502   4.477
  171   2HD   PRO  18          HD1       PRO  18  -4.908   4.208   4.512
  172    H    ILE  19           HN       ILE  19  -2.807   0.794   4.272
  173    HA   ILE  19           HA       ILE  19  -0.378  -0.304   5.356
  174    HB   ILE  19           HB       ILE  19  -2.685  -1.622   3.942
  175   1HG1  ILE  19          HG12      ILE  19  -1.888  -1.219   6.810
  176   2HG1  ILE  19          HG11      ILE  19  -3.417  -0.844   6.043
  177   1HG2  ILE  19          HG21      ILE  19  -0.312  -2.905   5.295
  178   2HG2  ILE  19          HG22      ILE  19  -0.699  -2.966   3.576
  179   3HG2  ILE  19          HG23      ILE  19  -1.750  -3.763   4.744
  180   1HD1  ILE  19          HD11      ILE  19  -2.467  -3.352   7.227
  181   2HD1  ILE  19          HD12      ILE  19  -3.365  -3.517   5.718
  182   3HD1  ILE  19          HD13      ILE  19  -4.099  -2.698   7.097
  183    H    LEU  20           HN       LEU  20  -1.518   0.419   2.165
  184    HA   LEU  20           HA       LEU  20   0.560  -1.107   0.872
  185   1HB   LEU  20          HB2       LEU  20  -0.197  -0.246  -1.185
  186   2HB   LEU  20          HB1       LEU  20  -1.633  -0.542  -0.231
  187    HG   LEU  20           HG       LEU  20  -0.814   2.159   0.182
  188   1HD1  LEU  20          HD11      LEU  20  -0.470   1.174  -2.552
  189   2HD1  LEU  20          HD12      LEU  20   0.115   2.656  -1.797
  190   3HD1  LEU  20          HD13      LEU  20  -1.535   2.572  -2.413
  191   1HD2  LEU  20          HD21      LEU  20  -3.170   1.101  -1.339
  192   2HD2  LEU  20          HD22      LEU  20  -3.043   2.615  -0.440
  193   3HD2  LEU  20          HD23      LEU  20  -3.035   1.074   0.419
  194    H    VAL  21           HN       VAL  21  -0.094   2.155   1.856
  195    HA   VAL  21           HA       VAL  21   2.087   3.524   0.847
  196    HB   VAL  21           HB       VAL  21   0.364   3.675   3.256
  197   1HG1  VAL  21          HG11      VAL  21   2.680   4.236   3.864
  198   2HG1  VAL  21          HG12      VAL  21   1.516   5.545   4.116
  199   3HG1  VAL  21          HG13      VAL  21   2.604   5.582   2.726
  200   1HG2  VAL  21          HG21      VAL  21  -0.359   5.775   2.250
  201   2HG2  VAL  21          HG22      VAL  21  -0.507   4.425   1.119
  202   3HG2  VAL  21          HG23      VAL  21   0.830   5.570   0.960
  203    H    PHE  22           HN       PHE  22   1.470   1.961   3.908
  204    HA   PHE  22           HA       PHE  22   3.891   2.227   5.218
  205   1HB   PHE  22          HB2       PHE  22   2.327   1.394   6.631
  206   2HB   PHE  22          HB1       PHE  22   1.446   0.638   5.329
  207    HD1  PHE  22           HD1      PHE  22   4.652   0.276   7.060
  208    HD2  PHE  22           HD2      PHE  22   1.261  -1.477   5.322
  209    HE1  PHE  22           HE1      PHE  22   5.498  -1.927   7.724
  210    HE2  PHE  22           HE2      PHE  22   2.047  -3.723   5.983
  211    HZ   PHE  22           HZ       PHE  22   4.189  -3.947   7.168
  212    H    LEU  23           HN       LEU  23   2.828   0.128   2.714
  213    HA   LEU  23           HA       LEU  23   5.157  -1.664   2.799
  214   1HB   LEU  23          HB2       LEU  23   2.826  -1.340   0.925
  215   2HB   LEU  23          HB1       LEU  23   4.213  -2.292   0.444
  216    HG   LEU  23           HG       LEU  23   2.077  -3.355   1.582
  217   1HD1  LEU  23          HD11      LEU  23   4.937  -4.049   1.541
  218   2HD1  LEU  23          HD12      LEU  23   3.541  -4.958   0.962
  219   3HD1  LEU  23          HD13      LEU  23   3.948  -4.966   2.678
  220   1HD2  LEU  23          HD21      LEU  23   3.721  -3.265   4.003
  221   2HD2  LEU  23          HD22      LEU  23   1.967  -3.268   3.813
  222   3HD2  LEU  23          HD23      LEU  23   2.880  -1.771   3.584
  223    H    LYS  24           HN       LYS  24   3.998   1.039   1.105
  224    HA   LYS  24           HA       LYS  24   5.852   1.142  -0.991
  225   1HB   LYS  24          HB2       LYS  24   3.625   2.590   0.007
  226   2HB   LYS  24          HB1       LYS  24   4.872   3.728  -0.379
  227   1HG   LYS  24          HG2       LYS  24   4.196   3.579  -2.490
  228   2HG   LYS  24          HG1       LYS  24   4.814   1.926  -2.482
  229   1HD   LYS  24          HD2       LYS  24   2.496   1.480  -1.280
  230   2HD   LYS  24          HD1       LYS  24   2.032   2.903  -2.220
  231   1HE   LYS  24          HE2       LYS  24   1.925   1.707  -4.097
  232   2HE   LYS  24          HE1       LYS  24   3.546   1.060  -3.840
  233   1HZ   LYS  24          HZ1       LYS  24   0.952  -0.093  -3.152
  234   2HZ   LYS  24          HZ2       LYS  24   2.238  -0.401  -2.098
  235   3HZ   LYS  24          HZ3       LYS  24   2.354  -0.848  -3.726
  236    H    THR  25           HN       THR  25   5.669   2.668   2.128
  237    HA   THR  25           HA       THR  25   8.001   4.209   1.925
  238    HB   THR  25           HB       THR  25   6.454   4.829   3.611
  239    HG1  THR  25           HG1      THR  25   7.694   4.700   5.495
  240   1HG2  THR  25          HG21      THR  25   5.427   3.492   5.158
  241   2HG2  THR  25          HG22      THR  25   6.702   2.274   5.110
  242   3HG2  THR  25          HG23      THR  25   5.550   2.397   3.777
  243    H    ARG  26           HN       ARG  26   7.290   0.991   3.250
  244    HA   ARG  26           HA       ARG  26   9.882   0.429   4.206
  245   1HB   ARG  26          HB2       ARG  26   7.646  -1.288   3.162
  246   2HB   ARG  26          HB1       ARG  26   9.135  -1.985   3.790
  247   1HG   ARG  26          HG2       ARG  26   6.998  -0.485   5.245
  248   2HG   ARG  26          HG1       ARG  26   7.673  -2.069   5.591
  249   1HD   ARG  26          HD2       ARG  26   9.881  -0.717   5.950
  250   2HD   ARG  26          HD1       ARG  26   8.774   0.639   6.167
  251    HE   ARG  26           HE       ARG  26   7.911  -1.496   7.766
  252   1HH1  ARG  26          1HH1      ARG  26  10.546   0.782   7.562
  253   2HH1  ARG  26          2HH1      ARG  26  10.854   0.769   9.266
  254   1HH2  ARG  26          1HH2      ARG  26   8.315  -1.513  10.008
  255   2HH2  ARG  26          2HH2      ARG  26   9.588  -0.534  10.655
  256    H    VAL  27           HN       VAL  27   8.322   0.063   1.130
  257    HA   VAL  27           HA       VAL  27  10.443  -1.220  -0.277
  258    HB   VAL  27           HB       VAL  27   7.772  -0.083  -0.820
  259   1HG1  VAL  27          HG11      VAL  27   8.124  -0.371  -3.282
  260   2HG1  VAL  27          HG12      VAL  27   9.855  -0.367  -2.946
  261   3HG1  VAL  27          HG13      VAL  27   8.874   1.041  -2.541
  262   1HG2  VAL  27          HG21      VAL  27   9.158  -2.631  -1.640
  263   2HG2  VAL  27          HG22      VAL  27   7.471  -2.240  -1.971
  264   3HG2  VAL  27          HG23      VAL  27   8.022  -2.432  -0.307
  265    H    LEU  28           HN       LEU  28   9.636   1.982   0.597
  266    HA   LEU  28           HA       LEU  28  11.013   3.361  -1.463
  267   1HB   LEU  28          HB2       LEU  28   9.818   5.102  -0.706
  268   2HB   LEU  28          HB1       LEU  28   8.962   3.939   0.239
  269    HG   LEU  28           HG       LEU  28  10.381   4.413   2.154
  270   1HD1  LEU  28          HD11      LEU  28  11.584   6.838   1.579
  271   2HD1  LEU  28          HD12      LEU  28  11.955   5.827   0.182
  272   3HD1  LEU  28          HD13      LEU  28  12.392   5.286   1.803
  273   1HD2  LEU  28          HD21      LEU  28   8.978   6.030   2.773
  274   2HD2  LEU  28          HD22      LEU  28   8.357   5.983   1.124
  275   3HD2  LEU  28          HD23      LEU  28   9.608   7.146   1.562
  276    H    LYS  29           HN       LYS  29  11.341   2.790   1.935
  277    HA   LYS  29           HA       LYS  29  13.888   3.974   2.212
  278   1HB   LYS  29          HB2       LYS  29  13.922   3.115   4.443
  279   2HB   LYS  29          HB1       LYS  29  12.276   3.626   4.106
  280   1HG   LYS  29          HG2       LYS  29  11.598   1.334   3.750
  281   2HG   LYS  29          HG1       LYS  29  13.261   0.783   3.964
  282   1HD   LYS  29          HD2       LYS  29  11.660   2.235   6.066
  283   2HD   LYS  29          HD1       LYS  29  11.833   0.481   5.978
  284   1HE   LYS  29          HE2       LYS  29  13.726   0.628   7.127
  285   2HE   LYS  29          HE1       LYS  29  14.430   1.583   5.823
  286   1HZ   LYS  29          HZ1       LYS  29  14.148   2.479   8.304
  287   2HZ   LYS  29          HZ2       LYS  29  12.681   3.012   7.653
  288   3HZ   LYS  29          HZ3       LYS  29  14.142   3.495   6.951
  289    H    ARG  30           HN       ARG  30  12.708   1.009   1.160
  290    HA   ARG  30           HA       ARG  30  15.158  -0.441   1.402
  291   1HB   ARG  30          HB2       ARG  30  12.416  -0.909   0.395
  292   2HB   ARG  30          HB1       ARG  30  13.670  -1.972  -0.179
  293   1HG   ARG  30          HG2       ARG  30  13.798  -1.602   2.669
  294   2HG   ARG  30          HG1       ARG  30  12.210  -2.156   2.164
  295   1HD   ARG  30          HD2       ARG  30  13.067  -4.124   1.214
  296   2HD   ARG  30          HD1       ARG  30  14.711  -3.489   1.179
  297    HE   ARG  30           HE       ARG  30  13.747  -3.680   3.842
  298   1HH1  ARG  30          1HH1      ARG  30  14.987  -5.606   1.209
  299   2HH1  ARG  30          2HH1      ARG  30  15.613  -6.844   2.245
  300   1HH2  ARG  30          1HH2      ARG  30  14.569  -5.306   5.205
  301   2HH2  ARG  30          2HH2      ARG  30  15.375  -6.674   4.515
  302    H    TRP  31           HN       TRP  31  13.380   1.459  -0.839
  303    HA   TRP  31           HA       TRP  31  14.759   0.886  -3.206
  304   1HB   TRP  31          HB2       TRP  31  12.498   2.296  -2.327
  305   2HB   TRP  31          HB1       TRP  31  13.510   3.427  -3.132
  306    HD1  TRP  31           HD1      TRP  31  11.430   0.505  -3.727
  307    HE1  TRP  31           HE1      TRP  31  11.267   0.074  -6.253
  308    HE3  TRP  31           HE3      TRP  31  14.864   3.674  -5.017
  309    HZ2  TRP  31           HZ2      TRP  31  12.560   1.076  -8.569
  310    HZ3  TRP  31           HZ3      TRP  31  15.483   4.004  -7.434
  311    HH2  TRP  31           HH2      TRP  31  14.334   2.702  -9.180
  312    H    ARG  32           HN       ARG  32  14.757   3.339  -0.608
  313    HA   ARG  32           HA       ARG  32  16.778   5.017  -1.611
  314   1HB   ARG  32          HB2       ARG  32  15.936   4.186   1.132
  315   2HB   ARG  32          HB1       ARG  32  17.036   5.536   0.829
  316   1HG   ARG  32          HG2       ARG  32  15.296   6.660  -0.437
  317   2HG   ARG  32          HG1       ARG  32  14.211   5.313  -0.177
  318   1HD   ARG  32          HD2       ARG  32  13.724   7.113   1.369
  319   2HD   ARG  32          HD1       ARG  32  14.292   5.674   2.208
  320    HE   ARG  32           HE       ARG  32  16.375   7.565   1.625
  321   1HH1  ARG  32          1HH1      ARG  32  13.887   6.666   3.902
  322   2HH1  ARG  32          2HH1      ARG  32  14.651   7.459   5.239
  323   1HH2  ARG  32          1HH2      ARG  32  17.379   8.609   3.383
  324   2HH2  ARG  32          2HH2      ARG  32  16.633   8.562   4.945
  325    H    LEU  33           HN       LEU  33  16.791   2.371   0.635
  326    HA   LEU  33           HA       LEU  33  19.452   2.005   1.182
  327   1HB   LEU  33          HB2       LEU  33  16.910   0.482   1.171
  328   2HB   LEU  33          HB1       LEU  33  18.362  -0.384   1.482
  329    HG   LEU  33           HG       LEU  33  16.797   0.923   3.287
  330   1HD1  LEU  33          HD11      LEU  33  18.153  -0.018   4.857
  331   2HD1  LEU  33          HD12      LEU  33  19.628   0.497   4.039
  332   3HD1  LEU  33          HD13      LEU  33  18.730  -0.898   3.442
  333   1HD2  LEU  33          HD21      LEU  33  19.328   2.496   3.136
  334   2HD2  LEU  33          HD22      LEU  33  17.872   2.835   4.075
  335   3HD2  LEU  33          HD23      LEU  33  17.852   3.003   2.316
  336    H    PHE  34           HN       PHE  34  17.365   0.780  -1.230
  337    HA   PHE  34           HA       PHE  34  19.199  -1.043  -2.411
  338   1HB   PHE  34          HB2       PHE  34  16.513  -0.128  -2.876
  339   2HB   PHE  34          HB1       PHE  34  17.356  -0.508  -4.346
  340    HD1  PHE  34           HD1      PHE  34  17.877  -1.940  -1.085
  341    HD2  PHE  34           HD2      PHE  34  16.271  -2.492  -4.957
  342    HE1  PHE  34           HE1      PHE  34  17.576  -4.320  -0.607
  343    HE2  PHE  34           HE2      PHE  34  15.948  -4.871  -4.506
  344    HZ   PHE  34           HZ       PHE  34  16.599  -5.819  -2.316
  345    H    SER  35           HN       SER  35  18.537   2.208  -2.467
  346    HA   SER  35           HA       SER  35  20.086   2.655  -4.955
  347   1HB   SER  35          HB2       SER  35  17.903   4.045  -3.933
  348   2HB   SER  35          HB1       SER  35  19.276   5.112  -3.640
  349    HG   SER  35           HG       SER  35  18.435   5.482  -5.694
  350    H    LYS  36           HN       LYS  36  20.438   2.931  -1.488
  351    HA   LYS  36           HA       LYS  36  22.773   4.620  -1.701
  352   1HB   LYS  36          HB2       LYS  36  22.014   3.064   0.744
  353   2HB   LYS  36          HB1       LYS  36  22.909   4.569   0.651
  354   1HG   LYS  36          HG2       LYS  36  19.986   4.077   0.469
  355   2HG   LYS  36          HG1       LYS  36  20.867   5.225   1.467
  356   1HD   LYS  36          HD2       LYS  36  21.344   6.608  -0.460
  357   2HD   LYS  36          HD1       LYS  36  20.587   5.431  -1.533
  358   1HE   LYS  36          HE2       LYS  36  18.459   5.966  -0.845
  359   2HE   LYS  36          HE1       LYS  36  19.002   6.566   0.721
  360   1HZ   LYS  36          HZ1       LYS  36  19.717   7.975  -1.772
  361   2HZ   LYS  36          HZ2       LYS  36  19.663   8.577  -0.194
  362   3HZ   LYS  36          HZ3       LYS  36  18.225   8.248  -1.021
  363    H    HIS  37           HN       HIS  37  22.041   1.287  -1.112
  364    HA   HIS  37           HA       HIS  37  24.698   0.430  -0.622
  365   1HB   HIS  37          HB2       HIS  37  22.092  -0.761  -0.744
  366   2HB   HIS  37          HB1       HIS  37  23.215  -1.733  -1.674
  367    HD1  HIS  37           HD1      HIS  37  24.320  -3.478  -0.317
  368    HD2  HIS  37           HD2      HIS  37  23.330  -0.144   1.952
  369    HE1  HIS  37           HE1      HIS  37  25.027  -4.031   2.033
  370    HE2  HIS  37           HE2      HIS  37  24.507  -1.960   3.370
  371    H    GLU  38           HN       GLU  38  22.740   0.684  -3.535
  372    HA   GLU  38           HA       GLU  38  24.872  -0.471  -5.141
  373   1HB   GLU  38          HB2       GLU  38  21.988   0.103  -5.519
  374   2HB   GLU  38          HB1       GLU  38  23.003   0.195  -6.948
  375   1HG   GLU  38          HG2       GLU  38  23.592  -2.060  -6.820
  376   2HG   GLU  38          HG1       GLU  38  23.073  -2.187  -5.140
  Start of MODEL    5
    1   1H    VAL   1          HT1       VAL   1 -26.286  -7.679   4.047
    2   2H    VAL   1          HT2       VAL   1 -24.813  -6.914   3.609
    3   3H    VAL   1          HT3       VAL   1 -26.069  -7.087   2.453
    4    HA   VAL   1           HA       VAL   1 -27.337  -5.483   3.349
    5    HB   VAL   1           HB       VAL   1 -26.900  -4.570   5.658
    6   1HG1  VAL   1          HG11      VAL   1 -28.764  -5.835   5.770
    7   2HG1  VAL   1          HG12      VAL   1 -27.722  -6.913   6.698
    8   3HG1  VAL   1          HG13      VAL   1 -28.003  -7.219   4.984
    9   1HG2  VAL   1          HG21      VAL   1 -24.920  -6.794   5.605
   10   2HG2  VAL   1          HG22      VAL   1 -25.751  -6.434   7.118
   11   3HG2  VAL   1          HG23      VAL   1 -24.793  -5.187   6.318
   12    H    MET   2           HN       MET   2 -26.957  -3.180   3.562
   13    HA   MET   2           HA       MET   2 -24.732  -2.297   2.130
   14   1HB   MET   2          HB2       MET   2 -27.081  -1.129   3.442
   15   2HB   MET   2          HB1       MET   2 -25.697  -0.066   3.373
   16   1HG   MET   2          HG2       MET   2 -25.584  -0.628   0.897
   17   2HG   MET   2          HG1       MET   2 -27.189  -1.323   1.113
   18   1HE   MET   2          HE1       MET   2 -27.658   0.123  -0.851
   19   2HE   MET   2          HE2       MET   2 -28.244   1.781  -0.725
   20   3HE   MET   2          HE3       MET   2 -29.149   0.466   0.026
   21    HA   PRO   3           HA       PRO   3 -23.356  -0.267   6.495
   22   1HB   PRO   3          HB2       PRO   3 -24.032  -2.323   8.352
   23   2HB   PRO   3          HB1       PRO   3 -24.626  -0.671   8.309
   24   1HG   PRO   3          HG2       PRO   3 -25.861  -3.145   7.263
   25   2HG   PRO   3          HG1       PRO   3 -26.638  -1.666   7.858
   26   1HD   PRO   3          HD2       PRO   3 -26.581  -2.241   5.255
   27   2HD   PRO   3          HD1       PRO   3 -26.374  -0.569   5.820
   28    H    LYS   4           HN       LYS   4 -23.472  -3.609   5.648
   29    HA   LYS   4           HA       LYS   4 -20.787  -4.103   6.711
   30   1HB   LYS   4          HB2       LYS   4 -23.003  -5.840   5.689
   31   2HB   LYS   4          HB1       LYS   4 -21.368  -6.472   5.806
   32   1HG   LYS   4          HG2       LYS   4 -22.308  -5.128   8.230
   33   2HG   LYS   4          HG1       LYS   4 -23.225  -6.570   7.789
   34   1HD   LYS   4          HD2       LYS   4 -21.197  -7.889   7.741
   35   2HD   LYS   4          HD1       LYS   4 -20.221  -6.452   8.052
   36   1HE   LYS   4          HE2       LYS   4 -20.488  -7.716  10.094
   37   2HE   LYS   4          HE1       LYS   4 -21.352  -6.184  10.224
   38   1HZ   LYS   4          HZ1       LYS   4 -22.947  -8.366   9.210
   39   2HZ   LYS   4          HZ2       LYS   4 -23.310  -7.221  10.401
   40   3HZ   LYS   4          HZ3       LYS   4 -22.403  -8.592  10.796
   41    H    GLN   5           HN       GLN   5 -22.363  -3.425   3.741
   42    HA   GLN   5           HA       GLN   5 -20.253  -4.571   2.155
   43   1HB   GLN   5          HB2       GLN   5 -21.943  -4.739   0.677
   44   2HB   GLN   5          HB1       GLN   5 -22.969  -3.853   1.784
   45   1HG   GLN   5          HG2       GLN   5 -23.128  -2.615  -0.105
   46   2HG   GLN   5          HG1       GLN   5 -21.892  -1.753   0.772
   47   1HE2  GLN   5          HE21      GLN   5 -19.855  -3.717   0.079
   48   2HE2  GLN   5          HE22      GLN   5 -19.555  -3.490  -1.585
   49    H    ILE   6           HN       ILE   6 -21.174  -1.488   3.423
   50    HA   ILE   6           HA       ILE   6 -19.269  -0.112   1.757
   51    HB   ILE   6           HB       ILE   6 -19.881   1.832   3.321
   52   1HG1  ILE   6          HG12      ILE   6 -22.106   1.756   4.259
   53   2HG1  ILE   6          HG11      ILE   6 -22.300   0.096   3.775
   54   1HG2  ILE   6          HG21      ILE   6 -21.713   2.411   1.859
   55   2HG2  ILE   6          HG22      ILE   6 -21.872   0.717   1.385
   56   3HG2  ILE   6          HG23      ILE   6 -20.413   1.620   0.963
   57   1HD1  ILE   6          HD11      ILE   6 -20.953  -0.672   5.442
   58   2HD1  ILE   6          HD12      ILE   6 -21.619   0.759   6.221
   59   3HD1  ILE   6          HD13      ILE   6 -20.003   0.806   5.510
   60    H    VAL   7           HN       VAL   7 -19.554  -1.534   4.887
   61    HA   VAL   7           HA       VAL   7 -17.291  -0.269   6.091
   62    HB   VAL   7           HB       VAL   7 -19.369  -1.466   7.197
   63   1HG1  VAL   7          HG11      VAL   7 -17.412  -3.753   7.050
   64   2HG1  VAL   7          HG12      VAL   7 -18.930  -3.662   6.158
   65   3HG1  VAL   7          HG13      VAL   7 -18.946  -3.730   7.920
   66   1HG2  VAL   7          HG21      VAL   7 -18.212  -1.506   9.206
   67   2HG2  VAL   7          HG22      VAL   7 -17.362  -0.325   8.211
   68   3HG2  VAL   7          HG23      VAL   7 -16.694  -1.943   8.422
   69    H    TYR   8           HN       TYR   8 -18.116  -3.193   4.413
   70    HA   TYR   8           HA       TYR   8 -15.692  -4.641   4.560
   71   1HB   TYR   8          HB2       TYR   8 -18.154  -5.010   3.349
   72   2HB   TYR   8          HB1       TYR   8 -17.070  -4.784   1.981
   73    HD1  TYR   8           HD1      TYR   8 -16.554  -6.331   5.294
   74    HD2  TYR   8           HD2      TYR   8 -16.610  -6.885   1.097
   75    HE1  TYR   8           HE1      TYR   8 -15.680  -8.501   5.594
   76    HE2  TYR   8           HE2      TYR   8 -15.744  -9.115   1.377
   77    HH   TYR   8           HH       TYR   8 -14.355 -10.365   3.149
   78    H    TRP   9           HN       TRP   9 -17.083  -2.328   2.299
   79    HA   TRP   9           HA       TRP   9 -14.940  -2.117   0.469
   80   1HB   TRP   9          HB2       TRP   9 -17.358  -0.591   1.201
   81   2HB   TRP   9          HB1       TRP   9 -16.038   0.409   0.593
   82    HD1  TRP   9           HD1      TRP   9 -18.856  -1.487  -0.596
   83    HE1  TRP   9           HE1      TRP   9 -18.577  -1.883  -3.156
   84    HE3  TRP   9           HE3      TRP   9 -14.083  -0.217  -1.035
   85    HZ2  TRP   9           HZ2      TRP   9 -16.568  -1.664  -5.082
   86    HZ3  TRP   9           HZ3      TRP   9 -12.985  -0.300  -3.242
   87    HH2  TRP   9           HH2      TRP   9 -14.237  -1.024  -5.226
   88    H    LYS  10           HN       LYS  10 -16.034   0.019   2.908
   89    HA   LYS  10           HA       LYS  10 -13.954   1.780   3.159
   90   1HB   LYS  10          HB2       LYS  10 -16.008   2.199   4.281
   91   2HB   LYS  10          HB1       LYS  10 -15.898   0.698   5.184
   92   1HG   LYS  10          HG2       LYS  10 -13.626   2.012   5.932
   93   2HG   LYS  10          HG1       LYS  10 -14.801   3.315   5.770
   94   1HD   LYS  10          HD2       LYS  10 -16.328   2.150   7.259
   95   2HD   LYS  10          HD1       LYS  10 -15.204   0.793   7.374
   96   1HE   LYS  10          HE2       LYS  10 -14.620   1.898   9.276
   97   2HE   LYS  10          HE1       LYS  10 -13.555   2.728   8.142
   98   1HZ   LYS  10          HZ1       LYS  10 -15.230   4.478   7.939
   99   2HZ   LYS  10          HZ2       LYS  10 -14.702   4.309   9.536
  100   3HZ   LYS  10          HZ3       LYS  10 -16.206   3.690   9.074
  101    H    GLN  11           HN       GLN  11 -14.372  -1.273   4.949
  102    HA   GLN  11           HA       GLN  11 -11.851  -0.958   6.281
  103   1HB   GLN  11          HB2       GLN  11 -12.301  -3.031   7.317
  104   2HB   GLN  11          HB1       GLN  11 -13.866  -2.260   7.155
  105   1HG   GLN  11          HG2       GLN  11 -14.387  -3.624   5.242
  106   2HG   GLN  11          HG1       GLN  11 -12.776  -4.312   5.255
  107   1HE2  GLN  11          HE21      GLN  11 -13.409  -4.111   8.456
  108   2HE2  GLN  11          HE22      GLN  11 -14.172  -5.638   8.699
  109    H    TRP  12           HN       TRP  12 -12.421  -1.463   3.204
  110    HA   TRP  12           HA       TRP  12 -10.146  -3.294   2.816
  111   1HB   TRP  12          HB2       TRP  12 -12.435  -3.826   1.807
  112   2HB   TRP  12          HB1       TRP  12 -12.170  -2.516   0.721
  113    HD1  TRP  12           HD1      TRP  12 -11.407  -6.047   1.187
  114    HE1  TRP  12           HE1      TRP  12  -9.740  -6.812  -0.600
  115    HE3  TRP  12           HE3      TRP  12 -10.235  -1.569  -0.539
  116    HZ2  TRP  12           HZ2      TRP  12  -8.119  -5.597  -2.569
  117    HZ3  TRP  12           HZ3      TRP  12  -8.604  -1.331  -2.418
  118    HH2  TRP  12           HH2      TRP  12  -7.559  -3.358  -3.415
  119    H    LEU  13           HN       LEU  13 -11.495  -0.122   1.912
  120    HA   LEU  13           HA       LEU  13  -9.011   0.456   0.482
  121   1HB   LEU  13          HB2       LEU  13 -11.581   2.038   0.701
  122   2HB   LEU  13          HB1       LEU  13 -10.176   2.533  -0.223
  123    HG   LEU  13           HG       LEU  13 -11.746   0.015  -0.770
  124   1HD1  LEU  13          HD11      LEU  13 -12.320   1.528  -2.865
  125   2HD1  LEU  13          HD12      LEU  13 -12.102   2.816  -1.680
  126   3HD1  LEU  13          HD13      LEU  13 -13.301   1.555  -1.400
  127   1HD2  LEU  13          HD21      LEU  13  -9.903   1.430  -2.658
  128   2HD2  LEU  13          HD22      LEU  13 -10.444  -0.249  -2.673
  129   3HD2  LEU  13          HD23      LEU  13  -9.272   0.287  -1.470
  130    H    SER  14           HN       SER  14 -10.358   0.805   3.548
  131    HA   SER  14           HA       SER  14  -9.008   3.289   4.125
  132   1HB   SER  14          HB2       SER  14 -11.184   2.065   5.277
  133   2HB   SER  14          HB1       SER  14  -9.908   1.693   6.423
  134    HG   SER  14           HG       SER  14 -10.501   4.294   5.458
  135    H    LEU  15           HN       LEU  15  -8.692  -0.113   4.913
  136    HA   LEU  15           HA       LEU  15  -6.211   0.299   6.278
  137   1HB   LEU  15          HB2       LEU  15  -7.574  -2.263   5.476
  138   2HB   LEU  15          HB1       LEU  15  -6.285  -2.076   6.647
  139    HG   LEU  15           HG       LEU  15  -8.126  -2.257   8.022
  140   1HD1  LEU  15          HD11      LEU  15  -8.050   0.698   7.439
  141   2HD1  LEU  15          HD12      LEU  15  -6.920  -0.149   8.501
  142   3HD1  LEU  15          HD13      LEU  15  -8.633  -0.064   8.921
  143   1HD2  LEU  15          HD21      LEU  15 -10.119  -2.257   7.067
  144   2HD2  LEU  15          HD22      LEU  15  -9.445  -1.457   5.637
  145   3HD2  LEU  15          HD23      LEU  15 -10.061  -0.494   6.988
  146    H    ARG  16           HN       ARG  16  -7.211  -1.605   3.475
  147    HA   ARG  16           HA       ARG  16  -4.735  -2.351   2.557
  148   1HB   ARG  16          HB2       ARG  16  -7.240  -1.677   1.103
  149   2HB   ARG  16          HB1       ARG  16  -5.811  -2.092   0.197
  150   1HG   ARG  16          HG2       ARG  16  -7.296  -3.805   2.172
  151   2HG   ARG  16          HG1       ARG  16  -7.151  -4.049   0.431
  152   1HD   ARG  16          HD2       ARG  16  -4.738  -4.409   0.693
  153   2HD   ARG  16          HD1       ARG  16  -4.899  -4.181   2.434
  154    HE   ARG  16           HE       ARG  16  -5.601  -6.338   2.593
  155   1HH1  ARG  16          1HH1      ARG  16  -6.077  -5.282  -0.699
  156   2HH1  ARG  16          2HH1      ARG  16  -6.593  -6.839  -1.255
  157   1HH2  ARG  16          1HH2      ARG  16  -6.275  -8.385   1.863
  158   2HH2  ARG  16          2HH2      ARG  16  -6.705  -8.600   0.200
  159    H    ASN  17           HN       ASN  17  -6.191   0.735   2.403
  160    HA   ASN  17           HA       ASN  17  -4.637   1.979   0.467
  161   1HB   ASN  17          HB2       ASN  17  -6.499   2.691   2.538
  162   2HB   ASN  17          HB1       ASN  17  -5.259   3.873   2.408
  163   1HD2  ASN  17          HD21      ASN  17  -7.396   4.978   1.853
  164   2HD2  ASN  17          HD22      ASN  17  -7.734   5.093   0.170
  165    HA   PRO  18           HA       PRO  18  -1.739   3.802   3.836
  166   1HB   PRO  18          HB2       PRO  18  -1.981   2.584   6.317
  167   2HB   PRO  18          HB1       PRO  18  -2.557   4.200   5.895
  168   1HG   PRO  18          HG2       PRO  18  -4.027   1.616   5.921
  169   2HG   PRO  18          HG1       PRO  18  -4.569   3.222   6.437
  170   1HD   PRO  18          HD2       PRO  18  -5.349   2.249   4.107
  171   2HD   PRO  18          HD1       PRO  18  -4.875   3.949   4.244
  172    H    ILE  19           HN       ILE  19  -2.789   0.561   3.736
  173    HA   ILE  19           HA       ILE  19  -0.292  -0.606   4.572
  174    HB   ILE  19           HB       ILE  19  -2.629  -1.848   3.135
  175   1HG1  ILE  19          HG12      ILE  19  -1.745  -1.677   6.000
  176   2HG1  ILE  19          HG11      ILE  19  -3.311  -1.290   5.317
  177   1HG2  ILE  19          HG21      ILE  19  -0.188  -3.184   4.297
  178   2HG2  ILE  19          HG22      ILE  19  -0.610  -3.083   2.588
  179   3HG2  ILE  19          HG23      ILE  19  -1.617  -4.020   3.691
  180   1HD1  ILE  19          HD11      ILE  19  -3.054  -3.963   4.762
  181   2HD1  ILE  19          HD12      ILE  19  -3.964  -3.260   6.099
  182   3HD1  ILE  19          HD13      ILE  19  -2.305  -3.803   6.350
  183    H    LEU  20           HN       LEU  20  -1.673   0.318   1.552
  184    HA   LEU  20           HA       LEU  20   0.245  -0.961  -0.127
  185   1HB   LEU  20          HB2       LEU  20  -1.464   1.464  -0.720
  186   2HB   LEU  20          HB1       LEU  20  -0.574   0.528  -1.904
  187    HG   LEU  20           HG       LEU  20  -3.192   0.031  -0.694
  188   1HD1  LEU  20          HD11      LEU  20  -3.753  -0.514  -2.806
  189   2HD1  LEU  20          HD12      LEU  20  -2.262  -1.415  -3.086
  190   3HD1  LEU  20          HD13      LEU  20  -2.262   0.345  -3.193
  191   1HD2  LEU  20          HD21      LEU  20  -1.277  -2.266  -1.085
  192   2HD2  LEU  20          HD22      LEU  20  -3.010  -2.411  -0.787
  193   3HD2  LEU  20          HD23      LEU  20  -1.956  -1.724   0.451
  194    H    VAL  21           HN       VAL  21  -0.233   2.195   1.250
  195    HA   VAL  21           HA       VAL  21   1.941   3.602   0.296
  196    HB   VAL  21           HB       VAL  21   0.299   3.533   2.753
  197   1HG1  VAL  21          HG11      VAL  21   2.548   3.960   3.495
  198   2HG1  VAL  21          HG12      VAL  21   1.519   5.384   3.714
  199   3HG1  VAL  21          HG13      VAL  21   2.674   5.318   2.378
  200   1HG2  VAL  21          HG21      VAL  21  -0.598   4.542   0.749
  201   2HG2  VAL  21          HG22      VAL  21   0.774   5.655   0.669
  202   3HG2  VAL  21          HG23      VAL  21  -0.374   5.761   2.008
  203    H    PHE  22           HN       PHE  22   1.440   1.749   3.221
  204    HA   PHE  22           HA       PHE  22   3.943   1.887   4.403
  205   1HB   PHE  22          HB2       PHE  22   2.478   0.953   5.840
  206   2HB   PHE  22          HB1       PHE  22   1.492   0.326   4.545
  207    HD1  PHE  22           HD1      PHE  22   1.277  -1.791   4.345
  208    HD2  PHE  22           HD2      PHE  22   4.791  -0.224   6.023
  209    HE1  PHE  22           HE1      PHE  22   2.077  -4.091   4.748
  210    HE2  PHE  22           HE2      PHE  22   5.644  -2.484   6.437
  211    HZ   PHE  22           HZ       PHE  22   4.282  -4.437   5.778
  212    H    LEU  23           HN       LEU  23   2.690   0.019   1.800
  213    HA   LEU  23           HA       LEU  23   4.981  -1.811   1.600
  214   1HB   LEU  23          HB2       LEU  23   2.578  -1.264  -0.123
  215   2HB   LEU  23          HB1       LEU  23   3.921  -2.186  -0.763
  216    HG   LEU  23           HG       LEU  23   1.819  -3.321   0.375
  217   1HD1  LEU  23          HD11      LEU  23   3.214  -4.876  -0.480
  218   2HD1  LEU  23          HD12      LEU  23   3.702  -5.067   1.204
  219   3HD1  LEU  23          HD13      LEU  23   4.656  -4.056   0.118
  220   1HD2  LEU  23          HD21      LEU  23   2.821  -1.963   2.488
  221   2HD2  LEU  23          HD22      LEU  23   3.550  -3.558   2.708
  222   3HD2  LEU  23          HD23      LEU  23   1.795  -3.397   2.601
  223    H    LYS  24           HN       LYS  24   3.878   1.101   0.309
  224    HA   LYS  24           HA       LYS  24   5.658   1.379  -1.852
  225   1HB   LYS  24          HB2       LYS  24   3.468   2.732  -0.645
  226   2HB   LYS  24          HB1       LYS  24   4.709   3.894  -0.972
  227   1HG   LYS  24          HG2       LYS  24   3.948   3.938  -3.060
  228   2HG   LYS  24          HG1       LYS  24   4.563   2.292  -3.225
  229   1HD   LYS  24          HD2       LYS  24   2.294   1.735  -1.980
  230   2HD   LYS  24          HD1       LYS  24   1.794   3.235  -2.772
  231   1HE   LYS  24          HE2       LYS  24   1.285   1.818  -4.465
  232   2HE   LYS  24          HE1       LYS  24   2.994   2.025  -4.839
  233   1HZ   LYS  24          HZ1       LYS  24   2.109  -0.131  -3.033
  234   2HZ   LYS  24          HZ2       LYS  24   3.521  -0.033  -3.957
  235   3HZ   LYS  24          HZ3       LYS  24   2.038  -0.336  -4.711
  236    H    THR  25           HN       THR  25   5.555   2.577   1.407
  237    HA   THR  25           HA       THR  25   7.935   4.087   1.265
  238    HB   THR  25           HB       THR  25   6.340   4.727   2.906
  239    HG1  THR  25           HG1      THR  25   7.551   4.483   4.852
  240   1HG2  THR  25          HG21      THR  25   5.265   3.399   4.417
  241   2HG2  THR  25          HG22      THR  25   6.547   2.189   4.431
  242   3HG2  THR  25          HG23      THR  25   5.437   2.281   3.061
  243    H    ARG  26           HN       ARG  26   7.088   0.874   2.558
  244    HA   ARG  26           HA       ARG  26   9.578   0.210   3.635
  245   1HB   ARG  26          HB2       ARG  26   7.404  -1.402   2.332
  246   2HB   ARG  26          HB1       ARG  26   8.841  -2.174   2.997
  247   1HG   ARG  26          HG2       ARG  26   6.658  -0.714   4.434
  248   2HG   ARG  26          HG1       ARG  26   7.249  -2.347   4.689
  249   1HD   ARG  26          HD2       ARG  26   8.740   0.197   5.288
  250   2HD   ARG  26          HD1       ARG  26   7.950  -0.834   6.478
  251    HE   ARG  26           HE       ARG  26  10.447  -1.368   5.081
  252   1HH1  ARG  26          1HH1      ARG  26   7.927  -2.579   7.176
  253   2HH1  ARG  26          2HH1      ARG  26   8.897  -3.868   7.800
  254   1HH2  ARG  26          1HH2      ARG  26  11.718  -3.066   5.902
  255   2HH2  ARG  26          2HH2      ARG  26  11.046  -4.145   7.078
  256    H    VAL  27           HN       VAL  27   8.315  -0.021   0.403
  257    HA   VAL  27           HA       VAL  27  10.570  -1.258  -0.829
  258    HB   VAL  27           HB       VAL  27   7.970  -0.092  -1.596
  259   1HG1  VAL  27          HG11      VAL  27   8.577  -0.286  -4.024
  260   2HG1  VAL  27          HG12      VAL  27  10.264  -0.282  -3.507
  261   3HG1  VAL  27          HG13      VAL  27   9.228   1.101  -3.152
  262   1HG2  VAL  27          HG21      VAL  27   9.439  -2.605  -2.375
  263   2HG2  VAL  27          HG22      VAL  27   7.792  -2.199  -2.861
  264   3HG2  VAL  27          HG23      VAL  27   8.171  -2.459  -1.157
  265    H    LEU  28           HN       LEU  28   9.688   1.914   0.074
  266    HA   LEU  28           HA       LEU  28  11.296   3.345  -1.775
  267   1HB   LEU  28          HB2       LEU  28  10.017   5.066  -1.126
  268   2HB   LEU  28          HB1       LEU  28   9.054   3.884  -0.318
  269    HG   LEU  28           HG       LEU  28  10.227   4.311   1.767
  270   1HD1  LEU  28          HD11      LEU  28  12.271   5.181   1.689
  271   2HD1  LEU  28          HD12      LEU  28  11.504   6.743   1.392
  272   3HD1  LEU  28          HD13      LEU  28  12.045   5.751   0.036
  273   1HD2  LEU  28          HD21      LEU  28   9.539   7.062   1.118
  274   2HD2  LEU  28          HD22      LEU  28   8.787   5.943   2.254
  275   3HD2  LEU  28          HD23      LEU  28   8.341   5.899   0.548
  276    H    LYS  29           HN       LYS  29  11.201   2.690   1.633
  277    HA   LYS  29           HA       LYS  29  13.705   3.853   2.229
  278   1HB   LYS  29          HB2       LYS  29  13.477   2.987   4.425
  279   2HB   LYS  29          HB1       LYS  29  11.857   3.417   3.904
  280   1HG   LYS  29          HG2       LYS  29  11.334   1.104   3.469
  281   2HG   LYS  29          HG1       LYS  29  12.993   0.630   3.845
  282   1HD   LYS  29          HD2       LYS  29  11.191   2.027   5.810
  283   2HD   LYS  29          HD1       LYS  29  11.304   0.271   5.686
  284   1HE   LYS  29          HE2       LYS  29  13.874   1.685   5.888
  285   2HE   LYS  29          HE1       LYS  29  12.843   1.796   7.314
  286   1HZ   LYS  29          HZ1       LYS  29  13.800  -0.152   7.821
  287   2HZ   LYS  29          HZ2       LYS  29  14.252  -0.486   6.226
  288   3HZ   LYS  29          HZ3       LYS  29  12.674  -0.809   6.742
  289    H    ARG  30           HN       ARG  30  12.653   0.901   0.981
  290    HA   ARG  30           HA       ARG  30  15.050  -0.574   1.446
  291   1HB   ARG  30          HB2       ARG  30  12.469  -0.946   0.050
  292   2HB   ARG  30          HB1       ARG  30  13.785  -1.979  -0.434
  293   1HG   ARG  30          HG2       ARG  30  13.548  -1.820   2.426
  294   2HG   ARG  30          HG1       ARG  30  12.033  -2.314   1.683
  295   1HD   ARG  30          HD2       ARG  30  12.887  -4.285   0.910
  296   2HD   ARG  30          HD1       ARG  30  14.511  -3.625   0.717
  297    HE   ARG  30           HE       ARG  30  13.514  -5.033   2.964
  298   1HH1  ARG  30          1HH1      ARG  30  15.609  -2.382   2.095
  299   2HH1  ARG  30          2HH1      ARG  30  16.598  -2.535   3.508
  300   1HH2  ARG  30          1HH2      ARG  30  14.810  -5.235   4.824
  301   2HH2  ARG  30          2HH2      ARG  30  16.146  -4.157   5.058
  302    H    TRP  31           HN       TRP  31  13.601   1.473  -0.899
  303    HA   TRP  31           HA       TRP  31  15.332   1.046  -3.068
  304   1HB   TRP  31          HB2       TRP  31  12.937   2.372  -2.451
  305   2HB   TRP  31          HB1       TRP  31  14.029   3.564  -3.037
  306    HD1  TRP  31           HD1      TRP  31  12.116   0.653  -4.080
  307    HE1  TRP  31           HE1      TRP  31  12.332   0.353  -6.622
  308    HE3  TRP  31           HE3      TRP  31  15.637   3.929  -4.692
  309    HZ2  TRP  31           HZ2      TRP  31  13.929   1.492  -8.670
  310    HZ3  TRP  31           HZ3      TRP  31  16.594   4.393  -6.974
  311    HH2  TRP  31           HH2      TRP  31  15.738   3.171  -8.933
  312    H    ARG  32           HN       ARG  32  14.926   3.273  -0.343
  313    HA   ARG  32           HA       ARG  32  16.995   5.094  -0.864
  314   1HB   ARG  32          HB2       ARG  32  15.809   3.956   1.636
  315   2HB   ARG  32          HB1       ARG  32  16.802   5.416   1.602
  316   1HG   ARG  32          HG2       ARG  32  14.271   5.159   0.007
  317   2HG   ARG  32          HG1       ARG  32  14.281   5.714   1.659
  318   1HD   ARG  32          HD2       ARG  32  16.005   6.902  -0.458
  319   2HD   ARG  32          HD1       ARG  32  14.349   7.439  -0.207
  320    HE   ARG  32           HE       ARG  32  14.977   8.401   1.828
  321   1HH1  ARG  32          1HH1      ARG  32  17.679   6.761   0.331
  322   2HH1  ARG  32          2HH1      ARG  32  18.856   7.523   1.345
  323   1HH2  ARG  32          1HH2      ARG  32  16.529   9.395   3.156
  324   2HH2  ARG  32          2HH2      ARG  32  18.206   9.015   2.947
  325    H    LEU  33           HN       LEU  33  16.724   2.171   0.968
  326    HA   LEU  33           HA       LEU  33  19.287   1.832   1.962
  327   1HB   LEU  33          HB2       LEU  33  16.830   0.272   1.402
  328   2HB   LEU  33          HB1       LEU  33  18.232  -0.580   1.901
  329    HG   LEU  33           HG       LEU  33  16.321   0.534   3.483
  330   1HD1  LEU  33          HD11      LEU  33  17.378  -0.576   5.142
  331   2HD1  LEU  33          HD12      LEU  33  18.930   0.184   4.791
  332   3HD1  LEU  33          HD13      LEU  33  18.381  -1.186   3.825
  333   1HD2  LEU  33          HD21      LEU  33  17.175   2.399   4.610
  334   2HD2  LEU  33          HD22      LEU  33  17.405   2.721   2.888
  335   3HD2  LEU  33          HD23      LEU  33  18.769   2.200   3.877
  336    H    PHE  34           HN       PHE  34  17.609   0.797  -0.834
  337    HA   PHE  34           HA       PHE  34  19.673  -0.879  -1.879
  338   1HB   PHE  34          HB2       PHE  34  17.002  -0.087  -2.596
  339   2HB   PHE  34          HB1       PHE  34  18.031  -0.317  -3.980
  340    HD1  PHE  34           HD1      PHE  34  18.226  -1.910  -0.757
  341    HD2  PHE  34           HD2      PHE  34  17.213  -2.332  -4.838
  342    HE1  PHE  34           HE1      PHE  34  18.041  -4.332  -0.445
  343    HE2  PHE  34           HE2      PHE  34  17.009  -4.751  -4.559
  344    HZ   PHE  34           HZ       PHE  34  17.422  -5.785  -2.351
  345    H    SER  35           HN       SER  35  18.882   2.337  -1.804
  346    HA   SER  35           HA       SER  35  20.634   3.011  -4.101
  347   1HB   SER  35          HB2       SER  35  18.325   4.276  -3.160
  348   2HB   SER  35          HB1       SER  35  19.645   5.345  -2.695
  349    HG   SER  35           HG       SER  35  20.118   5.689  -4.750
  350    H    LYS  36           HN       LYS  36  20.537   3.158  -0.613
  351    HA   LYS  36           HA       LYS  36  22.858   4.842  -0.421
  352   1HB   LYS  36          HB2       LYS  36  22.480   4.886   1.827
  353   2HB   LYS  36          HB1       LYS  36  20.883   4.400   1.290
  354   1HG   LYS  36          HG2       LYS  36  21.239   2.158   1.930
  355   2HG   LYS  36          HG1       LYS  36  22.973   2.412   2.134
  356   1HD   LYS  36          HD2       LYS  36  21.736   2.301   4.280
  357   2HD   LYS  36          HD1       LYS  36  22.599   3.821   4.046
  358   1HE   LYS  36          HE2       LYS  36  19.796   3.728   3.109
  359   2HE   LYS  36          HE1       LYS  36  20.045   3.684   4.854
  360   1HZ   LYS  36          HZ1       LYS  36  21.579   5.683   3.416
  361   2HZ   LYS  36          HZ2       LYS  36  20.757   5.802   4.890
  362   3HZ   LYS  36          HZ3       LYS  36  19.905   5.931   3.434
  363    H    HIS  37           HN       HIS  37  22.246   1.505  -0.719
  364    HA   HIS  37           HA       HIS  37  24.714   0.542   0.300
  365   1HB   HIS  37          HB2       HIS  37  23.488  -1.303   0.213
  366   2HB   HIS  37          HB1       HIS  37  22.260  -0.538  -0.730
  367    HD1  HIS  37           HD1      HIS  37  25.132  -2.887  -1.001
  368    HD2  HIS  37           HD2      HIS  37  22.360  -1.013  -3.454
  369    HE1  HIS  37           HE1      HIS  37  25.254  -4.110  -3.197
  370    HE2  HIS  37           HE2      HIS  37  23.480  -3.037  -4.632
  371    H    GLU  38           HN       GLU  38  23.423   0.698  -2.977
  372    HA   GLU  38           HA       GLU  38  26.150   0.679  -4.040
  373   1HB   GLU  38          HB2       GLU  38  25.191   0.142  -6.185
  374   2HB   GLU  38          HB1       GLU  38  24.497  -0.926  -4.976
  375   1HG   GLU  38          HG2       GLU  38  22.450  -0.279  -5.506
  376   2HG   GLU  38          HG1       GLU  38  22.867   1.412  -5.233
  Start of MODEL    6
    1   1H    VAL   1          HT1       VAL   1 -27.800  -7.786   3.083
    2   2H    VAL   1          HT2       VAL   1 -27.188  -6.544   2.069
    3   3H    VAL   1          HT3       VAL   1 -28.880  -6.812   2.177
    4    HA   VAL   1           HA       VAL   1 -29.067  -5.876   4.187
    5    HB   VAL   1           HB       VAL   1 -27.096  -5.485   5.687
    6   1HG1  VAL   1          HG11      VAL   1 -26.788  -8.170   5.923
    7   2HG1  VAL   1          HG12      VAL   1 -28.280  -8.079   4.985
    8   3HG1  VAL   1          HG13      VAL   1 -28.168  -7.264   6.546
    9   1HG2  VAL   1          HG21      VAL   1 -25.464  -5.726   3.720
   10   2HG2  VAL   1          HG22      VAL   1 -25.619  -7.464   3.984
   11   3HG2  VAL   1          HG23      VAL   1 -25.000  -6.428   5.270
   12    H    MET   2           HN       MET   2 -28.444  -3.685   5.038
   13    HA   MET   2           HA       MET   2 -28.007  -1.933   2.854
   14   1HB   MET   2          HB2       MET   2 -28.795  -1.750   5.685
   15   2HB   MET   2          HB1       MET   2 -27.972  -0.348   5.045
   16   1HG   MET   2          HG2       MET   2 -30.367  -1.611   3.770
   17   2HG   MET   2          HG1       MET   2 -30.453  -0.267   4.907
   18   1HE   MET   2          HE1       MET   2 -31.793   1.159   3.295
   19   2HE   MET   2          HE2       MET   2 -30.904   2.345   2.339
   20   3HE   MET   2          HE3       MET   2 -30.574   2.175   4.063
   21    HA   PRO   3           HA       PRO   3 -23.846  -0.962   4.885
   22   1HB   PRO   3          HB2       PRO   3 -23.377  -1.336   7.434
   23   2HB   PRO   3          HB1       PRO   3 -24.747  -0.308   7.010
   24   1HG   PRO   3          HG2       PRO   3 -24.749  -3.222   7.709
   25   2HG   PRO   3          HG1       PRO   3 -25.721  -1.920   8.436
   26   1HD   PRO   3          HD2       PRO   3 -26.601  -3.535   6.366
   27   2HD   PRO   3          HD1       PRO   3 -27.212  -1.899   6.683
   28    H    LYS   4           HN       LYS   4 -22.034  -2.432   6.606
   29    HA   LYS   4           HA       LYS   4 -20.686  -4.246   6.680
   30   1HB   LYS   4          HB2       LYS   4 -22.965  -5.373   7.052
   31   2HB   LYS   4          HB1       LYS   4 -22.853  -5.864   5.367
   32   1HG   LYS   4          HG2       LYS   4 -21.740  -7.649   6.062
   33   2HG   LYS   4          HG1       LYS   4 -20.398  -6.572   6.451
   34   1HD   LYS   4          HD2       LYS   4 -22.475  -6.622   8.503
   35   2HD   LYS   4          HD1       LYS   4 -21.725  -8.197   8.229
   36   1HE   LYS   4          HE2       LYS   4 -20.246  -7.386   9.746
   37   2HE   LYS   4          HE1       LYS   4 -19.520  -6.706   8.291
   38   1HZ   LYS   4          HZ1       LYS   4 -20.546  -4.620   8.721
   39   2HZ   LYS   4          HZ2       LYS   4 -19.786  -5.107  10.151
   40   3HZ   LYS   4          HZ3       LYS   4 -21.464  -5.250   9.995
   41    H    GLN   5           HN       GLN   5 -22.251  -3.453   3.661
   42    HA   GLN   5           HA       GLN   5 -20.187  -4.839   2.164
   43   1HB   GLN   5          HB2       GLN   5 -21.865  -5.128   0.691
   44   2HB   GLN   5          HB1       GLN   5 -22.911  -4.174   1.722
   45   1HG   GLN   5          HG2       GLN   5 -23.073  -3.058  -0.238
   46   2HG   GLN   5          HG1       GLN   5 -21.806  -2.145   0.539
   47   1HE2  GLN   5          HE21      GLN   5 -19.782  -4.099   0.013
   48   2HE2  GLN   5          HE22      GLN   5 -19.513  -4.067  -1.672
   49    H    ILE   6           HN       ILE   6 -21.158  -1.722   3.197
   50    HA   ILE   6           HA       ILE   6 -19.289  -0.353   1.499
   51    HB   ILE   6           HB       ILE   6 -20.005   1.619   3.020
   52   1HG1  ILE   6          HG12      ILE   6 -22.268   1.477   3.880
   53   2HG1  ILE   6          HG11      ILE   6 -22.385  -0.203   3.424
   54   1HG2  ILE   6          HG21      ILE   6 -21.815   2.088   1.487
   55   2HG2  ILE   6          HG22      ILE   6 -21.877   0.380   1.041
   56   3HG2  ILE   6          HG23      ILE   6 -20.449   1.342   0.653
   57   1HD1  ILE   6          HD11      ILE   6 -20.136   0.498   5.189
   58   2HD1  ILE   6          HD12      ILE   6 -21.229  -0.887   5.238
   59   3HD1  ILE   6          HD13      ILE   6 -21.749   0.668   5.883
   60    H    VAL   7           HN       VAL   7 -19.597  -1.657   4.682
   61    HA   VAL   7           HA       VAL   7 -17.398  -0.280   5.882
   62    HB   VAL   7           HB       VAL   7 -19.498  -1.503   6.959
   63   1HG1  VAL   7          HG11      VAL   7 -17.415  -3.682   7.040
   64   2HG1  VAL   7          HG12      VAL   7 -18.895  -3.727   6.081
   65   3HG1  VAL   7          HG13      VAL   7 -18.986  -3.692   7.842
   66   1HG2  VAL   7          HG21      VAL   7 -18.359  -1.488   9.040
   67   2HG2  VAL   7          HG22      VAL   7 -17.732  -0.170   8.051
   68   3HG2  VAL   7          HG23      VAL   7 -16.796  -1.650   8.243
   69    H    TYR   8           HN       TYR   8 -18.108  -3.303   4.344
   70    HA   TYR   8           HA       TYR   8 -15.667  -4.682   4.630
   71   1HB   TYR   8          HB2       TYR   8 -18.116  -4.928   3.106
   72   2HB   TYR   8          HB1       TYR   8 -16.718  -5.287   2.099
   73    HD1  TYR   8           HD1      TYR   8 -14.871  -6.434   3.999
   74    HD2  TYR   8           HD2      TYR   8 -19.049  -7.006   3.629
   75    HE1  TYR   8           HE1      TYR   8 -14.656  -8.517   5.084
   76    HE2  TYR   8           HE2      TYR   8 -18.854  -9.148   4.712
   77    HH   TYR   8           HH       TYR   8 -17.030 -10.904   5.070
   78    H    TRP   9           HN       TRP   9 -17.053  -2.539   2.205
   79    HA   TRP   9           HA       TRP   9 -14.888  -2.383   0.403
   80   1HB   TRP   9          HB2       TRP   9 -17.363  -0.903   1.002
   81   2HB   TRP   9          HB1       TRP   9 -16.064   0.120   0.390
   82    HD1  TRP   9           HD1      TRP   9 -18.757  -1.983  -0.770
   83    HE1  TRP   9           HE1      TRP   9 -18.413  -2.449  -3.311
   84    HE3  TRP   9           HE3      TRP   9 -14.072  -0.422  -1.188
   85    HZ2  TRP   9           HZ2      TRP   9 -16.392  -2.167  -5.217
   86    HZ3  TRP   9           HZ3      TRP   9 -12.934  -0.508  -3.378
   87    HH2  TRP   9           HH2      TRP   9 -14.105  -1.381  -5.352
   88    H    LYS  10           HN       LYS  10 -16.085  -0.151   2.712
   89    HA   LYS  10           HA       LYS  10 -14.053   1.679   2.900
   90   1HB   LYS  10          HB2       LYS  10 -16.119   2.118   3.980
   91   2HB   LYS  10          HB1       LYS  10 -16.011   0.653   4.942
   92   1HG   LYS  10          HG2       LYS  10 -13.753   2.104   5.614
   93   2HG   LYS  10          HG1       LYS  10 -15.044   3.297   5.502
   94   1HD   LYS  10          HD2       LYS  10 -16.299   1.323   6.858
   95   2HD   LYS  10          HD1       LYS  10 -14.644   1.106   7.429
   96   1HE   LYS  10          HE2       LYS  10 -14.544   3.313   8.270
   97   2HE   LYS  10          HE1       LYS  10 -16.013   3.784   7.416
   98   1HZ   LYS  10          HZ1       LYS  10 -15.705   2.408   9.944
   99   2HZ   LYS  10          HZ2       LYS  10 -16.909   1.778   8.937
  100   3HZ   LYS  10          HZ3       LYS  10 -16.959   3.404   9.397
  101    H    GLN  11           HN       GLN  11 -14.427  -1.268   4.868
  102    HA   GLN  11           HA       GLN  11 -11.933  -0.828   6.206
  103   1HB   GLN  11          HB2       GLN  11 -12.346  -2.858   7.342
  104   2HB   GLN  11          HB1       GLN  11 -13.924  -2.127   7.127
  105   1HG   GLN  11          HG2       GLN  11 -14.401  -3.598   5.284
  106   2HG   GLN  11          HG1       GLN  11 -12.777  -4.255   5.345
  107   1HE2  GLN  11          HE21      GLN  11 -13.425  -3.908   8.525
  108   2HE2  GLN  11          HE22      GLN  11 -14.171  -5.431   8.841
  109    H    TRP  12           HN       TRP  12 -12.447  -1.519   3.152
  110    HA   TRP  12           HA       TRP  12 -10.124  -3.313   2.891
  111   1HB   TRP  12          HB2       TRP  12 -12.377  -3.961   1.881
  112   2HB   TRP  12          HB1       TRP  12 -12.137  -2.699   0.736
  113    HD1  TRP  12           HD1      TRP  12 -11.259  -6.175   1.391
  114    HE1  TRP  12           HE1      TRP  12  -9.547  -6.971  -0.338
  115    HE3  TRP  12           HE3      TRP  12 -10.232  -1.754  -0.559
  116    HZ2  TRP  12           HZ2      TRP  12  -7.952  -5.802  -2.355
  117    HZ3  TRP  12           HZ3      TRP  12  -8.594  -1.554  -2.434
  118    HH2  TRP  12           HH2      TRP  12  -7.464  -3.591  -3.315
  119    H    LEU  13           HN       LEU  13 -11.527  -0.227   1.804
  120    HA   LEU  13           HA       LEU  13  -9.029   0.330   0.381
  121   1HB   LEU  13          HB2       LEU  13 -11.174   0.763  -0.781
  122   2HB   LEU  13          HB1       LEU  13 -11.607   1.911   0.470
  123    HG   LEU  13           HG       LEU  13  -9.601   3.268  -0.174
  124   1HD1  LEU  13          HD11      LEU  13  -8.189   2.687  -1.826
  125   2HD1  LEU  13          HD12      LEU  13  -9.462   1.948  -2.799
  126   3HD1  LEU  13          HD13      LEU  13  -8.746   1.054  -1.458
  127   1HD2  LEU  13          HD21      LEU  13 -11.417   4.275  -1.062
  128   2HD2  LEU  13          HD22      LEU  13 -11.998   2.798  -1.831
  129   3HD2  LEU  13          HD23      LEU  13 -10.702   3.731  -2.579
  130    H    SER  14           HN       SER  14 -10.439   0.817   3.399
  131    HA   SER  14           HA       SER  14  -9.147   3.357   3.859
  132   1HB   SER  14          HB2       SER  14 -11.321   2.148   5.038
  133   2HB   SER  14          HB1       SER  14 -10.058   1.879   6.228
  134    HG   SER  14           HG       SER  14  -9.635   4.229   5.935
  135    H    LEU  15           HN       LEU  15  -8.777   0.008   4.835
  136    HA   LEU  15           HA       LEU  15  -6.333   0.547   6.219
  137   1HB   LEU  15          HB2       LEU  15  -7.636  -2.080   5.546
  138   2HB   LEU  15          HB1       LEU  15  -6.369  -1.804   6.723
  139    HG   LEU  15           HG       LEU  15  -8.227  -1.933   8.082
  140   1HD1  LEU  15          HD11      LEU  15  -8.784   0.301   8.837
  141   2HD1  LEU  15          HD12      LEU  15  -8.194   0.982   7.319
  142   3HD1  LEU  15          HD13      LEU  15  -7.065   0.224   8.445
  143   1HD2  LEU  15          HD21      LEU  15 -10.198  -2.038   7.088
  144   2HD2  LEU  15          HD22      LEU  15  -9.523  -1.288   5.633
  145   3HD2  LEU  15          HD23      LEU  15 -10.183  -0.279   6.929
  146    H    ARG  16           HN       ARG  16  -7.253  -1.533   3.514
  147    HA   ARG  16           HA       ARG  16  -4.763  -2.313   2.676
  148   1HB   ARG  16          HB2       ARG  16  -7.241  -1.730   1.143
  149   2HB   ARG  16          HB1       ARG  16  -5.792  -2.170   0.282
  150   1HG   ARG  16          HG2       ARG  16  -7.299  -3.805   2.304
  151   2HG   ARG  16          HG1       ARG  16  -7.101  -4.133   0.582
  152   1HD   ARG  16          HD2       ARG  16  -4.626  -4.306   1.013
  153   2HD   ARG  16          HD1       ARG  16  -5.001  -4.242   2.735
  154    HE   ARG  16           HE       ARG  16  -6.414  -6.285   1.266
  155   1HH1  ARG  16          1HH1      ARG  16  -3.547  -5.503   3.100
  156   2HH1  ARG  16          2HH1      ARG  16  -3.225  -7.148   3.531
  157   1HH2  ARG  16          1HH2      ARG  16  -5.989  -8.448   1.834
  158   2HH2  ARG  16          2HH2      ARG  16  -4.608  -8.820   2.812
  159    H    ASN  17           HN       ASN  17  -6.225   0.754   2.342
  160    HA   ASN  17           HA       ASN  17  -4.618   1.912   0.379
  161   1HB   ASN  17          HB2       ASN  17  -6.588   2.704   2.324
  162   2HB   ASN  17          HB1       ASN  17  -5.369   3.907   2.170
  163   1HD2  ASN  17          HD21      ASN  17  -7.515   4.911   1.459
  164   2HD2  ASN  17          HD22      ASN  17  -7.782   4.912  -0.239
  165    HA   PRO  18           HA       PRO  18  -1.895   3.978   3.782
  166   1HB   PRO  18          HB2       PRO  18  -2.249   2.894   6.312
  167   2HB   PRO  18          HB1       PRO  18  -2.825   4.472   5.770
  168   1HG   PRO  18          HG2       PRO  18  -4.257   1.869   5.861
  169   2HG   PRO  18          HG1       PRO  18  -4.848   3.490   6.268
  170   1HD   PRO  18          HD2       PRO  18  -5.498   2.389   3.957
  171   2HD   PRO  18          HD1       PRO  18  -5.049   4.099   4.025
  172    H    ILE  19           HN       ILE  19  -2.882   0.730   3.744
  173    HA   ILE  19           HA       ILE  19  -0.480  -0.406   4.810
  174    HB   ILE  19           HB       ILE  19  -2.714  -1.602   3.204
  175   1HG1  ILE  19          HG12      ILE  19  -1.956  -1.471   6.091
  176   2HG1  ILE  19          HG11      ILE  19  -3.523  -1.224   5.346
  177   1HG2  ILE  19          HG21      ILE  19  -1.749  -3.812   3.678
  178   2HG2  ILE  19          HG22      ILE  19  -0.328  -3.030   4.368
  179   3HG2  ILE  19          HG23      ILE  19  -0.696  -2.836   2.654
  180   1HD1  ILE  19          HD11      ILE  19  -3.719  -3.629   4.959
  181   2HD1  ILE  19          HD12      ILE  19  -3.511  -3.246   6.667
  182   3HD1  ILE  19          HD13      ILE  19  -2.153  -3.872   5.732
  183    H    LEU  20           HN       LEU  20  -1.669   0.255   1.645
  184    HA   LEU  20           HA       LEU  20   0.346  -0.918   0.082
  185   1HB   LEU  20          HB2       LEU  20  -1.356   1.503  -0.545
  186   2HB   LEU  20          HB1       LEU  20  -0.377   0.633  -1.706
  187    HG   LEU  20           HG       LEU  20  -3.049   0.033  -0.680
  188   1HD1  LEU  20          HD11      LEU  20  -1.882  -1.304  -3.042
  189   2HD1  LEU  20          HD12      LEU  20  -2.010   0.454  -3.095
  190   3HD1  LEU  20          HD13      LEU  20  -3.452  -0.528  -2.833
  191   1HD2  LEU  20          HD21      LEU  20  -1.901  -1.732   0.509
  192   2HD2  LEU  20          HD22      LEU  20  -1.034  -2.193  -0.957
  193   3HD2  LEU  20          HD23      LEU  20  -2.781  -2.414  -0.860
  194    H    VAL  21           HN       VAL  21  -0.182   2.216   1.453
  195    HA   VAL  21           HA       VAL  21   2.021   3.639   0.630
  196    HB   VAL  21           HB       VAL  21   0.266   3.497   2.995
  197   1HG1  VAL  21          HG11      VAL  21   1.433   5.145   4.195
  198   2HG1  VAL  21          HG12      VAL  21   2.515   5.465   2.838
  199   3HG1  VAL  21          HG13      VAL  21   2.622   3.931   3.708
  200   1HG2  VAL  21          HG21      VAL  21  -0.363   5.753   2.285
  201   2HG2  VAL  21          HG22      VAL  21  -0.526   4.570   0.982
  202   3HG2  VAL  21          HG23      VAL  21   0.849   5.680   1.002
  203    H    PHE  22           HN       PHE  22   1.390   1.685   3.474
  204    HA   PHE  22           HA       PHE  22   3.839   1.797   4.776
  205   1HB   PHE  22          HB2       PHE  22   2.368   0.777   6.121
  206   2HB   PHE  22          HB1       PHE  22   1.405   0.221   4.775
  207    HD1  PHE  22           HD1      PHE  22   1.256  -1.914   4.356
  208    HD2  PHE  22           HD2      PHE  22   4.628  -0.397   6.355
  209    HE1  PHE  22           HE1      PHE  22   2.109  -4.209   4.593
  210    HE2  PHE  22           HE2      PHE  22   5.522  -2.665   6.632
  211    HZ   PHE  22           HZ       PHE  22   4.262  -4.593   5.730
  212    H    LEU  23           HN       LEU  23   2.733   0.023   2.024
  213    HA   LEU  23           HA       LEU  23   5.152  -1.691   2.008
  214   1HB   LEU  23          HB2       LEU  23   2.916  -1.391   0.017
  215   2HB   LEU  23          HB1       LEU  23   4.300  -2.435  -0.240
  216    HG   LEU  23           HG       LEU  23   3.392  -3.295   2.195
  217   1HD1  LEU  23          HD11      LEU  23   1.215  -2.939   2.465
  218   2HD1  LEU  23          HD12      LEU  23   0.860  -3.287   0.769
  219   3HD1  LEU  23          HD13      LEU  23   1.406  -1.673   1.247
  220   1HD2  LEU  23          HD21      LEU  23   3.841  -5.026   0.812
  221   2HD2  LEU  23          HD22      LEU  23   3.210  -4.192  -0.608
  222   3HD2  LEU  23          HD23      LEU  23   2.102  -4.972   0.521
  223    H    LYS  24           HN       LYS  24   3.885   1.120   0.541
  224    HA   LYS  24           HA       LYS  24   5.696   1.427  -1.573
  225   1HB   LYS  24          HB2       LYS  24   3.517   2.788  -0.362
  226   2HB   LYS  24          HB1       LYS  24   4.774   3.943  -0.648
  227   1HG   LYS  24          HG2       LYS  24   4.043   4.043  -2.747
  228   2HG   LYS  24          HG1       LYS  24   4.622   2.387  -2.941
  229   1HD   LYS  24          HD2       LYS  24   2.463   1.978  -3.457
  230   2HD   LYS  24          HD1       LYS  24   2.309   1.899  -1.697
  231   1HE   LYS  24          HE2       LYS  24   0.631   3.374  -2.113
  232   2HE   LYS  24          HE1       LYS  24   1.965   4.523  -2.022
  233   1HZ   LYS  24          HZ1       LYS  24   1.939   4.873  -4.256
  234   2HZ   LYS  24          HZ2       LYS  24   0.300   4.520  -4.029
  235   3HZ   LYS  24          HZ3       LYS  24   1.346   3.331  -4.624
  236    H    THR  25           HN       THR  25   5.603   2.553   1.708
  237    HA   THR  25           HA       THR  25   7.970   4.072   1.643
  238    HB   THR  25           HB       THR  25   6.424   4.589   3.363
  239    HG1  THR  25           HG1      THR  25   8.750   4.331   3.988
  240   1HG2  THR  25          HG21      THR  25   6.581   1.972   4.729
  241   2HG2  THR  25          HG22      THR  25   5.527   2.107   3.320
  242   3HG2  THR  25          HG23      THR  25   5.288   3.170   4.708
  243    H    ARG  26           HN       ARG  26   7.169   0.764   2.679
  244    HA   ARG  26           HA       ARG  26   9.686   0.042   3.673
  245   1HB   ARG  26          HB2       ARG  26   7.503  -1.488   2.287
  246   2HB   ARG  26          HB1       ARG  26   8.957  -2.293   2.866
  247   1HG   ARG  26          HG2       ARG  26   6.780  -0.982   4.440
  248   2HG   ARG  26          HG1       ARG  26   7.413  -2.612   4.571
  249   1HD   ARG  26          HD2       ARG  26   9.561  -1.620   5.377
  250   2HD   ARG  26          HD1       ARG  26   8.753  -0.052   5.400
  251    HE   ARG  26           HE       ARG  26   7.796  -0.649   7.378
  252   1HH1  ARG  26          1HH1      ARG  26   8.749  -3.564   5.711
  253   2HH1  ARG  26          2HH1      ARG  26   8.302  -4.606   7.020
  254   1HH2  ARG  26          1HH2      ARG  26   7.208  -2.017   9.100
  255   2HH2  ARG  26          2HH2      ARG  26   7.428  -3.729   8.944
  256    H    VAL  27           HN       VAL  27   8.350   0.051   0.465
  257    HA   VAL  27           HA       VAL  27  10.566  -1.071  -0.923
  258    HB   VAL  27           HB       VAL  27   7.950   0.151  -1.517
  259   1HG1  VAL  27          HG11      VAL  27  10.197   0.159  -3.493
  260   2HG1  VAL  27          HG12      VAL  27   9.155   1.491  -2.993
  261   3HG1  VAL  27          HG13      VAL  27   8.499   0.178  -3.971
  262   1HG2  VAL  27          HG21      VAL  27   8.174  -2.243  -1.303
  263   2HG2  VAL  27          HG22      VAL  27   9.408  -2.270  -2.563
  264   3HG2  VAL  27          HG23      VAL  27   7.748  -1.832  -2.964
  265    H    LEU  28           HN       LEU  28   9.709   2.019   0.256
  266    HA   LEU  28           HA       LEU  28  11.276   3.601  -1.502
  267   1HB   LEU  28          HB2       LEU  28  10.017   5.260  -0.681
  268   2HB   LEU  28          HB1       LEU  28   9.068   4.007   0.034
  269    HG   LEU  28           HG       LEU  28  10.262   4.259   2.133
  270   1HD1  LEU  28          HD11      LEU  28  11.546   6.696   1.973
  271   2HD1  LEU  28          HD12      LEU  28  12.051   5.857   0.505
  272   3HD1  LEU  28          HD13      LEU  28  12.307   5.110   2.082
  273   1HD2  LEU  28          HD21      LEU  28   8.866   5.884   2.786
  274   2HD2  LEU  28          HD22      LEU  28   8.351   5.922   1.100
  275   3HD2  LEU  28          HD23      LEU  28   9.568   7.060   1.677
  276    H    LYS  29           HN       LYS  29  11.296   2.625   1.821
  277    HA   LYS  29           HA       LYS  29  13.817   3.741   2.458
  278   1HB   LYS  29          HB2       LYS  29  13.626   2.696   4.584
  279   2HB   LYS  29          HB1       LYS  29  12.002   3.194   4.137
  280   1HG   LYS  29          HG2       LYS  29  11.421   0.942   3.532
  281   2HG   LYS  29          HG1       LYS  29  13.082   0.405   3.792
  282   1HD   LYS  29          HD2       LYS  29  12.191   1.727   6.149
  283   2HD   LYS  29          HD1       LYS  29  10.955   0.564   5.668
  284   1HE   LYS  29          HE2       LYS  29  12.280  -0.811   6.906
  285   2HE   LYS  29          HE1       LYS  29  13.074  -0.991   5.342
  286   1HZ   LYS  29          HZ1       LYS  29  14.784  -0.590   6.861
  287   2HZ   LYS  29          HZ2       LYS  29  13.935   0.639   7.654
  288   3HZ   LYS  29          HZ3       LYS  29  14.551   0.905   6.102
  289    H    ARG  30           HN       ARG  30  12.704   0.925   0.994
  290    HA   ARG  30           HA       ARG  30  15.098  -0.604   1.285
  291   1HB   ARG  30          HB2       ARG  30  12.471  -0.869  -0.051
  292   2HB   ARG  30          HB1       ARG  30  13.766  -1.877  -0.630
  293   1HG   ARG  30          HG2       ARG  30  13.599  -1.890   2.241
  294   2HG   ARG  30          HG1       ARG  30  12.067  -2.335   1.502
  295   1HD   ARG  30          HD2       ARG  30  14.510  -3.592   0.394
  296   2HD   ARG  30          HD1       ARG  30  14.005  -4.111   2.001
  297    HE   ARG  30           HE       ARG  30  11.725  -4.277   0.558
  298   1HH1  ARG  30          1HH1      ARG  30  14.951  -5.516   0.070
  299   2HH1  ARG  30          2HH1      ARG  30  14.417  -6.913  -0.803
  300   1HH2  ARG  30          1HH2      ARG  30  11.021  -6.113  -0.593
  301   2HH2  ARG  30          2HH2      ARG  30  12.187  -7.252  -1.181
  302    H    TRP  31           HN       TRP  31  13.574   1.613  -0.846
  303    HA   TRP  31           HA       TRP  31  15.168   1.334  -3.122
  304   1HB   TRP  31          HB2       TRP  31  12.873   2.684  -2.270
  305   2HB   TRP  31          HB1       TRP  31  13.981   3.890  -2.790
  306    HD1  TRP  31           HD1      TRP  31  11.899   1.176  -4.018
  307    HE1  TRP  31           HE1      TRP  31  11.990   1.122  -6.584
  308    HE3  TRP  31           HE3      TRP  31  15.540   4.346  -4.478
  309    HZ2  TRP  31           HZ2      TRP  31  13.547   2.390  -8.587
  310    HZ3  TRP  31           HZ3      TRP  31  16.417   4.993  -6.747
  311    HH2  TRP  31           HH2      TRP  31  15.420   4.008  -8.771
  312    H    ARG  32           HN       ARG  32  15.018   3.366  -0.181
  313    HA   ARG  32           HA       ARG  32  17.157   5.106  -0.742
  314   1HB   ARG  32          HB2       ARG  32  16.126   3.829   1.755
  315   2HB   ARG  32          HB1       ARG  32  17.270   5.175   1.761
  316   1HG   ARG  32          HG2       ARG  32  15.622   6.566   0.645
  317   2HG   ARG  32          HG1       ARG  32  14.495   5.227   0.602
  318   1HD   ARG  32          HD2       ARG  32  13.821   5.625   2.653
  319   2HD   ARG  32          HD1       ARG  32  15.467   5.589   3.260
  320    HE   ARG  32           HE       ARG  32  15.117   8.056   2.046
  321   1HH1  ARG  32          1HH1      ARG  32  13.757   6.303   4.740
  322   2HH1  ARG  32          2HH1      ARG  32  13.391   7.733   5.646
  323   1HH2  ARG  32          1HH2      ARG  32  14.638   9.937   3.238
  324   2HH2  ARG  32          2HH2      ARG  32  13.891   9.795   4.794
  325    H    LEU  33           HN       LEU  33  16.914   2.129   0.993
  326    HA   LEU  33           HA       LEU  33  19.497   1.541   1.689
  327   1HB   LEU  33          HB2       LEU  33  16.912   0.174   1.211
  328   2HB   LEU  33          HB1       LEU  33  18.293  -0.800   1.514
  329    HG   LEU  33           HG       LEU  33  16.591   0.293   3.348
  330   1HD1  LEU  33          HD11      LEU  33  19.238  -0.357   4.421
  331   2HD1  LEU  33          HD12      LEU  33  18.560  -1.584   3.350
  332   3HD1  LEU  33          HD13      LEU  33  17.665  -1.070   4.779
  333   1HD2  LEU  33          HD21      LEU  33  19.186   1.709   3.734
  334   2HD2  LEU  33          HD22      LEU  33  17.634   2.002   4.522
  335   3HD2  LEU  33          HD23      LEU  33  17.862   2.431   2.823
  336    H    PHE  34           HN       PHE  34  17.576   0.787  -1.038
  337    HA   PHE  34           HA       PHE  34  19.464  -0.891  -2.350
  338   1HB   PHE  34          HB2       PHE  34  16.818   0.125  -2.837
  339   2HB   PHE  34          HB1       PHE  34  17.749  -0.055  -4.294
  340    HD1  PHE  34           HD1      PHE  34  16.751  -1.932  -5.262
  341    HD2  PHE  34           HD2      PHE  34  18.009  -1.924  -1.226
  342    HE1  PHE  34           HE1      PHE  34  16.402  -4.349  -5.169
  343    HE2  PHE  34           HE2      PHE  34  17.671  -4.344  -1.101
  344    HZ   PHE  34           HZ       PHE  34  16.855  -5.588  -3.077
  345    H    SER  35           HN       SER  35  18.848   2.351  -1.976
  346    HA   SER  35           HA       SER  35  20.531   3.125  -4.286
  347   1HB   SER  35          HB2       SER  35  18.346   4.423  -3.136
  348   2HB   SER  35          HB1       SER  35  19.741   5.379  -2.643
  349    HG   SER  35           HG       SER  35  18.656   4.975  -5.151
  350    H    LYS  36           HN       LYS  36  20.712   2.836  -0.811
  351    HA   LYS  36           HA       LYS  36  23.091   4.464  -0.613
  352   1HB   LYS  36          HB2       LYS  36  22.144   2.447   1.410
  353   2HB   LYS  36          HB1       LYS  36  23.194   3.826   1.686
  354   1HG   LYS  36          HG2       LYS  36  21.137   5.209   0.920
  355   2HG   LYS  36          HG1       LYS  36  20.252   3.731   1.302
  356   1HD   LYS  36          HD2       LYS  36  22.122   5.090   3.221
  357   2HD   LYS  36          HD1       LYS  36  20.376   5.362   3.185
  358   1HE   LYS  36          HE2       LYS  36  20.011   3.503   4.343
  359   2HE   LYS  36          HE1       LYS  36  20.918   2.553   3.162
  360   1HZ   LYS  36          HZ1       LYS  36  22.888   2.829   4.350
  361   2HZ   LYS  36          HZ2       LYS  36  21.737   2.563   5.561
  362   3HZ   LYS  36          HZ3       LYS  36  22.293   4.130   5.253
  363    H    HIS  37           HN       HIS  37  22.268   1.125  -0.814
  364    HA   HIS  37           HA       HIS  37  24.879   0.081  -0.463
  365   1HB   HIS  37          HB2       HIS  37  23.621  -1.725  -0.225
  366   2HB   HIS  37          HB1       HIS  37  22.218  -0.920  -0.826
  367    HD1  HIS  37           HD1      HIS  37  24.801  -3.406  -1.776
  368    HD2  HIS  37           HD2      HIS  37  21.631  -1.364  -3.508
  369    HE1  HIS  37           HE1      HIS  37  24.318  -4.628  -3.922
  370    HE2  HIS  37           HE2      HIS  37  22.313  -3.448  -4.897
  371    H    GLU  38           HN       GLU  38  22.835   0.266  -3.330
  372    HA   GLU  38           HA       GLU  38  25.103  -0.082  -5.084
  373   1HB   GLU  38          HB2       GLU  38  22.170  -0.126  -5.339
  374   2HB   GLU  38          HB1       GLU  38  23.017   0.523  -6.735
  375   1HG   GLU  38          HG2       GLU  38  24.105  -1.975  -5.643
  376   2HG   GLU  38          HG1       GLU  38  22.494  -2.088  -6.351
  Start of MODEL    7
    1   1H    VAL   1          HT1       VAL   1 -28.081   2.915   1.847
    2   2H    VAL   1          HT2       VAL   1 -29.657   2.783   2.514
    3   3H    VAL   1          HT3       VAL   1 -29.445   2.834   0.812
    4    HA   VAL   1           HA       VAL   1 -29.921   0.633   1.595
    5    HB   VAL   1           HB       VAL   1 -27.878  -0.478   0.610
    6   1HG1  VAL   1          HG11      VAL   1 -29.586   1.548  -0.697
    7   2HG1  VAL   1          HG12      VAL   1 -29.399  -0.173  -1.038
    8   3HG1  VAL   1          HG13      VAL   1 -28.192   0.977  -1.616
    9   1HG2  VAL   1          HG21      VAL   1 -26.455   1.583   1.417
   10   2HG2  VAL   1          HG22      VAL   1 -26.896   2.224  -0.165
   11   3HG2  VAL   1          HG23      VAL   1 -26.022   0.697  -0.045
   12    H    MET   2           HN       MET   2 -28.579  -1.373   2.376
   13    HA   MET   2           HA       MET   2 -28.041  -0.962   5.125
   14   1HB   MET   2          HB2       MET   2 -28.259  -3.222   3.243
   15   2HB   MET   2          HB1       MET   2 -27.219  -3.487   4.621
   16   1HG   MET   2          HG2       MET   2 -29.127  -2.741   6.075
   17   2HG   MET   2          HG1       MET   2 -30.128  -2.788   4.625
   18   1HE   MET   2          HE1       MET   2 -31.570  -4.260   4.363
   19   2HE   MET   2          HE2       MET   2 -31.847  -5.134   5.869
   20   3HE   MET   2          HE3       MET   2 -31.440  -6.018   4.397
   21    HA   PRO   3           HA       PRO   3 -23.601  -0.750   4.934
   22   1HB   PRO   3          HB2       PRO   3 -22.916  -1.494   7.362
   23   2HB   PRO   3          HB1       PRO   3 -24.175  -0.270   7.203
   24   1HG   PRO   3          HG2       PRO   3 -24.488  -3.226   7.590
   25   2HG   PRO   3          HG1       PRO   3 -25.203  -1.911   8.552
   26   1HD   PRO   3          HD2       PRO   3 -26.499  -3.153   6.457
   27   2HD   PRO   3          HD1       PRO   3 -26.838  -1.490   6.981
   28    H    LYS   4           HN       LYS   4 -21.814  -2.641   6.314
   29    HA   LYS   4           HA       LYS   4 -20.712  -4.600   6.035
   30   1HB   LYS   4          HB2       LYS   4 -23.055  -5.539   6.334
   31   2HB   LYS   4          HB1       LYS   4 -23.129  -5.653   4.582
   32   1HG   LYS   4          HG2       LYS   4 -20.702  -6.851   5.440
   33   2HG   LYS   4          HG1       LYS   4 -22.017  -7.488   6.429
   34   1HD   LYS   4          HD2       LYS   4 -22.332  -8.912   4.722
   35   2HD   LYS   4          HD1       LYS   4 -23.126  -7.544   3.940
   36   1HE   LYS   4          HE2       LYS   4 -20.291  -7.366   3.555
   37   2HE   LYS   4          HE1       LYS   4 -20.855  -8.964   3.068
   38   1HZ   LYS   4          HZ1       LYS   4 -21.731  -6.330   2.040
   39   2HZ   LYS   4          HZ2       LYS   4 -22.622  -7.742   1.769
   40   3HZ   LYS   4          HZ3       LYS   4 -21.042  -7.613   1.179
   41    H    GLN   5           HN       GLN   5 -22.206  -3.054   3.310
   42    HA   GLN   5           HA       GLN   5 -20.309  -4.341   1.509
   43   1HB   GLN   5          HB2       GLN   5 -21.986  -4.304   0.025
   44   2HB   GLN   5          HB1       GLN   5 -23.001  -3.587   1.253
   45   1HG   GLN   5          HG2       GLN   5 -23.068  -2.335  -0.855
   46   2HG   GLN   5          HG1       GLN   5 -22.485  -1.393   0.466
   47   1HE2  GLN   5          HE21      GLN   5 -21.157  -3.408  -2.052
   48   2HE2  GLN   5          HE22      GLN   5 -19.872  -2.339  -2.389
   49    H    ILE   6           HN       ILE   6 -21.139  -1.314   2.900
   50    HA   ILE   6           HA       ILE   6 -19.167   0.118   1.391
   51    HB   ILE   6           HB       ILE   6 -19.796   1.953   3.109
   52   1HG1  ILE   6          HG12      ILE   6 -22.075   1.849   3.929
   53   2HG1  ILE   6          HG11      ILE   6 -22.282   0.241   3.287
   54   1HG2  ILE   6          HG21      ILE   6 -20.218   1.962   0.720
   55   2HG2  ILE   6          HG22      ILE   6 -21.551   2.693   1.620
   56   3HG2  ILE   6          HG23      ILE   6 -21.705   1.051   0.988
   57   1HD1  ILE   6          HD11      ILE   6 -21.647   0.781   5.833
   58   2HD1  ILE   6          HD12      ILE   6 -20.029   0.618   5.148
   59   3HD1  ILE   6          HD13      ILE   6 -21.183  -0.710   5.017
   60    H    VAL   7           HN       VAL   7 -19.593  -1.515   4.397
   61    HA   VAL   7           HA       VAL   7 -17.365  -0.391   5.784
   62    HB   VAL   7           HB       VAL   7 -19.539  -1.632   6.671
   63   1HG1  VAL   7          HG11      VAL   7 -19.021  -3.765   5.560
   64   2HG1  VAL   7          HG12      VAL   7 -19.137  -3.928   7.312
   65   3HG1  VAL   7          HG13      VAL   7 -17.556  -3.898   6.532
   66   1HG2  VAL   7          HG21      VAL   7 -16.887  -2.065   7.994
   67   2HG2  VAL   7          HG22      VAL   7 -18.465  -1.887   8.763
   68   3HG2  VAL   7          HG23      VAL   7 -17.725  -0.516   7.938
   69    H    TYR   8           HN       TYR   8 -18.155  -3.197   3.901
   70    HA   TYR   8           HA       TYR   8 -15.766  -4.688   4.081
   71   1HB   TYR   8          HB2       TYR   8 -18.200  -4.887   2.724
   72   2HB   TYR   8          HB1       TYR   8 -16.996  -4.749   1.449
   73    HD1  TYR   8           HD1      TYR   8 -16.723  -6.904   0.602
   74    HD2  TYR   8           HD2      TYR   8 -16.763  -6.295   4.791
   75    HE1  TYR   8           HE1      TYR   8 -16.047  -9.192   0.939
   76    HE2  TYR   8           HE2      TYR   8 -16.088  -8.524   5.147
   77    HH   TYR   8           HH       TYR   8 -14.942 -10.578   2.651
   78    H    TRP   9           HN       TRP   9 -17.009  -2.216   1.904
   79    HA   TRP   9           HA       TRP   9 -14.773  -1.989   0.182
   80   1HB   TRP   9          HB2       TRP   9 -17.222  -0.492   0.826
   81   2HB   TRP   9          HB1       TRP   9 -15.871   0.538   0.345
   82    HD1  TRP   9           HD1      TRP   9 -18.546  -1.454  -1.067
   83    HE1  TRP   9           HE1      TRP   9 -18.124  -1.706  -3.626
   84    HE3  TRP   9           HE3      TRP   9 -13.857   0.125  -1.198
   85    HZ2  TRP   9           HZ2      TRP   9 -16.040  -1.275  -5.434
   86    HZ3  TRP   9           HZ3      TRP   9 -12.642   0.213  -3.352
   87    HH2  TRP   9           HH2      TRP   9 -13.749  -0.492  -5.427
   88    H    LYS  10           HN       LYS  10 -15.980   0.039   2.662
   89    HA   LYS  10           HA       LYS  10 -13.906   1.773   3.104
   90   1HB   LYS  10          HB2       LYS  10 -15.991   2.152   4.172
   91   2HB   LYS  10          HB1       LYS  10 -15.939   0.596   4.984
   92   1HG   LYS  10          HG2       LYS  10 -13.672   1.872   5.873
   93   2HG   LYS  10          HG1       LYS  10 -14.877   3.153   5.797
   94   1HD   LYS  10          HD2       LYS  10 -16.131   2.252   7.459
   95   2HD   LYS  10          HD1       LYS  10 -15.761   0.596   6.977
   96   1HE   LYS  10          HE2       LYS  10 -13.436   2.034   7.982
   97   2HE   LYS  10          HE1       LYS  10 -14.736   1.920   9.167
   98   1HZ   LYS  10          HZ1       LYS  10 -14.763  -0.550   8.458
   99   2HZ   LYS  10          HZ2       LYS  10 -13.566  -0.011   9.525
  100   3HZ   LYS  10          HZ3       LYS  10 -13.199  -0.240   7.890
  101    H    GLN  11           HN       GLN  11 -14.416  -1.362   4.732
  102    HA   GLN  11           HA       GLN  11 -11.945  -1.145   6.172
  103   1HB   GLN  11          HB2       GLN  11 -12.429  -3.290   7.040
  104   2HB   GLN  11          HB1       GLN  11 -13.981  -2.488   6.891
  105   1HG   GLN  11          HG2       GLN  11 -14.457  -3.705   4.864
  106   2HG   GLN  11          HG1       GLN  11 -12.858  -4.427   4.890
  107   1HE2  GLN  11          HE21      GLN  11 -13.578  -4.432   8.070
  108   2HE2  GLN  11          HE22      GLN  11 -14.393  -5.947   8.188
  109    H    TRP  12           HN       TRP  12 -12.397  -1.481   3.042
  110    HA   TRP  12           HA       TRP  12 -10.086  -3.263   2.648
  111   1HB   TRP  12          HB2       TRP  12 -12.330  -3.757   1.525
  112   2HB   TRP  12          HB1       TRP  12 -12.028  -2.394   0.515
  113    HD1  TRP  12           HD1      TRP  12 -11.258  -5.939   0.843
  114    HE1  TRP  12           HE1      TRP  12  -9.515  -6.609  -0.910
  115    HE3  TRP  12           HE3      TRP  12 -10.053  -1.377  -0.616
  116    HZ2  TRP  12           HZ2      TRP  12  -7.827  -5.291  -2.753
  117    HZ3  TRP  12           HZ3      TRP  12  -8.350  -1.040  -2.417
  118    HH2  TRP  12           HH2      TRP  12  -7.250  -3.011  -3.466
  119    H    LEU  13           HN       LEU  13 -11.425  -0.051   1.895
  120    HA   LEU  13           HA       LEU  13  -8.906   0.640   0.581
  121   1HB   LEU  13          HB2       LEU  13 -11.490   2.193   0.831
  122   2HB   LEU  13          HB1       LEU  13 -10.062   2.750  -0.017
  123    HG   LEU  13           HG       LEU  13 -11.710   0.337  -0.770
  124   1HD1  LEU  13          HD11      LEU  13 -13.073   1.910  -1.608
  125   2HD1  LEU  13          HD12      LEU  13 -11.835   2.082  -2.855
  126   3HD1  LEU  13          HD13      LEU  13 -11.855   3.179  -1.474
  127   1HD2  LEU  13          HD21      LEU  13  -9.210   0.311  -1.276
  128   2HD2  LEU  13          HD22      LEU  13  -9.541   1.634  -2.392
  129   3HD2  LEU  13          HD23      LEU  13 -10.309   0.065  -2.633
  130    H    SER  14           HN       SER  14 -10.340   0.765   3.619
  131    HA   SER  14           HA       SER  14  -9.036   3.219   4.401
  132   1HB   SER  14          HB2       SER  14 -11.229   1.927   5.407
  133   2HB   SER  14          HB1       SER  14  -9.984   1.433   6.546
  134    HG   SER  14           HG       SER  14 -11.227   3.813   6.304
  135    H    LEU  15           HN       LEU  15  -8.723  -0.222   4.999
  136    HA   LEU  15           HA       LEU  15  -6.268   0.107   6.429
  137   1HB   LEU  15          HB2       LEU  15  -7.598  -2.405   5.436
  138   2HB   LEU  15          HB1       LEU  15  -6.341  -2.285   6.649
  139    HG   LEU  15           HG       LEU  15  -8.218  -2.566   7.961
  140   1HD1  LEU  15          HD11      LEU  15  -8.760  -0.439   8.989
  141   2HD1  LEU  15          HD12      LEU  15  -8.137   0.422   7.578
  142   3HD1  LEU  15          HD13      LEU  15  -7.036  -0.493   8.611
  143   1HD2  LEU  15          HD21      LEU  15 -10.138  -0.746   6.993
  144   2HD2  LEU  15          HD22      LEU  15 -10.188  -2.511   6.959
  145   3HD2  LEU  15          HD23      LEU  15  -9.483  -1.618   5.600
  146    H    ARG  16           HN       ARG  16  -7.198  -1.608   3.487
  147    HA   ARG  16           HA       ARG  16  -4.695  -2.286   2.585
  148   1HB   ARG  16          HB2       ARG  16  -7.176  -1.549   1.122
  149   2HB   ARG  16          HB1       ARG  16  -5.720  -1.885   0.225
  150   1HG   ARG  16          HG2       ARG  16  -7.220  -3.737   2.054
  151   2HG   ARG  16          HG1       ARG  16  -7.028  -3.874   0.306
  152   1HD   ARG  16          HD2       ARG  16  -4.545  -4.069   0.717
  153   2HD   ARG  16          HD1       ARG  16  -4.926  -4.218   2.432
  154    HE   ARG  16           HE       ARG  16  -5.482  -6.388   2.046
  155   1HH1  ARG  16          1HH1      ARG  16  -5.740  -4.655  -0.972
  156   2HH1  ARG  16          2HH1      ARG  16  -6.121  -6.070  -1.895
  157   1HH2  ARG  16          1HH2      ARG  16  -5.978  -8.250   0.834
  158   2HH2  ARG  16          2HH2      ARG  16  -6.253  -8.111  -0.871
  159    H    ASN  17           HN       ASN  17  -6.157   0.797   2.633
  160    HA   ASN  17           HA       ASN  17  -4.636   2.175   0.777
  161   1HB   ASN  17          HB2       ASN  17  -6.504   2.750   2.868
  162   2HB   ASN  17          HB1       ASN  17  -5.270   3.947   2.824
  163   1HD2  ASN  17          HD21      ASN  17  -7.374   5.097   2.310
  164   2HD2  ASN  17          HD22      ASN  17  -7.707   5.301   0.636
  165    HA   PRO  18           HA       PRO  18  -1.640   3.869   4.052
  166   1HB   PRO  18          HB2       PRO  18  -1.841   2.791   6.585
  167   2HB   PRO  18          HB1       PRO  18  -2.445   4.377   6.095
  168   1HG   PRO  18          HG2       PRO  18  -3.886   1.774   6.238
  169   2HG   PRO  18          HG1       PRO  18  -4.424   3.382   6.759
  170   1HD   PRO  18          HD2       PRO  18  -5.280   2.403   4.467
  171   2HD   PRO  18          HD1       PRO  18  -4.775   4.096   4.564
  172    H    ILE  19           HN       ILE  19  -2.773   0.667   4.030
  173    HA   ILE  19           HA       ILE  19  -0.327  -0.545   4.921
  174    HB   ILE  19           HB       ILE  19  -2.721  -1.742   3.544
  175   1HG1  ILE  19          HG12      ILE  19  -1.835  -1.570   6.418
  176   2HG1  ILE  19          HG11      ILE  19  -3.275  -0.873   5.714
  177   1HG2  ILE  19          HG21      ILE  19  -1.486  -3.562   3.199
  178   2HG2  ILE  19          HG22      ILE  19  -1.378  -3.745   4.950
  179   3HG2  ILE  19          HG23      ILE  19  -0.121  -2.872   4.077
  180   1HD1  ILE  19          HD11      ILE  19  -2.716  -3.786   6.176
  181   2HD1  ILE  19          HD12      ILE  19  -4.106  -3.175   5.279
  182   3HD1  ILE  19          HD13      ILE  19  -3.913  -2.777   6.986
  183    H    LEU  20           HN       LEU  20  -1.613   0.362   1.832
  184    HA   LEU  20           HA       LEU  20   0.360  -1.154   0.365
  185   1HB   LEU  20          HB2       LEU  20  -0.502  -0.211  -1.610
  186   2HB   LEU  20          HB1       LEU  20  -1.886  -0.508  -0.582
  187    HG   LEU  20           HG       LEU  20  -0.979   2.155  -0.130
  188   1HD1  LEU  20          HD11      LEU  20  -1.595   1.571  -3.018
  189   2HD1  LEU  20          HD12      LEU  20   0.018   1.918  -2.395
  190   3HD1  LEU  20          HD13      LEU  20  -1.247   3.142  -2.297
  191   1HD2  LEU  20          HD21      LEU  20  -3.449   1.190  -1.530
  192   2HD2  LEU  20          HD22      LEU  20  -3.231   2.689  -0.622
  193   3HD2  LEU  20          HD23      LEU  20  -3.208   1.137   0.217
  194    H    VAL  21           HN       VAL  21  -0.184   2.081   1.501
  195    HA   VAL  21           HA       VAL  21   1.970   3.448   0.424
  196    HB   VAL  21           HB       VAL  21   0.368   3.549   2.916
  197   1HG1  VAL  21          HG11      VAL  21   2.683   4.054   3.479
  198   2HG1  VAL  21          HG12      VAL  21   1.586   5.418   3.743
  199   3HG1  VAL  21          HG13      VAL  21   2.647   5.394   2.332
  200   1HG2  VAL  21          HG21      VAL  21   0.749   5.504   0.658
  201   2HG2  VAL  21          HG22      VAL  21  -0.366   5.695   2.014
  202   3HG2  VAL  21          HG23      VAL  21  -0.597   4.379   0.855
  203    H    PHE  22           HN       PHE  22   1.469   1.795   3.463
  204    HA   PHE  22           HA       PHE  22   3.942   1.990   4.672
  205   1HB   PHE  22          HB2       PHE  22   2.439   1.106   6.118
  206   2HB   PHE  22          HB1       PHE  22   1.498   0.404   4.825
  207    HD1  PHE  22           HD1      PHE  22   1.296  -1.703   4.754
  208    HD2  PHE  22           HD2      PHE  22   4.781  -0.039   6.389
  209    HE1  PHE  22           HE1      PHE  22   2.092  -3.979   5.292
  210    HE2  PHE  22           HE2      PHE  22   5.636  -2.271   6.934
  211    HZ   PHE  22           HZ       PHE  22   4.287  -4.262   6.366
  212    H    LEU  23           HN       LEU  23   2.751  -0.016   2.140
  213    HA   LEU  23           HA       LEU  23   5.074  -1.820   2.058
  214   1HB   LEU  23          HB2       LEU  23   2.674  -1.409   0.290
  215   2HB   LEU  23          HB1       LEU  23   4.034  -2.351  -0.279
  216    HG   LEU  23           HG       LEU  23   1.938  -3.445   0.900
  217   1HD1  LEU  23          HD11      LEU  23   3.818  -5.114   1.861
  218   2HD1  LEU  23          HD12      LEU  23   4.796  -4.148   0.752
  219   3HD1  LEU  23          HD13      LEU  23   3.383  -5.018   0.154
  220   1HD2  LEU  23          HD21      LEU  23   3.674  -3.446   3.260
  221   2HD2  LEU  23          HD22      LEU  23   1.913  -3.441   3.137
  222   3HD2  LEU  23          HD23      LEU  23   2.820  -1.937   2.927
  223    H    LYS  24           HN       LYS  24   3.897   0.964   0.537
  224    HA   LYS  24           HA       LYS  24   5.680   1.128  -1.625
  225   1HB   LYS  24          HB2       LYS  24   3.473   2.531  -0.516
  226   2HB   LYS  24          HB1       LYS  24   4.703   3.686  -0.909
  227   1HG   LYS  24          HG2       LYS  24   3.948   3.592  -2.997
  228   2HG   LYS  24          HG1       LYS  24   4.592   1.949  -3.059
  229   1HD   LYS  24          HD2       LYS  24   2.329   1.418  -1.804
  230   2HD   LYS  24          HD1       LYS  24   1.804   2.872  -2.663
  231   1HE   LYS  24          HE2       LYS  24   3.016   1.600  -4.679
  232   2HE   LYS  24          HE1       LYS  24   2.553   0.202  -3.712
  233   1HZ   LYS  24          HZ1       LYS  24   0.563   2.288  -4.302
  234   2HZ   LYS  24          HZ2       LYS  24   0.327   0.644  -3.979
  235   3HZ   LYS  24          HZ3       LYS  24   0.934   1.131  -5.481
  236    H    THR  25           HN       THR  25   5.576   2.532   1.545
  237    HA   THR  25           HA       THR  25   7.913   4.080   1.300
  238    HB   THR  25           HB       THR  25   6.327   4.778   2.917
  239    HG1  THR  25           HG1      THR  25   8.362   3.505   4.417
  240   1HG2  THR  25          HG21      THR  25   5.207   3.513   4.416
  241   2HG2  THR  25          HG22      THR  25   6.547   2.387   4.637
  242   3HG2  THR  25          HG23      THR  25   5.522   2.269   3.202
  243    H    ARG  26           HN       ARG  26   7.154   0.921   2.759
  244    HA   ARG  26           HA       ARG  26   9.674   0.390   3.849
  245   1HB   ARG  26          HB2       ARG  26   7.519  -1.350   2.688
  246   2HB   ARG  26          HB1       ARG  26   8.990  -2.049   3.357
  247   1HG   ARG  26          HG2       ARG  26   6.802  -0.573   4.761
  248   2HG   ARG  26          HG1       ARG  26   7.474  -2.155   5.110
  249   1HD   ARG  26          HD2       ARG  26   9.657  -0.821   5.564
  250   2HD   ARG  26          HD1       ARG  26   8.563   0.552   5.721
  251    HE   ARG  26           HE       ARG  26   7.403  -0.875   7.457
  252   1HH1  ARG  26          1HH1      ARG  26  10.826  -1.168   6.800
  253   2HH1  ARG  26          2HH1      ARG  26  11.201  -1.751   8.385
  254   1HH2  ARG  26          1HH2      ARG  26   7.907  -1.637   9.537
  255   2HH2  ARG  26          2HH2      ARG  26   9.549  -2.018   9.936
  256    H    VAL  27           HN       VAL  27   8.374  -0.090   0.659
  257    HA   VAL  27           HA       VAL  27  10.656  -1.325  -0.520
  258    HB   VAL  27           HB       VAL  27   8.003  -0.315  -1.325
  259   1HG1  VAL  27          HG11      VAL  27   8.594  -0.658  -3.744
  260   2HG1  VAL  27          HG12      VAL  27  10.283  -0.542  -3.248
  261   3HG1  VAL  27          HG13      VAL  27   9.188   0.814  -2.981
  262   1HG2  VAL  27          HG21      VAL  27   8.310  -2.637  -0.727
  263   2HG2  VAL  27          HG22      VAL  27   9.563  -2.816  -1.957
  264   3HG2  VAL  27          HG23      VAL  27   7.893  -2.510  -2.437
  265    H    LEU  28           HN       LEU  28   9.661   1.873   0.170
  266    HA   LEU  28           HA       LEU  28  11.189   3.227  -1.802
  267   1HB   LEU  28          HB2       LEU  28   9.868   4.948  -1.243
  268   2HB   LEU  28          HB1       LEU  28   8.956   3.787  -0.351
  269    HG   LEU  28           HG       LEU  28  10.133   4.387   1.689
  270   1HD1  LEU  28          HD11      LEU  28  12.137   5.316   1.521
  271   2HD1  LEU  28          HD12      LEU  28  11.310   6.830   1.157
  272   3HD1  LEU  28          HD13      LEU  28  11.867   5.791  -0.155
  273   1HD2  LEU  28          HD21      LEU  28   9.333   7.062   0.868
  274   2HD2  LEU  28          HD22      LEU  28   8.641   5.998   2.091
  275   3HD2  LEU  28          HD23      LEU  28   8.172   5.819   0.401
  276    H    LYS  29           HN       LYS  29  11.204   2.784   1.632
  277    HA   LYS  29           HA       LYS  29  13.670   4.083   2.100
  278   1HB   LYS  29          HB2       LYS  29  13.507   3.337   4.362
  279   2HB   LYS  29          HB1       LYS  29  11.884   3.763   3.839
  280   1HG   LYS  29          HG2       LYS  29  11.323   1.435   3.545
  281   2HG   LYS  29          HG1       LYS  29  12.978   0.958   3.933
  282   1HD   LYS  29          HD2       LYS  29  11.439   2.605   5.887
  283   2HD   LYS  29          HD1       LYS  29  11.097   0.879   5.759
  284   1HE   LYS  29          HE2       LYS  29  12.758   0.679   7.260
  285   2HE   LYS  29          HE1       LYS  29  13.803   0.857   5.851
  286   1HZ   LYS  29          HZ1       LYS  29  13.853   3.267   6.303
  287   2HZ   LYS  29          HZ2       LYS  29  14.519   2.350   7.559
  288   3HZ   LYS  29          HZ3       LYS  29  12.969   3.006   7.722
  289    H    ARG  30           HN       ARG  30  12.691   1.029   1.088
  290    HA   ARG  30           HA       ARG  30  15.145  -0.325   1.629
  291   1HB   ARG  30          HB2       ARG  30  12.540  -0.918   0.352
  292   2HB   ARG  30          HB1       ARG  30  13.883  -1.948  -0.061
  293   1HG   ARG  30          HG2       ARG  30  13.709  -1.512   2.772
  294   2HG   ARG  30          HG1       ARG  30  12.194  -2.125   2.126
  295   1HD   ARG  30          HD2       ARG  30  14.283  -3.615   0.928
  296   2HD   ARG  30          HD1       ARG  30  14.613  -3.542   2.659
  297    HE   ARG  30           HE       ARG  30  12.580  -5.052   1.380
  298   1HH1  ARG  30          1HH1      ARG  30  13.251  -3.226   4.276
  299   2HH1  ARG  30          2HH1      ARG  30  12.123  -4.111   5.246
  300   1HH2  ARG  30          1HH2      ARG  30  11.093  -6.216   2.653
  301   2HH2  ARG  30          2HH2      ARG  30  10.900  -5.809   4.326
  302    H    TRP  31           HN       TRP  31  13.545   1.442  -0.847
  303    HA   TRP  31           HA       TRP  31  15.197   0.856  -3.025
  304   1HB   TRP  31          HB2       TRP  31  12.813   2.210  -2.443
  305   2HB   TRP  31          HB1       TRP  31  13.869   3.356  -3.169
  306    HD1  TRP  31           HD1      TRP  31  11.958   0.347  -3.895
  307    HE1  TRP  31           HE1      TRP  31  12.094  -0.168  -6.407
  308    HE3  TRP  31           HE3      TRP  31  15.416   3.591  -4.902
  309    HZ2  TRP  31           HZ2      TRP  31  13.611   0.804  -8.598
  310    HZ3  TRP  31           HZ3      TRP  31  16.292   3.867  -7.247
  311    HH2  TRP  31           HH2      TRP  31  15.388   2.472  -9.064
  312    H    ARG  32           HN       ARG  32  14.884   3.368  -0.496
  313    HA   ARG  32           HA       ARG  32  16.954   5.083  -1.356
  314   1HB   ARG  32          HB2       ARG  32  15.894   4.273   1.314
  315   2HB   ARG  32          HB1       ARG  32  16.976   5.654   1.085
  316   1HG   ARG  32          HG2       ARG  32  15.312   6.694  -0.359
  317   2HG   ARG  32          HG1       ARG  32  14.245   5.325  -0.133
  318   1HD   ARG  32          HD2       ARG  32  13.709   5.889   1.974
  319   2HD   ARG  32          HD1       ARG  32  15.258   6.650   2.296
  320    HE   ARG  32           HE       ARG  32  12.942   7.883   1.003
  321   1HH1  ARG  32          1HH1      ARG  32  16.227   8.187   2.158
  322   2HH1  ARG  32          2HH1      ARG  32  16.210   9.917   2.111
  323   1HH2  ARG  32          1HH2      ARG  32  12.929  10.153   0.937
  324   2HH2  ARG  32          2HH2      ARG  32  14.342  11.032   1.418
  325    H    LEU  33           HN       LEU  33  16.786   2.409   0.834
  326    HA   LEU  33           HA       LEU  33  19.396   2.154   1.697
  327   1HB   LEU  33          HB2       LEU  33  16.909   0.561   1.453
  328   2HB   LEU  33          HB1       LEU  33  18.340  -0.248   1.947
  329    HG   LEU  33           HG       LEU  33  16.539   1.052   3.523
  330   1HD1  LEU  33          HD11      LEU  33  18.791  -0.555   3.865
  331   2HD1  LEU  33          HD12      LEU  33  17.624  -0.090   5.103
  332   3HD1  LEU  33          HD13      LEU  33  19.086   0.868   4.863
  333   1HD2  LEU  33          HD21      LEU  33  17.604   3.146   2.637
  334   2HD2  LEU  33          HD22      LEU  33  19.028   2.706   3.582
  335   3HD2  LEU  33          HD23      LEU  33  17.489   3.007   4.395
  336    H    PHE  34           HN       PHE  34  17.572   0.833  -0.874
  337    HA   PHE  34           HA       PHE  34  19.587  -0.953  -1.836
  338   1HB   PHE  34          HB2       PHE  34  16.876  -0.258  -2.494
  339   2HB   PHE  34          HB1       PHE  34  17.832  -0.639  -3.895
  340    HD1  PHE  34           HD1      PHE  34  18.234  -1.863  -0.534
  341    HD2  PHE  34           HD2      PHE  34  16.969  -2.736  -4.472
  342    HE1  PHE  34           HE1      PHE  34  18.091  -4.235   0.053
  343    HE2  PHE  34           HE2      PHE  34  16.807  -5.110  -3.915
  344    HZ   PHE  34           HZ       PHE  34  17.367  -5.891  -1.637
  345    H    SER  35           HN       SER  35  18.769   2.246  -2.084
  346    HA   SER  35           HA       SER  35  20.437   2.655  -4.506
  347   1HB   SER  35          HB2       SER  35  18.114   3.990  -3.643
  348   2HB   SER  35          HB1       SER  35  19.433   5.135  -3.425
  349    HG   SER  35           HG       SER  35  20.028   4.472  -5.659
  350    H    LYS  36           HN       LYS  36  20.533   2.980  -1.076
  351    HA   LYS  36           HA       LYS  36  22.833   4.761  -1.194
  352   1HB   LYS  36          HB2       LYS  36  22.502   5.191   1.040
  353   2HB   LYS  36          HB1       LYS  36  20.870   4.840   0.509
  354   1HG   LYS  36          HG2       LYS  36  21.023   3.695   2.498
  355   2HG   LYS  36          HG1       LYS  36  21.356   2.442   1.307
  356   1HD   LYS  36          HD2       LYS  36  23.830   3.641   1.925
  357   2HD   LYS  36          HD1       LYS  36  22.998   3.381   3.460
  358   1HE   LYS  36          HE2       LYS  36  22.990   1.110   3.230
  359   2HE   LYS  36          HE1       LYS  36  22.973   1.185   1.469
  360   1HZ   LYS  36          HZ1       LYS  36  25.295   1.650   3.257
  361   2HZ   LYS  36          HZ2       LYS  36  25.316   1.952   1.593
  362   3HZ   LYS  36          HZ3       LYS  36  25.087   0.377   2.163
  363    H    HIS  37           HN       HIS  37  22.104   1.480  -1.048
  364    HA   HIS  37           HA       HIS  37  24.502   0.580   0.226
  365   1HB   HIS  37          HB2       HIS  37  22.064  -0.596  -0.806
  366   2HB   HIS  37          HB1       HIS  37  23.471  -1.529  -1.276
  367    HD1  HIS  37           HD1      HIS  37  24.632  -2.893   0.528
  368    HD2  HIS  37           HD2      HIS  37  21.640  -0.418   2.003
  369    HE1  HIS  37           HE1      HIS  37  24.308  -3.589   2.923
  370    HE2  HIS  37           HE2      HIS  37  22.563  -2.010   3.823
  371    H    GLU  38           HN       GLU  38  23.308   0.544  -3.124
  372    HA   GLU  38           HA       GLU  38  25.940  -0.192  -4.093
  373   1HB   GLU  38          HB2       GLU  38  23.198  -0.159  -5.170
  374   2HB   GLU  38          HB1       GLU  38  24.453   0.245  -6.332
  375   1HG   GLU  38          HG2       GLU  38  24.537  -2.209  -4.609
  376   2HG   GLU  38          HG1       GLU  38  23.800  -2.174  -6.210
  Start of MODEL    8
    1   1H    VAL   1          HT1       VAL   1 -29.044   1.515  -0.124
    2   2H    VAL   1          HT2       VAL   1 -28.058   1.752   1.260
    3   3H    VAL   1          HT3       VAL   1 -29.767   1.720   1.417
    4    HA   VAL   1           HA       VAL   1 -29.908  -0.500   1.099
    5    HB   VAL   1           HB       VAL   1 -27.940  -1.850   0.289
    6   1HG1  VAL   1          HG11      VAL   1 -28.342  -0.238  -2.048
    7   2HG1  VAL   1          HG12      VAL   1 -29.852  -0.371  -1.145
    8   3HG1  VAL   1          HG13      VAL   1 -29.001  -1.827  -1.660
    9   1HG2  VAL   1          HG21      VAL   1 -26.867   0.902  -0.295
   10   2HG2  VAL   1          HG22      VAL   1 -26.255  -0.566  -1.057
   11   3HG2  VAL   1          HG23      VAL   1 -26.128  -0.360   0.690
   12    H    MET   2           HN       MET   2 -28.619  -2.404   2.190
   13    HA   MET   2           HA       MET   2 -28.138  -1.649   4.848
   14   1HB   MET   2          HB2       MET   2 -28.166  -4.111   3.248
   15   2HB   MET   2          HB1       MET   2 -27.094  -4.155   4.626
   16   1HG   MET   2          HG2       MET   2 -29.017  -3.418   6.042
   17   2HG   MET   2          HG1       MET   2 -30.042  -3.632   4.623
   18   1HE   MET   2          HE1       MET   2 -30.776  -4.652   7.058
   19   2HE   MET   2          HE2       MET   2 -30.401  -6.304   7.547
   20   3HE   MET   2          HE3       MET   2 -31.560  -6.010   6.250
   21    HA   PRO   3           HA       PRO   3 -23.721  -1.133   4.806
   22   1HB   PRO   3          HB2       PRO   3 -23.053  -1.666   7.293
   23   2HB   PRO   3          HB1       PRO   3 -24.392  -0.553   7.023
   24   1HG   PRO   3          HG2       PRO   3 -24.500  -3.494   7.589
   25   2HG   PRO   3          HG1       PRO   3 -25.332  -2.180   8.454
   26   1HD   PRO   3          HD2       PRO   3 -26.492  -3.630   6.422
   27   2HD   PRO   3          HD1       PRO   3 -26.945  -1.959   6.818
   28    H    LYS   4           HN       LYS   4 -21.837  -2.783   6.337
   29    HA   LYS   4           HA       LYS   4 -20.579  -4.659   6.215
   30   1HB   LYS   4          HB2       LYS   4 -22.835  -5.771   6.542
   31   2HB   LYS   4          HB1       LYS   4 -22.877  -5.996   4.800
   32   1HG   LYS   4          HG2       LYS   4 -21.219  -7.574   4.819
   33   2HG   LYS   4          HG1       LYS   4 -20.493  -6.950   6.302
   34   1HD   LYS   4          HD2       LYS   4 -22.289  -7.868   7.622
   35   2HD   LYS   4          HD1       LYS   4 -23.152  -8.368   6.167
   36   1HE   LYS   4          HE2       LYS   4 -22.161 -10.350   6.567
   37   2HE   LYS   4          HE1       LYS   4 -20.780  -9.594   5.773
   38   1HZ   LYS   4          HZ1       LYS   4 -21.133 -10.343   8.536
   39   2HZ   LYS   4          HZ2       LYS   4 -20.477  -8.798   8.325
   40   3HZ   LYS   4          HZ3       LYS   4 -19.711 -10.143   7.641
   41    H    GLN   5           HN       GLN   5 -22.180  -3.508   3.326
   42    HA   GLN   5           HA       GLN   5 -20.138  -4.731   1.663
   43   1HB   GLN   5          HB2       GLN   5 -21.792  -4.827   0.143
   44   2HB   GLN   5          HB1       GLN   5 -22.863  -4.112   1.337
   45   1HG   GLN   5          HG2       GLN   5 -23.162  -2.550  -0.210
   46   2HG   GLN   5          HG1       GLN   5 -21.646  -1.908   0.349
   47   1HE2  GLN   5          HE21      GLN   5 -19.761  -2.739  -0.793
   48   2HE2  GLN   5          HE22      GLN   5 -19.926  -2.995  -2.476
   49    H    ILE   6           HN       ILE   6 -21.088  -1.762   3.048
   50    HA   ILE   6           HA       ILE   6 -19.228  -0.196   1.508
   51    HB   ILE   6           HB       ILE   6 -19.995   1.598   3.212
   52   1HG1  ILE   6          HG12      ILE   6 -22.264   1.333   4.031
   53   2HG1  ILE   6          HG11      ILE   6 -22.351  -0.292   3.401
   54   1HG2  ILE   6          HG21      ILE   6 -21.822   2.175   1.719
   55   2HG2  ILE   6          HG22      ILE   6 -21.810   0.526   1.088
   56   3HG2  ILE   6          HG23      ILE   6 -20.415   1.579   0.833
   57   1HD1  ILE   6          HD11      ILE   6 -21.756   0.331   5.947
   58   2HD1  ILE   6          HD12      ILE   6 -20.133   0.250   5.260
   59   3HD1  ILE   6          HD13      ILE   6 -21.210  -1.144   5.152
   60    H    VAL   7           HN       VAL   7 -19.557  -1.857   4.506
   61    HA   VAL   7           HA       VAL   7 -17.414  -0.596   5.907
   62    HB   VAL   7           HB       VAL   7 -19.490  -2.013   6.781
   63   1HG1  VAL   7          HG11      VAL   7 -18.800  -4.080   5.630
   64   2HG1  VAL   7          HG12      VAL   7 -18.909  -4.282   7.379
   65   3HG1  VAL   7          HG13      VAL   7 -17.332  -4.113   6.607
   66   1HG2  VAL   7          HG21      VAL   7 -18.456  -2.092   8.856
   67   2HG2  VAL   7          HG22      VAL   7 -17.633  -0.792   7.995
   68   3HG2  VAL   7          HG23      VAL   7 -16.864  -2.370   8.151
   69    H    TYR   8           HN       TYR   8 -18.029  -3.399   3.971
   70    HA   TYR   8           HA       TYR   8 -15.563  -4.759   4.090
   71   1HB   TYR   8          HB2       TYR   8 -17.968  -5.093   2.755
   72   2HB   TYR   8          HB1       TYR   8 -16.832  -4.733   1.457
   73    HD1  TYR   8           HD1      TYR   8 -16.281  -6.750   0.435
   74    HD2  TYR   8           HD2      TYR   8 -16.409  -6.518   4.662
   75    HE1  TYR   8           HE1      TYR   8 -15.362  -8.972   0.582
   76    HE2  TYR   8           HE2      TYR   8 -15.500  -8.687   4.832
   77    HH   TYR   8           HH       TYR   8 -15.194 -10.827   2.116
   78    H    TRP   9           HN       TRP   9 -16.954  -2.315   1.963
   79    HA   TRP   9           HA       TRP   9 -14.752  -1.857   0.259
   80   1HB   TRP   9          HB2       TRP   9 -17.263  -0.509   1.003
   81   2HB   TRP   9          HB1       TRP   9 -15.963   0.609   0.587
   82    HD1  TRP   9           HD1      TRP   9 -18.602  -1.301  -0.951
   83    HE1  TRP   9           HE1      TRP   9 -18.184  -1.378  -3.523
   84    HE3  TRP   9           HE3      TRP   9 -13.909   0.302  -1.000
   85    HZ2  TRP   9           HZ2      TRP   9 -16.112  -0.814  -5.305
   86    HZ3  TRP   9           HZ3      TRP   9 -12.712   0.545  -3.142
   87    HH2  TRP   9           HH2      TRP   9 -13.825  -0.019  -5.257
   88    H    LYS  10           HN       LYS  10 -16.040   0.012   2.826
   89    HA   LYS  10           HA       LYS  10 -14.047   1.812   3.331
   90   1HB   LYS  10          HB2       LYS  10 -16.142   2.063   4.406
   91   2HB   LYS  10          HB1       LYS  10 -16.028   0.477   5.152
   92   1HG   LYS  10          HG2       LYS  10 -13.812   1.850   6.078
   93   2HG   LYS  10          HG1       LYS  10 -15.121   3.030   6.104
   94   1HD   LYS  10          HD2       LYS  10 -16.355   0.836   7.129
   95   2HD   LYS  10          HD1       LYS  10 -14.711   0.618   7.731
   96   1HE   LYS  10          HE2       LYS  10 -15.161   3.278   8.197
   97   2HE   LYS  10          HE1       LYS  10 -16.750   2.571   8.487
   98   1HZ   LYS  10          HZ1       LYS  10 -15.170   2.700  10.443
   99   2HZ   LYS  10          HZ2       LYS  10 -14.299   1.453   9.705
  100   3HZ   LYS  10          HZ3       LYS  10 -15.907   1.203  10.165
  101    H    GLN  11           HN       GLN  11 -14.405  -1.386   4.848
  102    HA   GLN  11           HA       GLN  11 -11.898  -1.073   6.230
  103   1HB   GLN  11          HB2       GLN  11 -12.337  -3.139   7.234
  104   2HB   GLN  11          HB1       GLN  11 -13.925  -2.432   7.036
  105   1HG   GLN  11          HG2       GLN  11 -14.423  -3.847   5.201
  106   2HG   GLN  11          HG1       GLN  11 -12.754  -4.380   5.076
  107   1HE2  GLN  11          HE21      GLN  11 -13.152  -4.345   8.316
  108   2HE2  GLN  11          HE22      GLN  11 -13.758  -5.941   8.555
  109    H    TRP  12           HN       TRP  12 -12.400  -1.389   3.151
  110    HA   TRP  12           HA       TRP  12 -10.132  -3.211   2.682
  111   1HB   TRP  12          HB2       TRP  12 -12.391  -3.738   1.632
  112   2HB   TRP  12          HB1       TRP  12 -12.156  -2.367   0.618
  113    HD1  TRP  12           HD1      TRP  12 -11.308  -5.898   0.905
  114    HE1  TRP  12           HE1      TRP  12  -9.618  -6.532  -0.910
  115    HE3  TRP  12           HE3      TRP  12 -10.234  -1.311  -0.588
  116    HZ2  TRP  12           HZ2      TRP  12  -8.020  -5.182  -2.809
  117    HZ3  TRP  12           HZ3      TRP  12  -8.606  -0.940  -2.445
  118    HH2  TRP  12           HH2      TRP  12  -7.510  -2.890  -3.539
  119    H    LEU  13           HN       LEU  13 -11.524  -0.018   1.881
  120    HA   LEU  13           HA       LEU  13  -9.012   0.616   0.526
  121   1HB   LEU  13          HB2       LEU  13 -10.096   2.258  -0.632
  122   2HB   LEU  13          HB1       LEU  13 -11.414   1.138  -0.379
  123    HG   LEU  13           HG       LEU  13 -12.300   3.271   0.007
  124   1HD1  LEU  13          HD11      LEU  13 -13.225   1.924   1.615
  125   2HD1  LEU  13          HD12      LEU  13 -12.645   3.303   2.546
  126   3HD1  LEU  13          HD13      LEU  13 -11.728   1.801   2.529
  127   1HD2  LEU  13          HD21      LEU  13 -10.595   4.206   2.161
  128   2HD2  LEU  13          HD22      LEU  13 -11.170   5.049   0.721
  129   3HD2  LEU  13          HD23      LEU  13  -9.732   4.030   0.632
  130    H    SER  14           HN       SER  14 -10.416   0.859   3.557
  131    HA   SER  14           HA       SER  14  -9.094   3.321   4.263
  132   1HB   SER  14          HB2       SER  14 -11.258   2.016   5.350
  133   2HB   SER  14          HB1       SER  14  -9.978   1.601   6.477
  134    HG   SER  14           HG       SER  14  -9.808   3.644   7.074
  135    H    LEU  15           HN       LEU  15  -8.752  -0.114   4.927
  136    HA   LEU  15           HA       LEU  15  -6.276   0.268   6.302
  137   1HB   LEU  15          HB2       LEU  15  -7.579  -2.285   5.385
  138   2HB   LEU  15          HB1       LEU  15  -6.307  -2.115   6.571
  139    HG   LEU  15           HG       LEU  15  -8.150  -2.415   7.917
  140   1HD1  LEU  15          HD11      LEU  15  -8.140   0.567   7.483
  141   2HD1  LEU  15          HD12      LEU  15  -7.013  -0.309   8.523
  142   3HD1  LEU  15          HD13      LEU  15  -8.734  -0.281   8.913
  143   1HD2  LEU  15          HD21      LEU  15 -10.129  -0.661   6.948
  144   2HD2  LEU  15          HD22      LEU  15 -10.138  -2.427   6.955
  145   3HD2  LEU  15          HD23      LEU  15  -9.479  -1.550   5.563
  146    H    ARG  16           HN       ARG  16  -7.222  -1.562   3.428
  147    HA   ARG  16           HA       ARG  16  -4.742  -2.228   2.492
  148   1HB   ARG  16          HB2       ARG  16  -7.258  -1.556   1.069
  149   2HB   ARG  16          HB1       ARG  16  -5.818  -1.872   0.138
  150   1HG   ARG  16          HG2       ARG  16  -7.223  -3.728   2.032
  151   2HG   ARG  16          HG1       ARG  16  -7.070  -3.890   0.281
  152   1HD   ARG  16          HD2       ARG  16  -4.559  -3.969   0.670
  153   2HD   ARG  16          HD1       ARG  16  -4.936  -4.179   2.378
  154    HE   ARG  16           HE       ARG  16  -5.457  -6.089   0.222
  155   1HH1  ARG  16          1HH1      ARG  16  -5.606  -5.312   3.628
  156   2HH1  ARG  16          2HH1      ARG  16  -5.854  -6.954   4.114
  157   1HH2  ARG  16          1HH2      ARG  16  -5.786  -8.244   0.870
  158   2HH2  ARG  16          2HH2      ARG  16  -5.957  -8.615   2.553
  159    H    ASN  17           HN       ASN  17  -6.209   0.852   2.491
  160    HA   ASN  17           HA       ASN  17  -4.692   2.182   0.583
  161   1HB   ASN  17          HB2       ASN  17  -6.582   2.807   2.651
  162   2HB   ASN  17          HB1       ASN  17  -5.365   4.018   2.559
  163   1HD2  ASN  17          HD21      ASN  17  -7.466   5.136   1.995
  164   2HD2  ASN  17          HD22      ASN  17  -7.810   5.257   0.315
  165    HA   PRO  18           HA       PRO  18  -1.739   3.991   3.860
  166   1HB   PRO  18          HB2       PRO  18  -1.978   2.979   6.416
  167   2HB   PRO  18          HB1       PRO  18  -2.583   4.545   5.875
  168   1HG   PRO  18          HG2       PRO  18  -4.008   1.938   6.057
  169   2HG   PRO  18          HG1       PRO  18  -4.565   3.552   6.536
  170   1HD   PRO  18          HD2       PRO  18  -5.381   2.521   4.254
  171   2HD   PRO  18          HD1       PRO  18  -4.880   4.217   4.317
  172    H    ILE  19           HN       ILE  19  -2.837   0.788   3.846
  173    HA   ILE  19           HA       ILE  19  -0.436  -0.400   4.844
  174    HB   ILE  19           HB       ILE  19  -2.771  -1.607   3.387
  175   1HG1  ILE  19          HG12      ILE  19  -1.959  -1.394   6.274
  176   2HG1  ILE  19          HG11      ILE  19  -3.439  -0.835   5.530
  177   1HG2  ILE  19          HG21      ILE  19  -1.720  -3.562   3.218
  178   2HG2  ILE  19          HG22      ILE  19  -1.219  -3.499   4.907
  179   3HG2  ILE  19          HG23      ILE  19  -0.230  -2.737   3.667
  180   1HD1  ILE  19          HD11      ILE  19  -3.431  -3.566   5.057
  181   2HD1  ILE  19          HD12      ILE  19  -4.387  -2.697   6.257
  182   3HD1  ILE  19          HD13      ILE  19  -2.828  -3.390   6.705
  183    H    LEU  20           HN       LEU  20  -1.651   0.337   1.675
  184    HA   LEU  20           HA       LEU  20   0.369  -1.092   0.257
  185   1HB   LEU  20          HB2       LEU  20  -0.408  -0.055  -1.718
  186   2HB   LEU  20          HB1       LEU  20  -1.822  -0.408  -0.750
  187    HG   LEU  20           HG       LEU  20  -0.966   2.242  -0.147
  188   1HD1  LEU  20          HD11      LEU  20  -1.698   2.130  -3.014
  189   2HD1  LEU  20          HD12      LEU  20  -0.024   1.777  -2.587
  190   3HD1  LEU  20          HD13      LEU  20  -0.743   3.323  -2.134
  191   1HD2  LEU  20          HD21      LEU  20  -3.198   2.773  -0.695
  192   2HD2  LEU  20          HD22      LEU  20  -3.201   1.168   0.039
  193   3HD2  LEU  20          HD23      LEU  20  -3.358   1.336  -1.710
  194    H    VAL  21           HN       VAL  21  -0.170   2.096   1.464
  195    HA   VAL  21           HA       VAL  21   2.004   3.492   0.495
  196    HB   VAL  21           HB       VAL  21   0.358   3.473   2.952
  197   1HG1  VAL  21          HG11      VAL  21   1.576   5.190   3.977
  198   2HG1  VAL  21          HG12      VAL  21   2.581   5.425   2.544
  199   3HG1  VAL  21          HG13      VAL  21   2.736   3.945   3.498
  200   1HG2  VAL  21          HG21      VAL  21  -0.553   4.423   0.916
  201   2HG2  VAL  21          HG22      VAL  21   0.804   5.552   0.819
  202   3HG2  VAL  21          HG23      VAL  21  -0.348   5.667   2.152
  203    H    PHE  22           HN       PHE  22   1.447   1.678   3.443
  204    HA   PHE  22           HA       PHE  22   3.910   1.820   4.688
  205   1HB   PHE  22          HB2       PHE  22   2.452   0.836   6.086
  206   2HB   PHE  22          HB1       PHE  22   1.475   0.230   4.769
  207    HD1  PHE  22           HD1      PHE  22   1.325  -1.909   4.449
  208    HD2  PHE  22           HD2      PHE  22   4.738  -0.319   6.311
  209    HE1  PHE  22           HE1      PHE  22   2.183  -4.196   4.754
  210    HE2  PHE  22           HE2      PHE  22   5.642  -2.575   6.651
  211    HZ   PHE  22           HZ       PHE  22   4.363  -4.537   5.855
  212    H    LEU  23           HN       LEU  23   2.755  -0.059   2.018
  213    HA   LEU  23           HA       LEU  23   5.179  -1.766   2.026
  214   1HB   LEU  23          HB2       LEU  23   2.917  -1.531   0.057
  215   2HB   LEU  23          HB1       LEU  23   4.315  -2.554  -0.214
  216    HG   LEU  23           HG       LEU  23   3.461  -3.382   2.259
  217   1HD1  LEU  23          HD11      LEU  23   1.452  -1.816   1.349
  218   2HD1  LEU  23          HD12      LEU  23   1.259  -3.139   2.511
  219   3HD1  LEU  23          HD13      LEU  23   0.932  -3.413   0.797
  220   1HD2  LEU  23          HD21      LEU  23   3.867  -5.186   0.987
  221   2HD2  LEU  23          HD22      LEU  23   3.407  -4.354  -0.497
  222   3HD2  LEU  23          HD23      LEU  23   2.168  -5.076   0.529
  223    H    LYS  24           HN       LYS  24   3.889   0.979   0.467
  224    HA   LYS  24           HA       LYS  24   5.678   1.214  -1.678
  225   1HB   LYS  24          HB2       LYS  24   3.473   2.588  -0.519
  226   2HB   LYS  24          HB1       LYS  24   4.707   3.751  -0.877
  227   1HG   LYS  24          HG2       LYS  24   3.960   3.726  -2.972
  228   2HG   LYS  24          HG1       LYS  24   4.569   2.073  -3.084
  229   1HD   LYS  24          HD2       LYS  24   2.304   1.542  -1.839
  230   2HD   LYS  24          HD1       LYS  24   1.802   3.039  -2.633
  231   1HE   LYS  24          HE2       LYS  24   1.355   1.778  -4.423
  232   2HE   LYS  24          HE1       LYS  24   3.100   1.659  -4.639
  233   1HZ   LYS  24          HZ1       LYS  24   1.273  -0.386  -4.045
  234   2HZ   LYS  24          HZ2       LYS  24   2.346  -0.246  -2.745
  235   3HZ   LYS  24          HZ3       LYS  24   2.941  -0.508  -4.306
  236    H    THR  25           HN       THR  25   5.591   2.480   1.543
  237    HA   THR  25           HA       THR  25   7.923   4.057   1.358
  238    HB   THR  25           HB       THR  25   6.328   4.697   2.991
  239    HG1  THR  25           HG1      THR  25   7.521   4.481   4.949
  240   1HG2  THR  25          HG21      THR  25   6.504   2.293   4.670
  241   2HG2  THR  25          HG22      THR  25   5.571   2.130   3.180
  242   3HG2  THR  25          HG23      THR  25   5.145   3.371   4.361
  243    H    ARG  26           HN       ARG  26   7.155   0.845   2.683
  244    HA   ARG  26           HA       ARG  26   9.673   0.280   3.780
  245   1HB   ARG  26          HB2       ARG  26   7.544  -1.436   2.534
  246   2HB   ARG  26          HB1       ARG  26   8.998  -2.137   3.238
  247   1HG   ARG  26          HG2       ARG  26   6.750  -0.706   4.595
  248   2HG   ARG  26          HG1       ARG  26   7.405  -2.299   4.924
  249   1HD   ARG  26          HD2       ARG  26   8.877   0.281   5.393
  250   2HD   ARG  26          HD1       ARG  26   7.968  -0.580   6.630
  251    HE   ARG  26           HE       ARG  26  10.547  -1.302   5.544
  252   1HH1  ARG  26          1HH1      ARG  26   7.739  -2.390   7.313
  253   2HH1  ARG  26          2HH1      ARG  26   8.579  -3.689   8.089
  254   1HH2  ARG  26          1HH2      ARG  26  11.649  -3.014   6.568
  255   2HH2  ARG  26          2HH2      ARG  26  10.795  -4.044   7.667
  256    H    VAL  27           HN       VAL  27   8.383  -0.062   0.573
  257    HA   VAL  27           HA       VAL  27  10.640  -1.284  -0.656
  258    HB   VAL  27           HB       VAL  27   8.005  -0.194  -1.419
  259   1HG1  VAL  27          HG11      VAL  27   8.590  -0.419  -3.848
  260   2HG1  VAL  27          HG12      VAL  27  10.282  -0.372  -3.353
  261   3HG1  VAL  27          HG13      VAL  27   9.225   0.997  -3.013
  262   1HG2  VAL  27          HG21      VAL  27   7.856  -2.329  -2.628
  263   2HG2  VAL  27          HG22      VAL  27   8.284  -2.548  -0.931
  264   3HG2  VAL  27          HG23      VAL  27   9.524  -2.685  -2.178
  265    H    LEU  28           HN       LEU  28   9.690   1.892   0.171
  266    HA   LEU  28           HA       LEU  28  11.250   3.309  -1.729
  267   1HB   LEU  28          HB2       LEU  28   9.943   5.019  -1.101
  268   2HB   LEU  28          HB1       LEU  28   9.015   3.833  -0.258
  269    HG   LEU  28           HG       LEU  28  10.208   4.328   1.802
  270   1HD1  LEU  28          HD11      LEU  28  11.961   5.766   0.016
  271   2HD1  LEU  28          HD12      LEU  28  12.215   5.259   1.686
  272   3HD1  LEU  28          HD13      LEU  28  11.405   6.788   1.342
  273   1HD2  LEU  28          HD21      LEU  28   8.728   5.929   2.279
  274   2HD2  LEU  28          HD22      LEU  28   8.259   5.840   0.582
  275   3HD2  LEU  28          HD23      LEU  28   9.433   7.045   1.110
  276    H    LYS  29           HN       LYS  29  11.228   2.731   1.689
  277    HA   LYS  29           HA       LYS  29  13.716   3.951   2.224
  278   1HB   LYS  29          HB2       LYS  29  13.528   3.125   4.450
  279   2HB   LYS  29          HB1       LYS  29  11.906   3.563   3.940
  280   1HG   LYS  29          HG2       LYS  29  11.374   1.233   3.535
  281   2HG   LYS  29          HG1       LYS  29  13.024   0.765   3.956
  282   1HD   LYS  29          HD2       LYS  29  11.419   2.340   5.913
  283   2HD   LYS  29          HD1       LYS  29  11.087   0.618   5.724
  284   1HE   LYS  29          HE2       LYS  29  12.792   0.187   7.082
  285   2HE   LYS  29          HE1       LYS  29  13.881   0.861   5.870
  286   1HZ   LYS  29          HZ1       LYS  29  13.492   1.826   8.386
  287   2HZ   LYS  29          HZ2       LYS  29  12.588   2.886   7.428
  288   3HZ   LYS  29          HZ3       LYS  29  14.233   2.656   7.112
  289    H    ARG  30           HN       ARG  30  12.691   0.954   1.079
  290    HA   ARG  30           HA       ARG  30  15.118  -0.466   1.566
  291   1HB   ARG  30          HB2       ARG  30  12.523  -0.946   0.225
  292   2HB   ARG  30          HB1       ARG  30  13.854  -1.972  -0.226
  293   1HG   ARG  30          HG2       ARG  30  13.654  -1.700   2.623
  294   2HG   ARG  30          HG1       ARG  30  12.132  -2.239   1.928
  295   1HD   ARG  30          HD2       ARG  30  14.709  -3.538   1.132
  296   2HD   ARG  30          HD1       ARG  30  13.895  -4.011   2.622
  297    HE   ARG  30           HE       ARG  30  11.927  -4.190   0.790
  298   1HH1  ARG  30          1HH1      ARG  30  15.183  -5.448   0.875
  299   2HH1  ARG  30          2HH1      ARG  30  14.800  -6.842  -0.077
  300   1HH2  ARG  30          1HH2      ARG  30  11.426  -6.022  -0.460
  301   2HH2  ARG  30          2HH2      ARG  30  12.669  -7.167  -0.838
  302    H    TRP  31           HN       TRP  31  13.579   1.457  -0.824
  303    HA   TRP  31           HA       TRP  31  15.252   0.964  -3.010
  304   1HB   TRP  31          HB2       TRP  31  12.882   2.321  -2.384
  305   2HB   TRP  31          HB1       TRP  31  13.963   3.492  -3.028
  306    HD1  TRP  31           HD1      TRP  31  12.015   0.562  -3.948
  307    HE1  TRP  31           HE1      TRP  31  12.183   0.183  -6.481
  308    HE3  TRP  31           HE3      TRP  31  15.546   3.794  -4.725
  309    HZ2  TRP  31           HZ2      TRP  31  13.749   1.243  -8.592
  310    HZ3  TRP  31           HZ3      TRP  31  16.464   4.179  -7.038
  311    HH2  TRP  31           HH2      TRP  31  15.563   2.901  -8.941
  312    H    ARG  32           HN       ARG  32  14.949   3.330  -0.346
  313    HA   ARG  32           HA       ARG  32  17.050   5.068  -1.066
  314   1HB   ARG  32          HB2       ARG  32  15.963   4.080   1.535
  315   2HB   ARG  32          HB1       ARG  32  17.059   5.461   1.412
  316   1HG   ARG  32          HG2       ARG  32  15.410   6.631   0.057
  317   2HG   ARG  32          HG1       ARG  32  14.329   5.258   0.163
  318   1HD   ARG  32          HD2       ARG  32  13.559   6.715   1.800
  319   2HD   ARG  32          HD1       ARG  32  14.495   5.509   2.667
  320    HE   ARG  32           HE       ARG  32  16.304   7.155   2.782
  321   1HH1  ARG  32          1HH1      ARG  32  13.088   8.344   2.074
  322   2HH1  ARG  32          2HH1      ARG  32  13.425   9.940   2.648
  323   1HH2  ARG  32          1HH2      ARG  32  16.733   9.255   3.533
  324   2HH2  ARG  32          2HH2      ARG  32  15.490  10.459   3.473
  325    H    LEU  33           HN       LEU  33  16.818   2.239   0.903
  326    HA   LEU  33           HA       LEU  33  19.411   1.882   1.790
  327   1HB   LEU  33          HB2       LEU  33  16.907   0.346   1.400
  328   2HB   LEU  33          HB1       LEU  33  18.316  -0.505   1.879
  329    HG   LEU  33           HG       LEU  33  16.486   0.721   3.484
  330   1HD1  LEU  33          HD11      LEU  33  19.262   0.191   4.465
  331   2HD1  LEU  33          HD12      LEU  33  18.222  -1.134   3.941
  332   3HD1  LEU  33          HD13      LEU  33  17.724  -0.098   5.278
  333   1HD2  LEU  33          HD21      LEU  33  17.598   2.852   2.761
  334   2HD2  LEU  33          HD22      LEU  33  18.991   2.331   3.709
  335   3HD2  LEU  33          HD23      LEU  33  17.439   2.604   4.503
  336    H    PHE  34           HN       PHE  34  17.596   0.774  -0.884
  337    HA   PHE  34           HA       PHE  34  19.611  -0.973  -1.937
  338   1HB   PHE  34          HB2       PHE  34  16.890  -0.254  -2.540
  339   2HB   PHE  34          HB1       PHE  34  17.840  -0.565  -3.963
  340    HD1  PHE  34           HD1      PHE  34  16.990  -2.643  -4.636
  341    HD2  PHE  34           HD2      PHE  34  18.259  -1.940  -0.664
  342    HE1  PHE  34           HE1      PHE  34  16.845  -5.039  -4.187
  343    HE2  PHE  34           HE2      PHE  34  18.123  -4.338  -0.183
  344    HZ   PHE  34           HZ       PHE  34  17.408  -5.920  -1.946
  345    H    SER  35           HN       SER  35  18.813   2.236  -2.005
  346    HA   SER  35           HA       SER  35  20.411   2.763  -4.452
  347   1HB   SER  35          HB2       SER  35  18.143   4.075  -3.440
  348   2HB   SER  35          HB1       SER  35  19.482   5.188  -3.190
  349    HG   SER  35           HG       SER  35  18.819   3.917  -5.635
  350    H    LYS  36           HN       LYS  36  20.519   3.153  -0.985
  351    HA   LYS  36           HA       LYS  36  22.836   4.870  -1.089
  352   1HB   LYS  36          HB2       LYS  36  22.557   5.178   1.152
  353   2HB   LYS  36          HB1       LYS  36  20.936   4.659   0.735
  354   1HG   LYS  36          HG2       LYS  36  21.264   2.521   1.640
  355   2HG   LYS  36          HG1       LYS  36  23.015   2.723   1.699
  356   1HD   LYS  36          HD2       LYS  36  22.002   2.917   3.923
  357   2HD   LYS  36          HD1       LYS  36  22.786   4.418   3.426
  358   1HE   LYS  36          HE2       LYS  36  20.142   4.607   2.522
  359   2HE   LYS  36          HE1       LYS  36  20.040   3.933   4.146
  360   1HZ   LYS  36          HZ1       LYS  36  21.293   5.772   4.996
  361   2HZ   LYS  36          HZ2       LYS  36  19.994   6.380   4.101
  362   3HZ   LYS  36          HZ3       LYS  36  21.551   6.390   3.442
  363    H    HIS  37           HN       HIS  37  22.209   1.524  -0.968
  364    HA   HIS  37           HA       HIS  37  24.742   0.702   0.053
  365   1HB   HIS  37          HB2       HIS  37  22.274  -0.553  -0.793
  366   2HB   HIS  37          HB1       HIS  37  23.664  -1.414  -1.419
  367    HD1  HIS  37           HD1      HIS  37  23.916  -3.379   0.081
  368    HD2  HIS  37           HD2      HIS  37  23.225   0.130   2.195
  369    HE1  HIS  37           HE1      HIS  37  24.118  -4.007   2.507
  370    HE2  HIS  37           HE2      HIS  37  23.761  -1.853   3.768
  371    H    GLU  38           HN       GLU  38  23.278   0.699  -3.182
  372    HA   GLU  38           HA       GLU  38  25.908   1.100  -4.352
  373   1HB   GLU  38          HB2       GLU  38  25.587  -0.740  -5.982
  374   2HB   GLU  38          HB1       GLU  38  25.767  -1.309  -4.328
  375   1HG   GLU  38          HG2       GLU  38  22.996  -0.890  -4.897
  376   2HG   GLU  38          HG1       GLU  38  23.717  -1.897  -6.153
  Start of MODEL    9
    1   1H    VAL   1          HT1       VAL   1 -29.639  -4.601   3.921
    2   2H    VAL   1          HT2       VAL   1 -29.718  -5.736   5.205
    3   3H    VAL   1          HT3       VAL   1 -28.250  -5.511   4.345
    4    HA   VAL   1           HA       VAL   1 -29.579  -3.741   6.257
    5    HB   VAL   1           HB       VAL   1 -27.341  -3.678   7.268
    6   1HG1  VAL   1          HG11      VAL   1 -28.605  -5.287   8.310
    7   2HG1  VAL   1          HG12      VAL   1 -27.236  -6.251   7.754
    8   3HG1  VAL   1          HG13      VAL   1 -28.752  -6.271   6.854
    9   1HG2  VAL   1          HG21      VAL   1 -26.303  -5.942   5.714
   10   2HG2  VAL   1          HG22      VAL   1 -25.478  -4.508   6.325
   11   3HG2  VAL   1          HG23      VAL   1 -26.402  -4.420   4.827
   12    H    MET   2           HN       MET   2 -28.519  -1.632   6.567
   13    HA   MET   2           HA       MET   2 -28.230  -0.285   4.083
   14   1HB   MET   2          HB2       MET   2 -28.470   0.407   6.941
   15   2HB   MET   2          HB1       MET   2 -27.596   1.553   5.954
   16   1HG   MET   2          HG2       MET   2 -30.280   0.526   5.154
   17   2HG   MET   2          HG1       MET   2 -30.103   1.887   6.260
   18   1HE   MET   2          HE1       MET   2 -30.175   0.478   2.952
   19   2HE   MET   2          HE2       MET   2 -28.550   0.940   2.444
   20   3HE   MET   2          HE3       MET   2 -29.951   1.807   1.815
   21    HA   PRO   3           HA       PRO   3 -23.693   0.199   5.385
   22   1HB   PRO   3          HB2       PRO   3 -22.867  -0.236   7.839
   23   2HB   PRO   3          HB1       PRO   3 -24.097   1.003   7.599
   24   1HG   PRO   3          HG2       PRO   3 -24.466  -1.857   8.416
   25   2HG   PRO   3          HG1       PRO   3 -25.083  -0.395   9.220
   26   1HD   PRO   3          HD2       PRO   3 -26.531  -1.884   7.391
   27   2HD   PRO   3          HD1       PRO   3 -26.814  -0.163   7.723
   28    H    LYS   4           HN       LYS   4 -21.885  -1.566   6.892
   29    HA   LYS   4           HA       LYS   4 -20.902  -3.605   6.864
   30   1HB   LYS   4          HB2       LYS   4 -23.321  -4.360   7.271
   31   2HB   LYS   4          HB1       LYS   4 -23.351  -4.754   5.558
   32   1HG   LYS   4          HG2       LYS   4 -22.837  -6.743   6.758
   33   2HG   LYS   4          HG1       LYS   4 -21.368  -6.218   5.933
   34   1HD   LYS   4          HD2       LYS   4 -20.361  -5.516   7.906
   35   2HD   LYS   4          HD1       LYS   4 -21.902  -5.386   8.759
   36   1HE   LYS   4          HE2       LYS   4 -21.264  -7.345   9.673
   37   2HE   LYS   4          HE1       LYS   4 -21.896  -8.018   8.171
   38   1HZ   LYS   4          HZ1       LYS   4 -19.503  -8.600   9.010
   39   2HZ   LYS   4          HZ2       LYS   4 -19.099  -7.150   8.239
   40   3HZ   LYS   4          HZ3       LYS   4 -19.816  -8.402   7.358
   41    H    GLN   5           HN       GLN   5 -22.491  -2.449   3.959
   42    HA   GLN   5           HA       GLN   5 -20.639  -3.972   2.321
   43   1HB   GLN   5          HB2       GLN   5 -22.395  -4.019   0.905
   44   2HB   GLN   5          HB1       GLN   5 -23.294  -2.997   2.008
   45   1HG   GLN   5          HG2       GLN   5 -23.385  -1.800   0.083
   46   2HG   GLN   5          HG1       GLN   5 -22.022  -1.052   0.876
   47   1HE2  GLN   5          HE21      GLN   5 -20.226  -3.208   0.213
   48   2HE2  GLN   5          HE22      GLN   5 -19.976  -3.107  -1.472
   49    H    ILE   6           HN       ILE   6 -21.246  -0.832   3.531
   50    HA   ILE   6           HA       ILE   6 -19.305   0.439   1.841
   51    HB   ILE   6           HB       ILE   6 -19.775   2.382   3.491
   52   1HG1  ILE   6          HG12      ILE   6 -22.010   2.412   4.429
   53   2HG1  ILE   6          HG11      ILE   6 -22.311   0.781   3.886
   54   1HG2  ILE   6          HG21      ILE   6 -21.591   3.105   2.059
   55   2HG2  ILE   6          HG22      ILE   6 -21.816   1.441   1.513
   56   3HG2  ILE   6          HG23      ILE   6 -20.321   2.300   1.134
   57   1HD1  ILE   6          HD11      ILE   6 -21.164  -0.121   5.611
   58   2HD1  ILE   6          HD12      ILE   6 -21.522   1.432   6.365
   59   3HD1  ILE   6          HD13      ILE   6 -19.951   1.162   5.608
   60    H    VAL   7           HN       VAL   7 -19.640  -1.026   4.948
   61    HA   VAL   7           HA       VAL   7 -17.303   0.072   6.166
   62    HB   VAL   7           HB       VAL   7 -19.475  -1.040   7.218
   63   1HG1  VAL   7          HG11      VAL   7 -19.120  -3.314   7.959
   64   2HG1  VAL   7          HG12      VAL   7 -17.583  -3.384   7.097
   65   3HG1  VAL   7          HG13      VAL   7 -19.094  -3.242   6.198
   66   1HG2  VAL   7          HG21      VAL   7 -18.254  -1.326   9.269
   67   2HG2  VAL   7          HG22      VAL   7 -17.659   0.082   8.389
   68   3HG2  VAL   7          HG23      VAL   7 -16.736  -1.419   8.378
   69    H    TYR   8           HN       TYR   8 -18.298  -2.788   4.472
   70    HA   TYR   8           HA       TYR   8 -15.960  -4.365   4.595
   71   1HB   TYR   8          HB2       TYR   8 -18.469  -4.530   3.373
   72   2HB   TYR   8          HB1       TYR   8 -17.329  -4.489   2.032
   73    HD1  TYR   8           HD1      TYR   8 -17.154  -6.683   1.268
   74    HD2  TYR   8           HD2      TYR   8 -16.993  -5.901   5.426
   75    HE1  TYR   8           HE1      TYR   8 -16.542  -8.978   1.674
   76    HE2  TYR   8           HE2      TYR   8 -16.379  -8.137   5.848
   77    HH   TYR   8           HH       TYR   8 -16.664 -10.634   3.572
   78    H    TRP   9           HN       TRP   9 -17.239  -1.969   2.355
   79    HA   TRP   9           HA       TRP   9 -15.110  -1.875   0.502
   80   1HB   TRP   9          HB2       TRP   9 -17.445  -0.245   1.256
   81   2HB   TRP   9          HB1       TRP   9 -16.084   0.708   0.663
   82    HD1  TRP   9           HD1      TRP   9 -18.963  -1.114  -0.531
   83    HE1  TRP   9           HE1      TRP   9 -18.720  -1.452  -3.105
   84    HE3  TRP   9           HE3      TRP   9 -14.180   0.102  -0.998
   85    HZ2  TRP   9           HZ2      TRP   9 -16.730  -1.213  -5.051
   86    HZ3  TRP   9           HZ3      TRP   9 -13.106   0.058  -3.222
   87    HH2  TRP   9           HH2      TRP   9 -14.392  -0.601  -5.207
   88    H    LYS  10           HN       LYS  10 -16.067   0.300   2.969
   89    HA   LYS  10           HA       LYS  10 -13.903   1.950   3.210
   90   1HB   LYS  10          HB2       LYS  10 -15.898   2.472   4.376
   91   2HB   LYS  10          HB1       LYS  10 -15.871   0.949   5.248
   92   1HG   LYS  10          HG2       LYS  10 -13.504   2.143   5.964
   93   2HG   LYS  10          HG1       LYS  10 -14.644   3.482   5.892
   94   1HD   LYS  10          HD2       LYS  10 -15.686   1.083   7.209
   95   2HD   LYS  10          HD1       LYS  10 -14.306   1.816   8.032
   96   1HE   LYS  10          HE2       LYS  10 -16.785   3.309   7.186
   97   2HE   LYS  10          HE1       LYS  10 -16.508   2.675   8.807
   98   1HZ   LYS  10          HZ1       LYS  10 -14.275   4.079   8.417
   99   2HZ   LYS  10          HZ2       LYS  10 -15.663   4.712   9.149
  100   3HZ   LYS  10          HZ3       LYS  10 -15.366   5.001   7.509
  101    H    GLN  11           HN       GLN  11 -14.434  -1.092   4.989
  102    HA   GLN  11           HA       GLN  11 -11.876  -0.909   6.272
  103   1HB   GLN  11          HB2       GLN  11 -12.401  -2.975   7.292
  104   2HB   GLN  11          HB1       GLN  11 -13.925  -2.117   7.181
  105   1HG   GLN  11          HG2       GLN  11 -14.562  -3.424   5.257
  106   2HG   GLN  11          HG1       GLN  11 -12.996  -4.213   5.242
  107   1HE2  GLN  11          HE21      GLN  11 -13.557  -3.992   8.451
  108   2HE2  GLN  11          HE22      GLN  11 -14.416  -5.467   8.702
  109    H    TRP  12           HN       TRP  12 -12.530  -1.368   3.210
  110    HA   TRP  12           HA       TRP  12 -10.353  -3.306   2.731
  111   1HB   TRP  12          HB2       TRP  12 -12.673  -3.728   1.782
  112   2HB   TRP  12          HB1       TRP  12 -12.426  -2.376   0.749
  113    HD1  TRP  12           HD1      TRP  12 -11.718  -5.940   1.028
  114    HE1  TRP  12           HE1      TRP  12 -10.203  -6.666  -0.903
  115    HE3  TRP  12           HE3      TRP  12 -10.574  -1.425  -0.611
  116    HZ2  TRP  12           HZ2      TRP  12  -8.710  -5.407  -2.947
  117    HZ3  TRP  12           HZ3      TRP  12  -9.089  -1.142  -2.599
  118    HH2  TRP  12           HH2      TRP  12  -8.165  -3.147  -3.749
  119    H    LEU  13           HN       LEU  13 -11.556  -0.074   1.889
  120    HA   LEU  13           HA       LEU  13  -9.040   0.371   0.453
  121   1HB   LEU  13          HB2       LEU  13 -10.097   1.941  -0.798
  122   2HB   LEU  13          HB1       LEU  13 -11.514   1.027  -0.330
  123    HG   LEU  13           HG       LEU  13 -12.161   3.238  -0.030
  124   1HD1  LEU  13          HD11      LEU  13 -12.897   3.186   2.068
  125   2HD1  LEU  13          HD12      LEU  13 -11.270   3.108   2.743
  126   3HD1  LEU  13          HD13      LEU  13 -12.054   1.641   2.162
  127   1HD2  LEU  13          HD21      LEU  13  -9.511   3.834  -0.007
  128   2HD2  LEU  13          HD22      LEU  13  -9.971   4.196   1.656
  129   3HD2  LEU  13          HD23      LEU  13 -10.806   4.985   0.318
  130    H    SER  14           HN       SER  14 -10.357   0.798   3.505
  131    HA   SER  14           HA       SER  14  -8.915   3.237   4.062
  132   1HB   SER  14          HB2       SER  14 -11.122   2.092   5.244
  133   2HB   SER  14          HB1       SER  14  -9.844   1.677   6.374
  134    HG   SER  14           HG       SER  14 -10.609   3.659   6.979
  135    H    LEU  15           HN       LEU  15  -8.722  -0.179   4.833
  136    HA   LEU  15           HA       LEU  15  -6.219   0.133   6.179
  137   1HB   LEU  15          HB2       LEU  15  -7.699  -2.369   5.390
  138   2HB   LEU  15          HB1       LEU  15  -6.384  -2.240   6.541
  139    HG   LEU  15           HG       LEU  15  -8.211  -2.340   7.943
  140   1HD1  LEU  15          HD11      LEU  15  -8.014   0.608   7.351
  141   2HD1  LEU  15          HD12      LEU  15  -6.906  -0.285   8.399
  142   3HD1  LEU  15          HD13      LEU  15  -8.606  -0.125   8.844
  143   1HD2  LEU  15          HD21      LEU  15 -10.213  -2.255   7.013
  144   2HD2  LEU  15          HD22      LEU  15  -9.518  -1.492   5.572
  145   3HD2  LEU  15          HD23      LEU  15 -10.077  -0.496   6.924
  146    H    ARG  16           HN       ARG  16  -7.293  -1.787   3.405
  147    HA   ARG  16           HA       ARG  16  -4.808  -2.561   2.521
  148   1HB   ARG  16          HB2       ARG  16  -7.413  -2.135   1.213
  149   2HB   ARG  16          HB1       ARG  16  -6.025  -2.364   0.170
  150   1HG   ARG  16          HG2       ARG  16  -5.800  -4.532   0.736
  151   2HG   ARG  16          HG1       ARG  16  -6.257  -4.231   2.414
  152   1HD   ARG  16          HD2       ARG  16  -8.372  -4.811   2.044
  153   2HD   ARG  16          HD1       ARG  16  -8.465  -3.807   0.602
  154    HE   ARG  16           HE       ARG  16  -7.792  -5.645  -0.701
  155   1HH1  ARG  16          1HH1      ARG  16  -8.023  -6.474   2.688
  156   2HH1  ARG  16          2HH1      ARG  16  -8.043  -8.179   2.391
  157   1HH2  ARG  16          1HH2      ARG  16  -7.816  -7.883  -1.081
  158   2HH2  ARG  16          2HH2      ARG  16  -7.924  -8.978   0.256
  159    H    ASN  17           HN       ASN  17  -6.181   0.531   2.361
  160    HA   ASN  17           HA       ASN  17  -4.684   1.635   0.260
  161   1HB   ASN  17          HB2       ASN  17  -6.541   2.494   2.268
  162   2HB   ASN  17          HB1       ASN  17  -5.300   3.667   2.052
  163   1HD2  ASN  17          HD21      ASN  17  -7.363   4.786   1.393
  164   2HD2  ASN  17          HD22      ASN  17  -7.732   4.744  -0.286
  165    HA   PRO  18           HA       PRO  18  -1.745   3.703   3.417
  166   1HB   PRO  18          HB2       PRO  18  -1.994   2.835   6.028
  167   2HB   PRO  18          HB1       PRO  18  -2.593   4.369   5.394
  168   1HG   PRO  18          HG2       PRO  18  -4.026   1.782   5.724
  169   2HG   PRO  18          HG1       PRO  18  -4.583   3.425   6.092
  170   1HD   PRO  18          HD2       PRO  18  -5.383   2.247   3.874
  171   2HD   PRO  18          HD1       PRO  18  -4.884   3.945   3.833
  172    H    ILE  19           HN       ILE  19  -2.829   0.496   3.618
  173    HA   ILE  19           HA       ILE  19  -0.442  -0.629   4.696
  174    HB   ILE  19           HB       ILE  19  -2.752  -1.907   3.261
  175   1HG1  ILE  19          HG12      ILE  19  -1.933  -1.604   6.139
  176   2HG1  ILE  19          HG11      ILE  19  -3.409  -1.055   5.383
  177   1HG2  ILE  19          HG21      ILE  19  -0.167  -3.004   3.717
  178   2HG2  ILE  19          HG22      ILE  19  -1.596  -3.797   3.059
  179   3HG2  ILE  19          HG23      ILE  19  -1.302  -3.807   4.797
  180   1HD1  ILE  19          HD11      ILE  19  -4.169  -3.344   5.134
  181   2HD1  ILE  19          HD12      ILE  19  -3.787  -2.987   6.818
  182   3HD1  ILE  19          HD13      ILE  19  -2.663  -3.930   5.840
  183    H    LEU  20           HN       LEU  20  -1.613  -0.116   1.475
  184    HA   LEU  20           HA       LEU  20   0.461  -1.575   0.170
  185   1HB   LEU  20          HB2       LEU  20  -0.312  -0.673  -1.877
  186   2HB   LEU  20          HB1       LEU  20  -1.722  -1.038  -0.909
  187    HG   LEU  20           HG       LEU  20  -0.991   1.686  -0.457
  188   1HD1  LEU  20          HD11      LEU  20  -0.413   2.511  -2.433
  189   2HD1  LEU  20          HD12      LEU  20  -1.817   1.761  -3.192
  190   3HD1  LEU  20          HD13      LEU  20  -0.304   0.866  -3.060
  191   1HD2  LEU  20          HD21      LEU  20  -3.248   2.080  -1.105
  192   2HD2  LEU  20          HD22      LEU  20  -3.178   0.578  -0.183
  193   3HD2  LEU  20          HD23      LEU  20  -3.330   0.526  -1.940
  194    H    VAL  21           HN       VAL  21  -0.155   1.678   1.141
  195    HA   VAL  21           HA       VAL  21   2.031   3.028   0.090
  196    HB   VAL  21           HB       VAL  21   0.303   3.201   2.484
  197   1HG1  VAL  21          HG11      VAL  21   2.641   3.792   3.062
  198   2HG1  VAL  21          HG12      VAL  21   1.444   5.061   3.358
  199   3HG1  VAL  21          HG13      VAL  21   2.502   5.153   1.948
  200   1HG2  VAL  21          HG21      VAL  21   0.757   5.065   0.162
  201   2HG2  VAL  21          HG22      VAL  21  -0.425   5.295   1.453
  202   3HG2  VAL  21          HG23      VAL  21  -0.578   3.923   0.349
  203    H    PHE  22           HN       PHE  22   1.388   1.486   3.178
  204    HA   PHE  22           HA       PHE  22   3.782   1.800   4.504
  205   1HB   PHE  22          HB2       PHE  22   2.303   0.887   5.919
  206   2HB   PHE  22          HB1       PHE  22   1.398   0.147   4.618
  207    HD1  PHE  22           HD1      PHE  22   4.598  -0.170   6.338
  208    HD2  PHE  22           HD2      PHE  22   1.328  -2.015   4.458
  209    HE1  PHE  22           HE1      PHE  22   5.559  -2.360   6.888
  210    HE2  PHE  22           HE2      PHE  22   2.238  -4.241   4.987
  211    HZ   PHE  22           HZ       PHE  22   4.378  -4.421   6.199
  212    H    LEU  23           HN       LEU  23   2.817  -0.328   1.942
  213    HA   LEU  23           HA       LEU  23   5.296  -1.937   2.196
  214   1HB   LEU  23          HB2       LEU  23   3.140  -1.924   0.097
  215   2HB   LEU  23          HB1       LEU  23   4.572  -2.932  -0.003
  216    HG   LEU  23           HG       LEU  23   3.552  -3.551   2.485
  217   1HD1  LEU  23          HD11      LEU  23   1.180  -3.792   0.772
  218   2HD1  LEU  23          HD12      LEU  23   1.586  -2.158   1.313
  219   3HD1  LEU  23          HD13      LEU  23   1.313  -3.443   2.499
  220   1HD2  LEU  23          HD21      LEU  23   3.506  -5.648   1.634
  221   2HD2  LEU  23          HD22      LEU  23   4.313  -4.887   0.263
  222   3HD2  LEU  23          HD23      LEU  23   2.572  -5.165   0.219
  223    H    LYS  24           HN       LYS  24   3.987   0.616   0.328
  224    HA   LYS  24           HA       LYS  24   5.898   0.753  -1.700
  225   1HB   LYS  24          HB2       LYS  24   3.591   2.135  -0.801
  226   2HB   LYS  24          HB1       LYS  24   4.817   3.320  -1.118
  227   1HG   LYS  24          HG2       LYS  24   4.220   3.162  -3.251
  228   2HG   LYS  24          HG1       LYS  24   4.955   1.559  -3.231
  229   1HD   LYS  24          HD2       LYS  24   2.949   0.738  -3.720
  230   2HD   LYS  24          HD1       LYS  24   2.493   1.155  -2.063
  231   1HE   LYS  24          HE2       LYS  24   1.005   1.994  -3.987
  232   2HE   LYS  24          HE1       LYS  24   1.461   3.142  -2.730
  233   1HZ   LYS  24          HZ1       LYS  24   3.211   2.966  -5.055
  234   2HZ   LYS  24          HZ2       LYS  24   2.750   4.317  -4.147
  235   3HZ   LYS  24          HZ3       LYS  24   1.693   3.674  -5.300
  236    H    THR  25           HN       THR  25   5.601   2.266   1.406
  237    HA   THR  25           HA       THR  25   7.890   3.886   1.253
  238    HB   THR  25           HB       THR  25   6.229   4.496   2.833
  239    HG1  THR  25           HG1      THR  25   7.408   4.609   4.699
  240   1HG2  THR  25          HG21      THR  25   5.183   3.168   4.368
  241   2HG2  THR  25          HG22      THR  25   6.518   2.019   4.446
  242   3HG2  THR  25          HG23      THR  25   5.437   2.021   3.049
  243    H    ARG  26           HN       ARG  26   7.207   0.668   2.587
  244    HA   ARG  26           HA       ARG  26   9.722   0.211   3.758
  245   1HB   ARG  26          HB2       ARG  26   7.663  -1.595   2.519
  246   2HB   ARG  26          HB1       ARG  26   9.127  -2.237   3.256
  247   1HG   ARG  26          HG2       ARG  26   6.821  -0.847   4.552
  248   2HG   ARG  26          HG1       ARG  26   7.529  -2.406   4.932
  249   1HD   ARG  26          HD2       ARG  26   9.591  -1.182   5.663
  250   2HD   ARG  26          HD1       ARG  26   8.685   0.317   5.460
  251    HE   ARG  26           HE       ARG  26   7.097  -1.096   7.105
  252   1HH1  ARG  26          1HH1      ARG  26  10.510  -0.370   7.210
  253   2HH1  ARG  26          2HH1      ARG  26  10.591  -0.404   8.939
  254   1HH2  ARG  26          1HH2      ARG  26   7.204  -1.139   9.380
  255   2HH2  ARG  26          2HH2      ARG  26   8.716  -0.840  10.170
  256    H    VAL  27           HN       VAL  27   8.485  -0.242   0.537
  257    HA   VAL  27           HA       VAL  27  10.859  -1.371  -0.583
  258    HB   VAL  27           HB       VAL  27   8.168  -0.502  -1.452
  259   1HG1  VAL  27          HG11      VAL  27   9.321   0.652  -3.105
  260   2HG1  VAL  27          HG12      VAL  27   8.826  -0.865  -3.855
  261   3HG1  VAL  27          HG13      VAL  27  10.493  -0.643  -3.324
  262   1HG2  VAL  27          HG21      VAL  27   8.785  -2.827  -0.766
  263   2HG2  VAL  27          HG22      VAL  27   9.766  -2.930  -2.230
  264   3HG2  VAL  27          HG23      VAL  27   8.021  -2.699  -2.351
  265    H    LEU  28           HN       LEU  28   9.695   1.771   0.080
  266    HA   LEU  28           HA       LEU  28  11.184   3.208  -1.861
  267   1HB   LEU  28          HB2       LEU  28   9.834   4.894  -1.238
  268   2HB   LEU  28          HB1       LEU  28   8.948   3.692  -0.374
  269    HG   LEU  28           HG       LEU  28  10.127   4.248   1.673
  270   1HD1  LEU  28          HD11      LEU  28  11.835   5.731  -0.140
  271   2HD1  LEU  28          HD12      LEU  28  12.131   5.189   1.511
  272   3HD1  LEU  28          HD13      LEU  28  11.289   6.711   1.222
  273   1HD2  LEU  28          HD21      LEU  28   8.140   5.686   0.456
  274   2HD2  LEU  28          HD22      LEU  28   9.296   6.938   0.907
  275   3HD2  LEU  28          HD23      LEU  28   8.643   5.856   2.137
  276    H    LYS  29           HN       LYS  29  11.197   2.652   1.552
  277    HA   LYS  29           HA       LYS  29  13.663   3.909   2.094
  278   1HB   LYS  29          HB2       LYS  29  13.486   2.999   4.309
  279   2HB   LYS  29          HB1       LYS  29  11.881   3.511   3.808
  280   1HG   LYS  29          HG2       LYS  29  11.301   1.207   3.276
  281   2HG   LYS  29          HG1       LYS  29  12.916   0.684   3.754
  282   1HD   LYS  29          HD2       LYS  29  11.465   0.252   5.591
  283   2HD   LYS  29          HD1       LYS  29  12.447   1.652   6.024
  284   1HE   LYS  29          HE2       LYS  29   9.766   2.017   4.747
  285   2HE   LYS  29          HE1       LYS  29   9.891   1.691   6.475
  286   1HZ   LYS  29          HZ1       LYS  29  10.428   4.105   5.035
  287   2HZ   LYS  29          HZ2       LYS  29  11.714   3.669   6.043
  288   3HZ   LYS  29          HZ3       LYS  29  10.165   3.874   6.690
  289    H    ARG  30           HN       ARG  30  12.708   0.945   0.810
  290    HA   ARG  30           HA       ARG  30  15.137  -0.466   1.373
  291   1HB   ARG  30          HB2       ARG  30  14.055  -2.269   0.477
  292   2HB   ARG  30          HB1       ARG  30  12.645  -1.300   0.742
  293   1HG   ARG  30          HG2       ARG  30  12.183  -1.332  -1.409
  294   2HG   ARG  30          HG1       ARG  30  13.751  -0.677  -1.813
  295   1HD   ARG  30          HD2       ARG  30  14.485  -3.185  -1.303
  296   2HD   ARG  30          HD1       ARG  30  12.817  -3.486  -1.788
  297    HE   ARG  30           HE       ARG  30  14.996  -2.608  -3.471
  298   1HH1  ARG  30          1HH1      ARG  30  11.534  -2.890  -3.125
  299   2HH1  ARG  30          2HH1      ARG  30  11.235  -2.836  -4.829
  300   1HH2  ARG  30          1HH2      ARG  30  14.602  -2.536  -5.713
  301   2HH2  ARG  30          2HH2      ARG  30  12.974  -2.633  -6.297
  302    H    TRP  31           HN       TRP  31  13.610   1.463  -0.990
  303    HA   TRP  31           HA       TRP  31  15.370   1.237  -3.138
  304   1HB   TRP  31          HB2       TRP  31  12.927   2.410  -2.484
  305   2HB   TRP  31          HB1       TRP  31  13.948   3.701  -2.983
  306    HD1  TRP  31           HD1      TRP  31  12.186   0.779  -4.226
  307    HE1  TRP  31           HE1      TRP  31  12.449   0.637  -6.776
  308    HE3  TRP  31           HE3      TRP  31  15.583   4.219  -4.594
  309    HZ2  TRP  31           HZ2      TRP  31  14.028   1.953  -8.731
  310    HZ3  TRP  31           HZ3      TRP  31  16.551   4.853  -6.829
  311    HH2  TRP  31           HH2      TRP  31  15.771   3.714  -8.868
  312    H    ARG  32           HN       ARG  32  14.917   3.448  -0.364
  313    HA   ARG  32           HA       ARG  32  16.983   5.274  -0.952
  314   1HB   ARG  32          HB2       ARG  32  15.816   4.193   1.575
  315   2HB   ARG  32          HB1       ARG  32  16.863   5.617   1.524
  316   1HG   ARG  32          HG2       ARG  32  15.230   6.744   0.105
  317   2HG   ARG  32          HG1       ARG  32  14.195   5.330   0.156
  318   1HD   ARG  32          HD2       ARG  32  13.728   5.586   2.400
  319   2HD   ARG  32          HD1       ARG  32  15.090   6.667   2.667
  320    HE   ARG  32           HE       ARG  32  13.284   7.842   0.849
  321   1HH1  ARG  32          1HH1      ARG  32  13.584   7.058   4.237
  322   2HH1  ARG  32          2HH1      ARG  32  12.541   8.341   4.754
  323   1HH2  ARG  32          1HH2      ARG  32  11.915   9.529   1.527
  324   2HH2  ARG  32          2HH2      ARG  32  11.593   9.744   3.215
  325    H    LEU  33           HN       LEU  33  16.753   2.382   0.939
  326    HA   LEU  33           HA       LEU  33  19.321   2.075   1.911
  327   1HB   LEU  33          HB2       LEU  33  16.885   0.475   1.363
  328   2HB   LEU  33          HB1       LEU  33  18.309  -0.354   1.846
  329    HG   LEU  33           HG       LEU  33  16.392   0.723   3.447
  330   1HD1  LEU  33          HD11      LEU  33  17.490  -0.900   4.566
  331   2HD1  LEU  33          HD12      LEU  33  18.440   0.444   5.199
  332   3HD1  LEU  33          HD13      LEU  33  19.037  -0.490   3.827
  333   1HD2  LEU  33          HD21      LEU  33  18.814   2.423   3.845
  334   2HD2  LEU  33          HD22      LEU  33  17.214   2.598   4.571
  335   3HD2  LEU  33          HD23      LEU  33  17.450   2.928   2.851
  336    H    PHE  34           HN       PHE  34  17.653   1.023  -0.879
  337    HA   PHE  34           HA       PHE  34  19.742  -0.626  -1.925
  338   1HB   PHE  34          HB2       PHE  34  17.051   0.110  -2.636
  339   2HB   PHE  34          HB1       PHE  34  18.080  -0.116  -4.019
  340    HD1  PHE  34           HD1      PHE  34  18.324  -1.676  -0.783
  341    HD2  PHE  34           HD2      PHE  34  17.283  -2.151  -4.853
  342    HE1  PHE  34           HE1      PHE  34  18.184  -4.097  -0.450
  343    HE2  PHE  34           HE2      PHE  34  17.123  -4.571  -4.551
  344    HZ   PHE  34           HZ       PHE  34  17.573  -5.577  -2.337
  345    H    SER  35           HN       SER  35  18.869   2.574  -1.879
  346    HA   SER  35           HA       SER  35  20.636   3.249  -4.172
  347   1HB   SER  35          HB2       SER  35  18.253   4.450  -3.294
  348   2HB   SER  35          HB1       SER  35  19.534   5.592  -2.900
  349    HG   SER  35           HG       SER  35  18.445   5.185  -5.239
  350    H    LYS  36           HN       LYS  36  20.530   3.386  -0.703
  351    HA   LYS  36           HA       LYS  36  22.750   5.229  -0.547
  352   1HB   LYS  36          HB2       LYS  36  22.291   5.419   1.668
  353   2HB   LYS  36          HB1       LYS  36  20.740   4.795   1.141
  354   1HG   LYS  36          HG2       LYS  36  21.245   2.618   1.936
  355   2HG   LYS  36          HG1       LYS  36  22.939   3.038   2.201
  356   1HD   LYS  36          HD2       LYS  36  21.616   2.971   4.290
  357   2HD   LYS  36          HD1       LYS  36  22.335   4.552   3.977
  358   1HE   LYS  36          HE2       LYS  36  19.600   4.087   2.940
  359   2HE   LYS  36          HE1       LYS  36  19.776   4.223   4.689
  360   1HZ   LYS  36          HZ1       LYS  36  19.342   6.342   3.380
  361   2HZ   LYS  36          HZ2       LYS  36  20.947   6.230   2.863
  362   3HZ   LYS  36          HZ3       LYS  36  20.600   6.380   4.511
  363    H    HIS  37           HN       HIS  37  22.270   1.848  -0.621
  364    HA   HIS  37           HA       HIS  37  24.805   1.122   0.483
  365   1HB   HIS  37          HB2       HIS  37  22.424  -0.226  -0.429
  366   2HB   HIS  37          HB1       HIS  37  23.854  -1.003  -1.079
  367    HD1  HIS  37           HD1      HIS  37  24.786  -2.754   0.399
  368    HD2  HIS  37           HD2      HIS  37  22.753   0.167   2.543
  369    HE1  HIS  37           HE1      HIS  37  24.874  -3.501   2.799
  370    HE2  HIS  37           HE2      HIS  37  23.727  -1.665   4.090
  371    H    GLU  38           HN       GLU  38  23.452   1.151  -2.802
  372    HA   GLU  38           HA       GLU  38  26.104   0.718  -3.911
  373   1HB   GLU  38          HB2       GLU  38  23.314   0.477  -4.887
  374   2HB   GLU  38          HB1       GLU  38  24.532   0.908  -6.076
  375   1HG   GLU  38          HG2       GLU  38  25.678  -1.096  -5.815
  376   2HG   GLU  38          HG1       GLU  38  24.931  -1.425  -4.252
  Start of MODEL   10
    1   1H    VAL   1          HT1       VAL   1 -27.266   1.231   1.455
    2   2H    VAL   1          HT2       VAL   1 -28.227   0.152   0.529
    3   3H    VAL   1          HT3       VAL   1 -27.251   1.324  -0.257
    4    HA   VAL   1           HA       VAL   1 -26.370  -0.938  -0.313
    5    HB   VAL   1           HB       VAL   1 -24.074  -0.242   0.590
    6   1HG1  VAL   1          HG11      VAL   1 -23.919   1.614  -1.191
    7   2HG1  VAL   1          HG12      VAL   1 -25.613   1.240  -1.510
    8   3HG1  VAL   1          HG13      VAL   1 -24.382  -0.009  -1.703
    9   1HG2  VAL   1          HG21      VAL   1 -25.311   1.465   2.158
   10   2HG2  VAL   1          HG22      VAL   1 -25.187   2.518   0.749
   11   3HG2  VAL   1          HG23      VAL   1 -23.729   1.847   1.478
   12    H    MET   2           HN       MET   2 -25.242  -2.596   0.839
   13    HA   MET   2           HA       MET   2 -26.429  -3.277   3.298
   14   1HB   MET   2          HB2       MET   2 -24.505  -4.440   1.402
   15   2HB   MET   2          HB1       MET   2 -24.306  -4.951   3.061
   16   1HG   MET   2          HG2       MET   2 -26.732  -5.554   3.079
   17   2HG   MET   2          HG1       MET   2 -26.746  -5.225   1.347
   18   1HE   MET   2          HE1       MET   2 -24.492  -7.766  -0.204
   19   2HE   MET   2          HE2       MET   2 -25.207  -6.153  -0.241
   20   3HE   MET   2          HE3       MET   2 -26.236  -7.577  -0.395
   21    HA   PRO   3           HA       PRO   3 -23.429  -1.679   6.146
   22   1HB   PRO   3          HB2       PRO   3 -23.630  -3.577   8.119
   23   2HB   PRO   3          HB1       PRO   3 -24.799  -2.292   7.846
   24   1HG   PRO   3          HG2       PRO   3 -25.097  -5.132   7.448
   25   2HG   PRO   3          HG1       PRO   3 -26.327  -3.867   7.327
   26   1HD   PRO   3          HD2       PRO   3 -24.888  -5.248   5.208
   27   2HD   PRO   3          HD1       PRO   3 -26.308  -4.194   5.095
   28    H    LYS   4           HN       LYS   4 -23.041  -5.015   5.374
   29    HA   LYS   4           HA       LYS   4 -20.315  -5.113   6.392
   30   1HB   LYS   4          HB2       LYS   4 -22.304  -7.111   5.418
   31   2HB   LYS   4          HB1       LYS   4 -20.597  -7.527   5.351
   32   1HG   LYS   4          HG2       LYS   4 -20.938  -6.516   7.906
   33   2HG   LYS   4          HG1       LYS   4 -22.399  -7.459   7.614
   34   1HD   LYS   4          HD2       LYS   4 -20.804  -8.937   8.576
   35   2HD   LYS   4          HD1       LYS   4 -20.906  -9.340   6.861
   36   1HE   LYS   4          HE2       LYS   4 -18.865  -7.353   7.702
   37   2HE   LYS   4          HE1       LYS   4 -18.581  -9.046   8.107
   38   1HZ   LYS   4          HZ1       LYS   4 -19.313  -9.212   5.532
   39   2HZ   LYS   4          HZ2       LYS   4 -17.710  -9.122   6.061
   40   3HZ   LYS   4          HZ3       LYS   4 -18.507  -7.725   5.537
   41    H    GLN   5           HN       GLN   5 -22.011  -4.610   3.479
   42    HA   GLN   5           HA       GLN   5 -19.852  -5.434   1.779
   43   1HB   GLN   5          HB2       GLN   5 -21.507  -5.591   0.276
   44   2HB   GLN   5          HB1       GLN   5 -22.601  -5.010   1.509
   45   1HG   GLN   5          HG2       GLN   5 -22.877  -3.732  -0.531
   46   2HG   GLN   5          HG1       GLN   5 -22.283  -2.743   0.752
   47   1HE2  GLN   5          HE21      GLN   5 -20.990  -4.641  -1.876
   48   2HE2  GLN   5          HE22      GLN   5 -19.807  -3.483  -2.282
   49    H    ILE   6           HN       ILE   6 -20.968  -2.503   3.193
   50    HA   ILE   6           HA       ILE   6 -19.179  -0.942   1.558
   51    HB   ILE   6           HB       ILE   6 -19.906   0.916   3.148
   52   1HG1  ILE   6          HG12      ILE   6 -22.146   0.657   4.083
   53   2HG1  ILE   6          HG11      ILE   6 -22.136  -1.027   3.670
   54   1HG2  ILE   6          HG21      ILE   6 -21.795   1.399   1.734
   55   2HG2  ILE   6          HG22      ILE   6 -21.868  -0.295   1.245
   56   3HG2  ILE   6          HG23      ILE   6 -20.475   0.694   0.799
   57   1HD1  ILE   6          HD11      ILE   6 -20.745  -1.568   5.366
   58   2HD1  ILE   6          HD12      ILE   6 -21.504  -0.147   6.076
   59   3HD1  ILE   6          HD13      ILE   6 -19.911  -0.019   5.325
   60    H    VAL   7           HN       VAL   7 -19.374  -2.447   4.657
   61    HA   VAL   7           HA       VAL   7 -17.209  -1.052   5.891
   62    HB   VAL   7           HB       VAL   7 -19.193  -2.452   6.948
   63   1HG1  VAL   7          HG11      VAL   7 -18.517  -4.569   5.871
   64   2HG1  VAL   7          HG12      VAL   7 -18.567  -4.676   7.629
   65   3HG1  VAL   7          HG13      VAL   7 -17.018  -4.532   6.798
   66   1HG2  VAL   7          HG21      VAL   7 -17.295  -1.145   7.991
   67   2HG2  VAL   7          HG22      VAL   7 -16.503  -2.706   8.199
   68   3HG2  VAL   7          HG23      VAL   7 -18.060  -2.398   8.966
   69    H    TYR   8           HN       TYR   8 -17.780  -3.982   4.118
   70    HA   TYR   8           HA       TYR   8 -15.243  -5.224   4.290
   71   1HB   TYR   8          HB2       TYR   8 -17.647  -5.803   3.057
   72   2HB   TYR   8          HB1       TYR   8 -16.577  -5.472   1.700
   73    HD1  TYR   8           HD1      TYR   8 -15.936  -7.525   0.809
   74    HD2  TYR   8           HD2      TYR   8 -15.941  -6.983   5.010
   75    HE1  TYR   8           HE1      TYR   8 -14.865  -9.667   1.085
   76    HE2  TYR   8           HE2      TYR   8 -14.882  -9.070   5.304
   77    HH   TYR   8           HH       TYR   8 -13.483 -10.864   2.737
   78    H    TRP   9           HN       TRP   9 -16.780  -2.951   2.086
   79    HA   TRP   9           HA       TRP   9 -14.600  -2.607   0.292
   80   1HB   TRP   9          HB2       TRP   9 -17.175  -1.323   0.896
   81   2HB   TRP   9          HB1       TRP   9 -15.934  -0.193   0.347
   82    HD1  TRP   9           HD1      TRP   9 -18.416  -2.495  -0.931
   83    HE1  TRP   9           HE1      TRP   9 -17.984  -2.848  -3.477
   84    HE3  TRP   9           HE3      TRP   9 -13.892  -0.507  -1.192
   85    HZ2  TRP   9           HZ2      TRP   9 -15.953  -2.333  -5.324
   86    HZ3  TRP   9           HZ3      TRP   9 -12.697  -0.429  -3.356
   87    HH2  TRP   9           HH2      TRP   9 -13.742  -1.345  -5.380
   88    H    LYS  10           HN       LYS  10 -15.962  -0.598   2.691
   89    HA   LYS  10           HA       LYS  10 -14.073   1.357   3.020
   90   1HB   LYS  10          HB2       LYS  10 -16.180   1.551   4.110
   91   2HB   LYS  10          HB1       LYS  10 -15.936   0.053   4.990
   92   1HG   LYS  10          HG2       LYS  10 -13.818   1.568   5.798
   93   2HG   LYS  10          HG1       LYS  10 -15.111   2.754   5.636
   94   1HD   LYS  10          HD2       LYS  10 -16.525   1.497   7.113
   95   2HD   LYS  10          HD1       LYS  10 -15.368   0.165   7.154
   96   1HE   LYS  10          HE2       LYS  10 -14.808   2.955   8.156
   97   2HE   LYS  10          HE1       LYS  10 -15.313   1.610   9.179
   98   1HZ   LYS  10          HZ1       LYS  10 -12.919   1.899   9.222
   99   2HZ   LYS  10          HZ2       LYS  10 -12.835   1.704   7.544
  100   3HZ   LYS  10          HZ3       LYS  10 -13.319   0.411   8.521
  101    H    GLN  11           HN       GLN  11 -14.232  -1.756   4.748
  102    HA   GLN  11           HA       GLN  11 -11.782  -1.231   6.144
  103   1HB   GLN  11          HB2       GLN  11 -12.048  -3.337   7.144
  104   2HB   GLN  11          HB1       GLN  11 -13.684  -2.751   6.936
  105   1HG   GLN  11          HG2       GLN  11 -14.034  -4.177   5.062
  106   2HG   GLN  11          HG1       GLN  11 -12.335  -4.611   5.004
  107   1HE2  GLN  11          HE21      GLN  11 -12.856  -4.591   8.226
  108   2HE2  GLN  11          HE22      GLN  11 -13.377  -6.219   8.451
  109    H    TRP  12           HN       TRP  12 -12.248  -1.730   3.046
  110    HA   TRP  12           HA       TRP  12  -9.801  -3.319   2.664
  111   1HB   TRP  12          HB2       TRP  12 -11.997  -4.037   1.588
  112   2HB   TRP  12          HB1       TRP  12 -11.843  -2.674   0.548
  113    HD1  TRP  12           HD1      TRP  12 -10.733  -6.124   0.927
  114    HE1  TRP  12           HE1      TRP  12  -8.965  -6.659  -0.846
  115    HE3  TRP  12           HE3      TRP  12 -10.000  -1.500  -0.648
  116    HZ2  TRP  12           HZ2      TRP  12  -7.444  -5.226  -2.746
  117    HZ3  TRP  12           HZ3      TRP  12  -8.370  -1.038  -2.486
  118    HH2  TRP  12           HH2      TRP  12  -7.102  -2.916  -3.517
  119    H    LEU  13           HN       LEU  13 -11.411  -0.259   1.829
  120    HA   LEU  13           HA       LEU  13  -8.982   0.597   0.453
  121   1HB   LEU  13          HB2       LEU  13 -11.668   1.957   0.722
  122   2HB   LEU  13          HB1       LEU  13 -10.311   2.573  -0.203
  123    HG   LEU  13           HG       LEU  13 -11.707  -0.036  -0.793
  124   1HD1  LEU  13          HD11      LEU  13 -12.408   1.465  -2.850
  125   2HD1  LEU  13          HD12      LEU  13 -12.247   2.754  -1.659
  126   3HD1  LEU  13          HD13      LEU  13 -13.365   1.421  -1.370
  127   1HD2  LEU  13          HD21      LEU  13 -10.016   1.514  -2.702
  128   2HD2  LEU  13          HD22      LEU  13 -10.379  -0.211  -2.666
  129   3HD2  LEU  13          HD23      LEU  13  -9.249   0.476  -1.501
  130    H    SER  14           HN       SER  14 -10.415   0.744   3.506
  131    HA   SER  14           HA       SER  14  -9.265   3.294   4.185
  132   1HB   SER  14          HB2       SER  14 -11.350   1.868   5.261
  133   2HB   SER  14          HB1       SER  14 -10.064   1.549   6.413
  134    HG   SER  14           HG       SER  14 -11.554   3.690   6.274
  135    H    LEU  15           HN       LEU  15  -8.686  -0.093   4.899
  136    HA   LEU  15           HA       LEU  15  -6.264   0.486   6.301
  137   1HB   LEU  15          HB2       LEU  15  -7.387  -2.158   5.405
  138   2HB   LEU  15          HB1       LEU  15  -6.132  -1.896   6.597
  139    HG   LEU  15           HG       LEU  15  -7.962  -2.282   7.944
  140   1HD1  LEU  15          HD11      LEU  15  -6.956  -0.093   8.506
  141   2HD1  LEU  15          HD12      LEU  15  -8.674  -0.169   8.900
  142   3HD1  LEU  15          HD13      LEU  15  -8.137   0.686   7.450
  143   1HD2  LEU  15          HD21      LEU  15  -9.923  -2.449   6.938
  144   2HD2  LEU  15          HD22      LEU  15  -9.326  -1.498   5.568
  145   3HD2  LEU  15          HD23      LEU  15 -10.049  -0.687   6.966
  146    H    ARG  16           HN       ARG  16  -7.064  -1.407   3.425
  147    HA   ARG  16           HA       ARG  16  -4.535  -1.916   2.516
  148   1HB   ARG  16          HB2       ARG  16  -7.051  -1.374   1.034
  149   2HB   ARG  16          HB1       ARG  16  -5.571  -1.616   0.142
  150   1HG   ARG  16          HG2       ARG  16  -6.935  -3.554   1.993
  151   2HG   ARG  16          HG1       ARG  16  -6.740  -3.691   0.244
  152   1HD   ARG  16          HD2       ARG  16  -4.289  -3.795   0.568
  153   2HD   ARG  16          HD1       ARG  16  -4.548  -3.765   2.309
  154    HE   ARG  16           HE       ARG  16  -5.415  -5.940   0.520
  155   1HH1  ARG  16          1HH1      ARG  16  -4.429  -4.796   3.677
  156   2HH1  ARG  16          2HH1      ARG  16  -4.411  -6.379   4.374
  157   1HH2  ARG  16          1HH2      ARG  16  -5.392  -8.014   1.450
  158   2HH2  ARG  16          2HH2      ARG  16  -4.957  -8.201   3.116
  159    H    ASN  17           HN       ASN  17  -6.222   1.055   2.460
  160    HA   ASN  17           HA       ASN  17  -4.746   2.520   0.636
  161   1HB   ASN  17          HB2       ASN  17  -6.657   2.975   2.734
  162   2HB   ASN  17          HB1       ASN  17  -5.497   4.242   2.694
  163   1HD2  ASN  17          HD21      ASN  17  -7.742   5.196   2.193
  164   2HD2  ASN  17          HD22      ASN  17  -8.059   5.417   0.518
  165    HA   PRO  18           HA       PRO  18  -1.918   4.304   4.080
  166   1HB   PRO  18          HB2       PRO  18  -2.089   2.989   6.511
  167   2HB   PRO  18          HB1       PRO  18  -2.764   4.582   6.153
  168   1HG   PRO  18          HG2       PRO  18  -4.073   1.911   6.068
  169   2HG   PRO  18          HG1       PRO  18  -4.707   3.453   6.669
  170   1HD   PRO  18          HD2       PRO  18  -5.450   2.562   4.299
  171   2HD   PRO  18          HD1       PRO  18  -5.065   4.275   4.515
  172    H    ILE  19           HN       ILE  19  -2.828   1.026   3.847
  173    HA   ILE  19           HA       ILE  19  -0.299  -0.074   4.645
  174    HB   ILE  19           HB       ILE  19  -2.474  -1.366   3.021
  175   1HG1  ILE  19          HG12      ILE  19  -1.849  -1.394   5.972
  176   2HG1  ILE  19          HG11      ILE  19  -3.281  -0.734   5.210
  177   1HG2  ILE  19          HG21      ILE  19  -0.248  -2.426   2.756
  178   2HG2  ILE  19          HG22      ILE  19  -1.436  -3.476   3.527
  179   3HG2  ILE  19          HG23      ILE  19  -0.204  -2.677   4.502
  180   1HD1  ILE  19          HD11      ILE  19  -4.014  -2.941   4.574
  181   2HD1  ILE  19          HD12      ILE  19  -3.697  -2.885   6.308
  182   3HD1  ILE  19          HD13      ILE  19  -2.532  -3.644   5.223
  183    H    LEU  20           HN       LEU  20  -1.678   0.998   1.677
  184    HA   LEU  20           HA       LEU  20   0.256  -0.112  -0.087
  185   1HB   LEU  20          HB2       LEU  20  -1.465   2.350  -0.465
  186   2HB   LEU  20          HB1       LEU  20  -0.548   1.553  -1.725
  187    HG   LEU  20           HG       LEU  20  -3.168   0.887  -0.595
  188   1HD1  LEU  20          HD11      LEU  20  -2.169  -0.263  -3.123
  189   2HD1  LEU  20          HD12      LEU  20  -2.258   1.496  -3.033
  190   3HD1  LEU  20          HD13      LEU  20  -3.704   0.524  -2.758
  191   1HD2  LEU  20          HD21      LEU  20  -2.952  -1.517  -0.897
  192   2HD2  LEU  20          HD22      LEU  20  -1.856  -0.944   0.363
  193   3HD2  LEU  20          HD23      LEU  20  -1.231  -1.333  -1.240
  194    H    VAL  21           HN       VAL  21  -0.215   2.937   1.521
  195    HA   VAL  21           HA       VAL  21   1.993   4.385   0.727
  196    HB   VAL  21           HB       VAL  21   0.274   4.144   3.123
  197   1HG1  VAL  21          HG11      VAL  21   2.744   5.840   2.986
  198   2HG1  VAL  21          HG12      VAL  21   2.470   4.442   4.025
  199   3HG1  VAL  21          HG13      VAL  21   1.518   5.916   4.256
  200   1HG2  VAL  21          HG21      VAL  21   0.885   6.420   1.248
  201   2HG2  VAL  21          HG22      VAL  21  -0.303   6.449   2.556
  202   3HG2  VAL  21          HG23      VAL  21  -0.515   5.346   1.190
  203    H    PHE  22           HN       PHE  22   1.436   2.304   3.488
  204    HA   PHE  22           HA       PHE  22   3.957   2.322   4.673
  205   1HB   PHE  22          HB2       PHE  22   2.477   1.340   6.058
  206   2HB   PHE  22          HB1       PHE  22   1.468   0.824   4.737
  207    HD1  PHE  22           HD1      PHE  22   4.753   0.091   6.161
  208    HD2  PHE  22           HD2      PHE  22   1.201  -1.281   4.388
  209    HE1  PHE  22           HE1      PHE  22   5.557  -2.212   6.407
  210    HE2  PHE  22           HE2      PHE  22   1.949  -3.617   4.629
  211    HZ   PHE  22           HZ       PHE  22   4.150  -4.082   5.622
  212    H    LEU  23           HN       LEU  23   2.635   0.672   1.975
  213    HA   LEU  23           HA       LEU  23   4.822  -1.237   1.625
  214   1HB   LEU  23          HB2       LEU  23   2.423  -0.454   0.004
  215   2HB   LEU  23          HB1       LEU  23   3.721  -1.342  -0.765
  216    HG   LEU  23           HG       LEU  23   1.615  -2.524   0.344
  217   1HD1  LEU  23          HD11      LEU  23   2.910  -4.030  -0.724
  218   2HD1  LEU  23          HD12      LEU  23   3.492  -4.391   0.901
  219   3HD1  LEU  23          HD13      LEU  23   4.407  -3.303  -0.143
  220   1HD2  LEU  23          HD21      LEU  23   3.433  -3.067   2.553
  221   2HD2  LEU  23          HD22      LEU  23   1.687  -2.802   2.552
  222   3HD2  LEU  23          HD23      LEU  23   2.792  -1.420   2.529
  223    H    LYS  24           HN       LYS  24   3.866   1.819   0.587
  224    HA   LYS  24           HA       LYS  24   5.645   2.195  -1.564
  225   1HB   LYS  24          HB2       LYS  24   3.513   3.531  -0.237
  226   2HB   LYS  24          HB1       LYS  24   4.794   4.668  -0.487
  227   1HG   LYS  24          HG2       LYS  24   4.026   4.900  -2.559
  228   2HG   LYS  24          HG1       LYS  24   4.572   3.247  -2.853
  229   1HD   LYS  24          HD2       LYS  24   2.313   2.644  -1.670
  230   2HD   LYS  24          HD1       LYS  24   1.845   4.252  -2.234
  231   1HE   LYS  24          HE2       LYS  24   1.250   3.135  -4.104
  232   2HE   LYS  24          HE1       LYS  24   2.967   3.266  -4.480
  233   1HZ   LYS  24          HZ1       LYS  24   3.268   1.077  -4.214
  234   2HZ   LYS  24          HZ2       LYS  24   1.592   0.963  -4.410
  235   3HZ   LYS  24          HZ3       LYS  24   2.262   0.982  -2.858
  236    H    THR  25           HN       THR  25   5.591   3.160   1.776
  237    HA   THR  25           HA       THR  25   8.045   4.564   1.727
  238    HB   THR  25           HB       THR  25   6.486   5.175   3.412
  239    HG1  THR  25           HG1      THR  25   7.678   4.741   5.334
  240   1HG2  THR  25          HG21      THR  25   6.556   2.535   4.768
  241   2HG2  THR  25          HG22      THR  25   5.459   2.770   3.404
  242   3HG2  THR  25          HG23      THR  25   5.336   3.808   4.829
  243    H    ARG  26           HN       ARG  26   7.038   1.329   2.839
  244    HA   ARG  26           HA       ARG  26   9.512   0.475   3.834
  245   1HB   ARG  26          HB2       ARG  26   7.217  -0.946   2.521
  246   2HB   ARG  26          HB1       ARG  26   8.616  -1.829   3.124
  247   1HG   ARG  26          HG2       ARG  26   6.543  -0.314   4.662
  248   2HG   ARG  26          HG1       ARG  26   7.068  -1.978   4.853
  249   1HD   ARG  26          HD2       ARG  26   9.286  -1.092   5.605
  250   2HD   ARG  26          HD1       ARG  26   8.572   0.520   5.582
  251    HE   ARG  26           HE       ARG  26   7.214  -1.493   7.185
  252   1HH1  ARG  26          1HH1      ARG  26   9.418   1.217   7.113
  253   2HH1  ARG  26          2HH1      ARG  26   9.228   1.571   8.796
  254   1HH2  ARG  26          1HH2      ARG  26   6.967  -1.024   9.396
  255   2HH2  ARG  26          2HH2      ARG  26   7.840   0.300  10.092
  256    H    VAL  27           HN       VAL  27   8.175   0.511   0.625
  257    HA   VAL  27           HA       VAL  27  10.335  -0.825  -0.662
  258    HB   VAL  27           HB       VAL  27   7.818   0.548  -1.395
  259   1HG1  VAL  27          HG11      VAL  27  10.109   0.246  -3.285
  260   2HG1  VAL  27          HG12      VAL  27   9.146   1.677  -2.919
  261   3HG1  VAL  27          HG13      VAL  27   8.434   0.344  -3.828
  262   1HG2  VAL  27          HG21      VAL  27   7.323  -1.488  -2.514
  263   2HG2  VAL  27          HG22      VAL  27   8.069  -1.914  -0.974
  264   3HG2  VAL  27          HG23      VAL  27   9.011  -1.999  -2.464
  265    H    LEU  28           HN       LEU  28   9.654   2.355   0.372
  266    HA   LEU  28           HA       LEU  28  11.316   3.786  -1.415
  267   1HB   LEU  28          HB2       LEU  28  10.267   5.561  -0.519
  268   2HB   LEU  28          HB1       LEU  28   9.221   4.398   0.214
  269    HG   LEU  28           HG       LEU  28  10.537   4.477   2.263
  270   1HD1  LEU  28          HD11      LEU  28  12.643   5.162   2.152
  271   2HD1  LEU  28          HD12      LEU  28  12.014   6.809   2.077
  272   3HD1  LEU  28          HD13      LEU  28  12.388   5.937   0.589
  273   1HD2  LEU  28          HD21      LEU  28   8.771   6.381   1.304
  274   2HD2  LEU  28          HD22      LEU  28  10.086   7.321   2.009
  275   3HD2  LEU  28          HD23      LEU  28   9.234   6.124   2.985
  276    H    LYS  29           HN       LYS  29  11.333   2.801   1.903
  277    HA   LYS  29           HA       LYS  29  13.988   3.591   2.447
  278   1HB   LYS  29          HB2       LYS  29  13.737   2.508   4.573
  279   2HB   LYS  29          HB1       LYS  29  12.224   3.322   4.201
  280   1HG   LYS  29          HG2       LYS  29  11.322   1.143   3.413
  281   2HG   LYS  29          HG1       LYS  29  12.803   0.377   3.989
  282   1HD   LYS  29          HD2       LYS  29  11.405   2.125   5.915
  283   2HD   LYS  29          HD1       LYS  29  10.574   0.632   5.481
  284   1HE   LYS  29          HE2       LYS  29  13.403   0.223   6.011
  285   2HE   LYS  29          HE1       LYS  29  12.549   0.911   7.391
  286   1HZ   LYS  29          HZ1       LYS  29  11.360  -1.372   5.981
  287   2HZ   LYS  29          HZ2       LYS  29  11.228  -0.926   7.607
  288   3HZ   LYS  29          HZ3       LYS  29  12.647  -1.651   7.044
  289    H    ARG  30           HN       ARG  30  12.530   0.994   0.880
  290    HA   ARG  30           HA       ARG  30  14.723  -0.837   1.185
  291   1HB   ARG  30          HB2       ARG  30  13.339  -2.350   0.183
  292   2HB   ARG  30          HB1       ARG  30  12.106  -1.211   0.610
  293   1HG   ARG  30          HG2       ARG  30  11.593  -0.892  -1.514
  294   2HG   ARG  30          HG1       ARG  30  13.251  -0.547  -1.937
  295   1HD   ARG  30          HD2       ARG  30  13.710  -2.937  -2.118
  296   2HD   ARG  30          HD1       ARG  30  12.045  -3.289  -1.664
  297    HE   ARG  30           HE       ARG  30  12.651  -1.732  -4.085
  298   1HH1  ARG  30          1HH1      ARG  30  11.194  -4.526  -2.566
  299   2HH1  ARG  30          2HH1      ARG  30  10.341  -5.004  -3.993
  300   1HH2  ARG  30          1HH2      ARG  30  11.528  -2.368  -5.953
  301   2HH2  ARG  30          2HH2      ARG  30  10.530  -3.783  -5.913
  302    H    TRP  31           HN       TRP  31  13.414   1.538  -0.903
  303    HA   TRP  31           HA       TRP  31  15.028   1.277  -3.158
  304   1HB   TRP  31          HB2       TRP  31  12.851   2.765  -2.243
  305   2HB   TRP  31          HB1       TRP  31  14.062   3.911  -2.661
  306    HD1  TRP  31           HD1      TRP  31  11.766   1.494  -4.103
  307    HE1  TRP  31           HE1      TRP  31  11.902   1.602  -6.664
  308    HE3  TRP  31           HE3      TRP  31  15.702   4.322  -4.300
  309    HZ2  TRP  31           HZ2      TRP  31  13.611   2.843  -8.557
  310    HZ3  TRP  31           HZ3      TRP  31  16.678   5.032  -6.510
  311    HH2  TRP  31           HH2      TRP  31  15.631   4.284  -8.609
  312    H    ARG  32           HN       ARG  32  15.042   3.201  -0.171
  313    HA   ARG  32           HA       ARG  32  17.320   4.768  -0.593
  314   1HB   ARG  32          HB2       ARG  32  16.111   3.473   1.820
  315   2HB   ARG  32          HB1       ARG  32  17.301   4.778   1.906
  316   1HG   ARG  32          HG2       ARG  32  14.683   5.084   0.465
  317   2HG   ARG  32          HG1       ARG  32  14.853   5.401   2.171
  318   1HD   ARG  32          HD2       ARG  32  16.868   6.855   1.361
  319   2HD   ARG  32          HD1       ARG  32  15.997   6.795  -0.171
  320    HE   ARG  32           HE       ARG  32  14.518   8.306   0.681
  321   1HH1  ARG  32          1HH1      ARG  32  16.126   6.734   3.348
  322   2HH1  ARG  32          2HH1      ARG  32  15.372   7.726   4.551
  323   1HH2  ARG  32          1HH2      ARG  32  13.524   9.610   2.259
  324   2HH2  ARG  32          2HH2      ARG  32  13.894   9.359   3.932
  325    H    LEU  33           HN       LEU  33  16.750   1.700   0.896
  326    HA   LEU  33           HA       LEU  33  19.287   0.906   1.663
  327   1HB   LEU  33          HB2       LEU  33  16.603  -0.229   1.123
  328   2HB   LEU  33          HB1       LEU  33  17.895  -1.320   1.414
  329    HG   LEU  33           HG       LEU  33  16.267  -0.143   3.251
  330   1HD1  LEU  33          HD11      LEU  33  17.992  -1.036   4.930
  331   2HD1  LEU  33          HD12      LEU  33  18.892  -1.563   3.507
  332   3HD1  LEU  33          HD13      LEU  33  17.268  -2.183   3.803
  333   1HD2  LEU  33          HD21      LEU  33  18.958   1.092   3.647
  334   2HD2  LEU  33          HD22      LEU  33  17.453   1.434   4.504
  335   3HD2  LEU  33          HD23      LEU  33  17.641   1.919   2.815
  336    H    PHE  34           HN       PHE  34  17.327   0.419  -1.096
  337    HA   PHE  34           HA       PHE  34  19.079  -1.382  -2.451
  338   1HB   PHE  34          HB2       PHE  34  16.490  -0.198  -2.884
  339   2HB   PHE  34          HB1       PHE  34  17.393  -0.413  -4.356
  340    HD1  PHE  34           HD1      PHE  34  16.243  -2.206  -5.327
  341    HD2  PHE  34           HD2      PHE  34  17.603  -2.345  -1.326
  342    HE1  PHE  34           HE1      PHE  34  15.745  -4.598  -5.262
  343    HE2  PHE  34           HE2      PHE  34  17.118  -4.743  -1.230
  344    HZ   PHE  34           HZ       PHE  34  16.174  -5.900  -3.204
  345    H    SER  35           HN       SER  35  18.714   1.880  -2.012
  346    HA   SER  35           HA       SER  35  20.365   2.584  -4.371
  347   1HB   SER  35          HB2       SER  35  18.338   4.022  -3.080
  348   2HB   SER  35          HB1       SER  35  19.830   4.845  -2.635
  349    HG   SER  35           HG       SER  35  19.368   5.739  -4.530
  350    H    LYS  36           HN       LYS  36  20.554   2.336  -0.893
  351    HA   LYS  36           HA       LYS  36  23.133   3.632  -0.784
  352   1HB   LYS  36          HB2       LYS  36  22.918   3.597   1.486
  353   2HB   LYS  36          HB1       LYS  36  21.229   3.450   1.038
  354   1HG   LYS  36          HG2       LYS  36  21.246   1.100   1.467
  355   2HG   LYS  36          HG1       LYS  36  22.995   1.107   1.707
  356   1HD   LYS  36          HD2       LYS  36  21.712   1.042   3.827
  357   2HD   LYS  36          HD1       LYS  36  22.767   2.449   3.693
  358   1HE   LYS  36          HE2       LYS  36  20.026   2.815   2.682
  359   2HE   LYS  36          HE1       LYS  36  20.163   2.559   4.422
  360   1HZ   LYS  36          HZ1       LYS  36  21.303   4.735   2.785
  361   2HZ   LYS  36          HZ2       LYS  36  21.954   4.359   4.300
  362   3HZ   LYS  36          HZ3       LYS  36  20.338   4.845   4.171
  363    H    HIS  37           HN       HIS  37  21.935   0.474  -1.218
  364    HA   HIS  37           HA       HIS  37  24.305  -0.920  -0.427
  365   1HB   HIS  37          HB2       HIS  37  21.638  -1.593  -1.313
  366   2HB   HIS  37          HB1       HIS  37  22.834  -2.564  -2.148
  367    HD1  HIS  37           HD1      HIS  37  23.356  -4.670  -0.970
  368    HD2  HIS  37           HD2      HIS  37  22.224  -1.665   1.667
  369    HE1  HIS  37           HE1      HIS  37  23.381  -5.732   1.310
  370    HE2  HIS  37           HE2      HIS  37  22.604  -3.920   2.878
  371    H    GLU  38           HN       GLU  38  22.807  -0.160  -3.559
  372    HA   GLU  38           HA       GLU  38  25.234  -0.979  -4.937
  373   1HB   GLU  38          HB2       GLU  38  22.405  -0.537  -5.680
  374   2HB   GLU  38          HB1       GLU  38  23.592  -0.137  -6.911
  375   1HG   GLU  38          HG2       GLU  38  24.512  -2.392  -6.766
  376   2HG   GLU  38          HG1       GLU  38  23.329  -2.791  -5.520
  Start of MODEL   11
    1   1H    VAL   1          HT1       VAL   1 -27.749   1.665   2.234
    2   2H    VAL   1          HT2       VAL   1 -27.116   2.739   1.055
    3   3H    VAL   1          HT3       VAL   1 -26.310   2.538   2.558
    4    HA   VAL   1           HA       VAL   1 -26.586   0.614   0.358
    5    HB   VAL   1           HB       VAL   1 -24.022   1.336   1.703
    6   1HG1  VAL   1          HG11      VAL   1 -23.544  -0.239   0.150
    7   2HG1  VAL   1          HG12      VAL   1 -23.477   1.169  -0.911
    8   3HG1  VAL   1          HG13      VAL   1 -24.932   0.173  -0.857
    9   1HG2  VAL   1          HG21      VAL   1 -25.064   3.506   1.244
   10   2HG2  VAL   1          HG22      VAL   1 -25.308   3.032  -0.436
   11   3HG2  VAL   1          HG23      VAL   1 -23.674   3.222   0.198
   12    H    MET   2           HN       MET   2 -25.226  -1.380   0.803
   13    HA   MET   2           HA       MET   2 -26.225  -2.681   3.080
   14   1HB   MET   2          HB2       MET   2 -24.540  -3.328   0.760
   15   2HB   MET   2          HB1       MET   2 -24.255  -4.302   2.181
   16   1HG   MET   2          HG2       MET   2 -26.530  -5.027   2.233
   17   2HG   MET   2          HG1       MET   2 -26.957  -3.886   0.958
   18   1HE   MET   2          HE1       MET   2 -26.422  -7.336   1.796
   19   2HE   MET   2          HE2       MET   2 -26.441  -8.084   0.199
   20   3HE   MET   2          HE3       MET   2 -27.762  -7.025   0.695
   21    HA   PRO   3           HA       PRO   3 -23.335  -0.954   6.089
   22   1HB   PRO   3          HB2       PRO   3 -23.848  -3.188   7.770
   23   2HB   PRO   3          HB1       PRO   3 -24.525  -1.572   7.893
   24   1HG   PRO   3          HG2       PRO   3 -25.670  -4.011   6.679
   25   2HG   PRO   3          HG1       PRO   3 -26.498  -2.638   7.437
   26   1HD   PRO   3          HD2       PRO   3 -26.520  -2.979   4.792
   27   2HD   PRO   3          HD1       PRO   3 -26.392  -1.353   5.501
   28    H    LYS   4           HN       LYS   4 -23.348  -4.190   4.912
   29    HA   LYS   4           HA       LYS   4 -20.668  -4.727   5.930
   30   1HB   LYS   4          HB2       LYS   4 -22.788  -6.390   4.614
   31   2HB   LYS   4          HB1       LYS   4 -21.133  -6.974   4.714
   32   1HG   LYS   4          HG2       LYS   4 -21.377  -7.564   6.839
   33   2HG   LYS   4          HG1       LYS   4 -22.056  -5.993   7.269
   34   1HD   LYS   4          HD2       LYS   4 -24.183  -6.955   6.046
   35   2HD   LYS   4          HD1       LYS   4 -23.434  -8.503   6.445
   36   1HE   LYS   4          HE2       LYS   4 -24.746  -8.141   8.301
   37   2HE   LYS   4          HE1       LYS   4 -23.208  -7.457   8.824
   38   1HZ   LYS   4          HZ1       LYS   4 -25.649  -6.037   7.954
   39   2HZ   LYS   4          HZ2       LYS   4 -24.141  -5.270   7.956
   40   3HZ   LYS   4          HZ3       LYS   4 -24.787  -5.867   9.400
   41    H    GLN   5           HN       GLN   5 -22.224  -3.774   3.014
   42    HA   GLN   5           HA       GLN   5 -20.022  -4.597   1.346
   43   1HB   GLN   5          HB2       GLN   5 -21.593  -4.569  -0.238
   44   2HB   GLN   5          HB1       GLN   5 -22.725  -4.030   0.975
   45   1HG   GLN   5          HG2       GLN   5 -22.849  -2.597  -0.968
   46   2HG   GLN   5          HG1       GLN   5 -22.266  -1.728   0.402
   47   1HE2  GLN   5          HE21      GLN   5 -20.967  -3.498  -2.306
   48   2HE2  GLN   5          HE22      GLN   5 -19.703  -2.385  -2.575
   49    H    ILE   6           HN       ILE   6 -21.089  -1.719   2.914
   50    HA   ILE   6           HA       ILE   6 -19.183  -0.115   1.471
   51    HB   ILE   6           HB       ILE   6 -19.890   1.627   3.220
   52   1HG1  ILE   6          HG12      ILE   6 -22.130   1.384   4.085
   53   2HG1  ILE   6          HG11      ILE   6 -22.264  -0.216   3.413
   54   1HG2  ILE   6          HG21      ILE   6 -20.352   1.618   0.822
   55   2HG2  ILE   6          HG22      ILE   6 -21.661   2.337   1.767
   56   3HG2  ILE   6          HG23      ILE   6 -21.822   0.694   1.137
   57   1HD1  ILE   6          HD11      ILE   6 -21.649   0.191   5.934
   58   2HD1  ILE   6          HD12      ILE   6 -20.022   0.354   5.266
   59   3HD1  ILE   6          HD13      ILE   6 -20.933  -1.129   5.016
   60    H    VAL   7           HN       VAL   7 -19.481  -1.876   4.416
   61    HA   VAL   7           HA       VAL   7 -17.276  -0.672   5.786
   62    HB   VAL   7           HB       VAL   7 -19.373  -1.953   6.741
   63   1HG1  VAL   7          HG11      VAL   7 -17.409  -4.226   6.509
   64   2HG1  VAL   7          HG12      VAL   7 -18.861  -4.059   5.524
   65   3HG1  VAL   7          HG13      VAL   7 -18.999  -4.264   7.269
   66   1HG2  VAL   7          HG21      VAL   7 -18.292  -2.092   8.764
   67   2HG2  VAL   7          HG22      VAL   7 -17.336  -0.915   7.865
   68   3HG2  VAL   7          HG23      VAL   7 -16.766  -2.575   8.027
   69    H    TYR   8           HN       TYR   8 -18.019  -3.458   3.853
   70    HA   TYR   8           HA       TYR   8 -15.593  -4.893   4.004
   71   1HB   TYR   8          HB2       TYR   8 -18.001  -4.895   2.365
   72   2HB   TYR   8          HB1       TYR   8 -16.558  -5.213   1.410
   73    HD1  TYR   8           HD1      TYR   8 -14.859  -6.618   3.247
   74    HD2  TYR   8           HD2      TYR   8 -19.040  -6.964   2.675
   75    HE1  TYR   8           HE1      TYR   8 -14.775  -8.801   4.132
   76    HE2  TYR   8           HE2      TYR   8 -18.976  -9.206   3.553
   77    HH   TYR   8           HH       TYR   8 -16.082 -10.935   4.022
   78    H    TRP   9           HN       TRP   9 -16.912  -2.425   1.862
   79    HA   TRP   9           HA       TRP   9 -14.686  -2.109   0.145
   80   1HB   TRP   9          HB2       TRP   9 -17.196  -0.737   0.778
   81   2HB   TRP   9          HB1       TRP   9 -15.892   0.380   0.370
   82    HD1  TRP   9           HD1      TRP   9 -18.377  -1.789  -1.148
   83    HE1  TRP   9           HE1      TRP   9 -17.923  -1.891  -3.714
   84    HE3  TRP   9           HE3      TRP   9 -13.874   0.250  -1.173
   85    HZ2  TRP   9           HZ2      TRP   9 -15.883  -1.179  -5.483
   86    HZ3  TRP   9           HZ3      TRP   9 -12.659   0.550  -3.312
   87    HH2  TRP   9           HH2      TRP   9 -13.680  -0.173  -5.423
   88    H    LYS  10           HN       LYS  10 -15.971  -0.154   2.651
   89    HA   LYS  10           HA       LYS  10 -13.945   1.645   3.093
   90   1HB   LYS  10          HB2       LYS  10 -16.035   1.953   4.179
   91   2HB   LYS  10          HB1       LYS  10 -15.932   0.391   4.971
   92   1HG   LYS  10          HG2       LYS  10 -13.700   1.716   5.865
   93   2HG   LYS  10          HG1       LYS  10 -14.939   2.968   5.809
   94   1HD   LYS  10          HD2       LYS  10 -15.795   0.395   6.949
   95   2HD   LYS  10          HD1       LYS  10 -14.576   1.261   7.886
   96   1HE   LYS  10          HE2       LYS  10 -16.272   3.280   7.311
   97   2HE   LYS  10          HE1       LYS  10 -17.400   1.927   7.366
   98   1HZ   LYS  10          HZ1       LYS  10 -16.648   3.296   9.512
   99   2HZ   LYS  10          HZ2       LYS  10 -15.482   2.071   9.542
  100   3HZ   LYS  10          HZ3       LYS  10 -17.126   1.674   9.572
  101    H    GLN  11           HN       GLN  11 -14.334  -1.530   4.661
  102    HA   GLN  11           HA       GLN  11 -11.873  -1.223   6.103
  103   1HB   GLN  11          HB2       GLN  11 -12.304  -3.363   7.005
  104   2HB   GLN  11          HB1       GLN  11 -13.880  -2.617   6.832
  105   1HG   GLN  11          HG2       GLN  11 -14.296  -3.880   4.816
  106   2HG   GLN  11          HG1       GLN  11 -12.676  -4.546   4.869
  107   1HE2  GLN  11          HE21      GLN  11 -13.438  -4.527   8.041
  108   2HE2  GLN  11          HE22      GLN  11 -14.196  -6.070   8.172
  109    H    TRP  12           HN       TRP  12 -12.336  -1.582   2.992
  110    HA   TRP  12           HA       TRP  12 -10.004  -3.341   2.549
  111   1HB   TRP  12          HB2       TRP  12 -12.246  -3.895   1.487
  112   2HB   TRP  12          HB1       TRP  12 -12.055  -2.498   0.503
  113    HD1  TRP  12           HD1      TRP  12 -11.125  -6.012   0.705
  114    HE1  TRP  12           HE1      TRP  12  -9.470  -6.573  -1.163
  115    HE3  TRP  12           HE3      TRP  12 -10.198  -1.378  -0.733
  116    HZ2  TRP  12           HZ2      TRP  12  -7.958  -5.153  -3.084
  117    HZ3  TRP  12           HZ3      TRP  12  -8.634  -0.934  -2.628
  118    HH2  TRP  12           HH2      TRP  12  -7.523  -2.837  -3.787
  119    H    LEU  13           HN       LEU  13 -11.406  -0.170   1.764
  120    HA   LEU  13           HA       LEU  13  -8.865   0.493   0.465
  121   1HB   LEU  13          HB2       LEU  13 -10.847   1.042  -0.827
  122   2HB   LEU  13          HB1       LEU  13 -11.521   1.945   0.515
  123    HG   LEU  13           HG       LEU  13  -8.896   2.933  -0.289
  124   1HD1  LEU  13          HD11      LEU  13 -10.237   2.057  -2.437
  125   2HD1  LEU  13          HD12      LEU  13  -9.215   3.494  -2.452
  126   3HD1  LEU  13          HD13      LEU  13 -10.962   3.656  -2.269
  127   1HD2  LEU  13          HD21      LEU  13 -10.771   4.934  -0.587
  128   2HD2  LEU  13          HD22      LEU  13  -9.846   4.582   0.872
  129   3HD2  LEU  13          HD23      LEU  13 -11.463   3.907   0.668
  130    H    SER  14           HN       SER  14 -10.322   0.689   3.474
  131    HA   SER  14           HA       SER  14  -9.096   3.220   4.167
  132   1HB   SER  14          HB2       SER  14 -11.278   1.881   5.206
  133   2HB   SER  14          HB1       SER  14 -10.028   1.548   6.392
  134    HG   SER  14           HG       SER  14 -10.541   4.159   5.439
  135    H    LEU  15           HN       LEU  15  -8.721  -0.201   4.867
  136    HA   LEU  15           HA       LEU  15  -6.313   0.229   6.349
  137   1HB   LEU  15          HB2       LEU  15  -7.575  -2.338   5.399
  138   2HB   LEU  15          HB1       LEU  15  -6.334  -2.163   6.625
  139    HG   LEU  15           HG       LEU  15  -8.217  -2.441   7.922
  140   1HD1  LEU  15          HD11      LEU  15  -8.827  -0.295   8.873
  141   2HD1  LEU  15          HD12      LEU  15  -8.206   0.534   7.443
  142   3HD1  LEU  15          HD13      LEU  15  -7.097  -0.317   8.522
  143   1HD2  LEU  15          HD21      LEU  15 -10.164  -0.705   6.874
  144   2HD2  LEU  15          HD22      LEU  15 -10.167  -2.471   6.885
  145   3HD2  LEU  15          HD23      LEU  15  -9.463  -1.595   5.514
  146    H    ARG  16           HN       ARG  16  -7.121  -1.646   3.460
  147    HA   ARG  16           HA       ARG  16  -4.562  -2.234   2.675
  148   1HB   ARG  16          HB2       ARG  16  -7.105  -1.859   1.225
  149   2HB   ARG  16          HB1       ARG  16  -5.642  -2.030   0.277
  150   1HG   ARG  16          HG2       ARG  16  -5.489  -4.214   0.716
  151   2HG   ARG  16          HG1       ARG  16  -5.852  -3.965   2.427
  152   1HD   ARG  16          HD2       ARG  16  -8.066  -4.324   2.154
  153   2HD   ARG  16          HD1       ARG  16  -8.087  -3.613   0.548
  154    HE   ARG  16           HE       ARG  16  -7.473  -5.680  -0.365
  155   1HH1  ARG  16          1HH1      ARG  16  -7.709  -5.840   3.119
  156   2HH1  ARG  16          2HH1      ARG  16  -7.768  -7.569   3.156
  157   1HH2  ARG  16          1HH2      ARG  16  -7.548  -7.953  -0.308
  158   2HH2  ARG  16          2HH2      ARG  16  -7.674  -8.767   1.215
  159    H    ASN  17           HN       ASN  17  -6.148   0.769   2.507
  160    HA   ASN  17           HA       ASN  17  -4.620   2.051   0.561
  161   1HB   ASN  17          HB2       ASN  17  -6.574   2.717   2.552
  162   2HB   ASN  17          HB1       ASN  17  -5.379   3.950   2.450
  163   1HD2  ASN  17          HD21      ASN  17  -7.478   5.011   1.789
  164   2HD2  ASN  17          HD22      ASN  17  -7.783   5.063   0.097
  165    HA   PRO  18           HA       PRO  18  -1.854   4.081   3.898
  166   1HB   PRO  18          HB2       PRO  18  -2.115   2.997   6.436
  167   2HB   PRO  18          HB1       PRO  18  -2.733   4.566   5.913
  168   1HG   PRO  18          HG2       PRO  18  -4.121   1.940   6.046
  169   2HG   PRO  18          HG1       PRO  18  -4.723   3.551   6.476
  170   1HD   PRO  18          HD2       PRO  18  -5.432   2.449   4.183
  171   2HD   PRO  18          HD1       PRO  18  -5.003   4.166   4.244
  172    H    ILE  19           HN       ILE  19  -2.812   0.809   3.945
  173    HA   ILE  19           HA       ILE  19  -0.323  -0.240   4.918
  174    HB   ILE  19           HB       ILE  19  -2.558  -1.618   3.444
  175   1HG1  ILE  19          HG12      ILE  19  -1.822  -1.350   6.351
  176   2HG1  ILE  19          HG11      ILE  19  -3.297  -0.821   5.575
  177   1HG2  ILE  19          HG21      ILE  19  -0.972  -3.405   5.012
  178   2HG2  ILE  19          HG22      ILE  19   0.068  -2.549   3.878
  179   3HG2  ILE  19          HG23      ILE  19  -1.321  -3.457   3.285
  180   1HD1  ILE  19          HD11      ILE  19  -2.650  -3.371   6.744
  181   2HD1  ILE  19          HD12      ILE  19  -3.214  -3.545   5.081
  182   3HD1  ILE  19          HD13      ILE  19  -4.215  -2.710   6.270
  183    H    LEU  20           HN       LEU  20  -1.581   0.536   1.801
  184    HA   LEU  20           HA       LEU  20   0.433  -0.793   0.272
  185   1HB   LEU  20          HB2       LEU  20  -1.276   1.578  -0.506
  186   2HB   LEU  20          HB1       LEU  20  -0.304   0.621  -1.604
  187    HG   LEU  20           HG       LEU  20  -2.971   0.116  -0.524
  188   1HD1  LEU  20          HD11      LEU  20  -3.149  -1.191  -2.609
  189   2HD1  LEU  20          HD12      LEU  20  -1.443  -0.872  -2.923
  190   3HD1  LEU  20          HD13      LEU  20  -2.595   0.462  -2.878
  191   1HD2  LEU  20          HD21      LEU  20  -0.993  -2.152  -0.696
  192   2HD2  LEU  20          HD22      LEU  20  -2.738  -2.326  -0.506
  193   3HD2  LEU  20          HD23      LEU  20  -1.784  -1.561   0.767
  194    H    VAL  21           HN       VAL  21  -0.150   2.413   1.485
  195    HA   VAL  21           HA       VAL  21   2.057   3.796   0.577
  196    HB   VAL  21           HB       VAL  21   0.286   3.838   2.947
  197   1HG1  VAL  21          HG11      VAL  21   1.438   5.683   3.921
  198   2HG1  VAL  21          HG12      VAL  21   2.599   5.708   2.590
  199   3HG1  VAL  21          HG13      VAL  21   2.560   4.336   3.701
  200   1HG2  VAL  21          HG21      VAL  21   0.850   5.847   0.774
  201   2HG2  VAL  21          HG22      VAL  21  -0.368   6.011   2.044
  202   3HG2  VAL  21          HG23      VAL  21  -0.511   4.723   0.841
  203    H    PHE  22           HN       PHE  22   1.423   2.093   3.568
  204    HA   PHE  22           HA       PHE  22   3.868   2.320   4.858
  205   1HB   PHE  22          HB2       PHE  22   2.333   1.461   6.273
  206   2HB   PHE  22          HB1       PHE  22   1.423   0.744   4.971
  207    HD1  PHE  22           HD1      PHE  22   4.641   0.329   6.660
  208    HD2  PHE  22           HD2      PHE  22   1.251  -1.382   4.875
  209    HE1  PHE  22           HE1      PHE  22   5.502  -1.892   7.238
  210    HE2  PHE  22           HE2      PHE  22   2.053  -3.643   5.449
  211    HZ   PHE  22           HZ       PHE  22   4.202  -3.897   6.614
  212    H    LEU  23           HN       LEU  23   2.752   0.308   2.307
  213    HA   LEU  23           HA       LEU  23   5.041  -1.527   2.315
  214   1HB   LEU  23          HB2       LEU  23   2.698  -1.084   0.488
  215   2HB   LEU  23          HB1       LEU  23   4.068  -2.017  -0.074
  216    HG   LEU  23           HG       LEU  23   1.945  -3.121   1.063
  217   1HD1  LEU  23          HD11      LEU  23   3.837  -4.809   2.002
  218   2HD1  LEU  23          HD12      LEU  23   4.790  -3.840   0.877
  219   3HD1  LEU  23          HD13      LEU  23   3.362  -4.704   0.306
  220   1HD2  LEU  23          HD21      LEU  23   3.642  -3.233   3.436
  221   2HD2  LEU  23          HD22      LEU  23   1.886  -3.114   3.292
  222   3HD2  LEU  23          HD23      LEU  23   2.889  -1.665   3.131
  223    H    LYS  24           HN       LYS  24   3.958   1.280   0.768
  224    HA   LYS  24           HA       LYS  24   5.811   1.434  -1.332
  225   1HB   LYS  24          HB2       LYS  24   3.599   2.868  -0.277
  226   2HB   LYS  24          HB1       LYS  24   4.863   4.007  -0.609
  227   1HG   LYS  24          HG2       LYS  24   4.169   3.962  -2.718
  228   2HG   LYS  24          HG1       LYS  24   4.811   2.319  -2.789
  229   1HD   LYS  24          HD2       LYS  24   2.500   1.768  -1.633
  230   2HD   LYS  24          HD1       LYS  24   2.013   3.238  -2.486
  231   1HE   LYS  24          HE2       LYS  24   2.858   2.266  -4.589
  232   2HE   LYS  24          HE1       LYS  24   3.266   0.787  -3.720
  233   1HZ   LYS  24          HZ1       LYS  24   0.541   1.920  -4.050
  234   2HZ   LYS  24          HZ2       LYS  24   0.915   0.524  -3.171
  235   3HZ   LYS  24          HZ3       LYS  24   1.157   0.560  -4.845
  236    H    THR  25           HN       THR  25   5.637   2.837   1.845
  237    HA   THR  25           HA       THR  25   8.019   4.325   1.699
  238    HB   THR  25           HB       THR  25   6.444   4.980   3.347
  239    HG1  THR  25           HG1      THR  25   8.737   4.832   4.030
  240   1HG2  THR  25          HG21      THR  25   5.494   2.553   3.490
  241   2HG2  THR  25          HG22      THR  25   5.340   3.667   4.851
  242   3HG2  THR  25          HG23      THR  25   6.598   2.431   4.864
  243    H    ARG  26           HN       ARG  26   7.183   1.122   2.997
  244    HA   ARG  26           HA       ARG  26   9.721   0.480   4.032
  245   1HB   ARG  26          HB2       ARG  26   7.479  -1.162   2.886
  246   2HB   ARG  26          HB1       ARG  26   8.924  -1.910   3.556
  247   1HG   ARG  26          HG2       ARG  26   6.784  -0.363   4.961
  248   2HG   ARG  26          HG1       ARG  26   7.386  -1.978   5.300
  249   1HD   ARG  26          HD2       ARG  26   8.829   0.624   5.750
  250   2HD   ARG  26          HD1       ARG  26   8.154  -0.432   6.991
  251    HE   ARG  26           HE       ARG  26  10.130  -1.670   5.285
  252   1HH1  ARG  26          1HH1      ARG  26   9.560   0.100   8.241
  253   2HH1  ARG  26          2HH1      ARG  26  11.021  -0.444   8.993
  254   1HH2  ARG  26          1HH2      ARG  26  12.050  -2.385   6.275
  255   2HH2  ARG  26          2HH2      ARG  26  12.434  -1.853   7.879
  256    H    VAL  27           HN       VAL  27   8.297   0.196   0.874
  257    HA   VAL  27           HA       VAL  27  10.516  -1.115  -0.360
  258    HB   VAL  27           HB       VAL  27   7.876  -0.014  -1.120
  259   1HG1  VAL  27          HG11      VAL  27   9.074   1.059  -2.796
  260   2HG1  VAL  27          HG12      VAL  27   8.415  -0.396  -3.544
  261   3HG1  VAL  27          HG13      VAL  27  10.114  -0.335  -3.073
  262   1HG2  VAL  27          HG21      VAL  27   7.654  -2.207  -2.214
  263   2HG2  VAL  27          HG22      VAL  27   8.097  -2.343  -0.511
  264   3HG2  VAL  27          HG23      VAL  27   9.318  -2.581  -1.763
  265    H    LEU  28           HN       LEU  28   9.627   2.095   0.398
  266    HA   LEU  28           HA       LEU  28  11.125   3.452  -1.588
  267   1HB   LEU  28          HB2       LEU  28   9.952   5.225  -0.851
  268   2HB   LEU  28          HB1       LEU  28   9.030   4.079   0.051
  269    HG   LEU  28           HG       LEU  28  10.387   4.488   2.019
  270   1HD1  LEU  28          HD11      LEU  28  12.085   5.869   0.121
  271   2HD1  LEU  28          HD12      LEU  28  12.445   5.287   1.747
  272   3HD1  LEU  28          HD13      LEU  28  11.702   6.872   1.521
  273   1HD2  LEU  28          HD21      LEU  28   8.445   6.112   0.964
  274   2HD2  LEU  28          HD22      LEU  28   9.723   7.253   1.381
  275   3HD2  LEU  28          HD23      LEU  28   9.059   6.183   2.615
  276    H    LYS  29           HN       LYS  29  11.294   2.837   1.819
  277    HA   LYS  29           HA       LYS  29  13.896   3.877   2.173
  278   1HB   LYS  29          HB2       LYS  29  13.771   3.178   4.414
  279   2HB   LYS  29          HB1       LYS  29  12.117   3.583   3.990
  280   1HG   LYS  29          HG2       LYS  29  11.787   1.616   5.083
  281   2HG   LYS  29          HG1       LYS  29  11.975   1.020   3.436
  282   1HD   LYS  29          HD2       LYS  29  13.473  -0.367   4.407
  283   2HD   LYS  29          HD1       LYS  29  14.548   1.020   4.227
  284   1HE   LYS  29          HE2       LYS  29  12.929   0.353   6.683
  285   2HE   LYS  29          HE1       LYS  29  14.657   0.065   6.483
  286   1HZ   LYS  29          HZ1       LYS  29  14.893   2.506   6.133
  287   2HZ   LYS  29          HZ2       LYS  29  14.394   2.072   7.689
  288   3HZ   LYS  29          HZ3       LYS  29  13.272   2.685   6.583
  289    H    ARG  30           HN       ARG  30  12.610   1.027   0.934
  290    HA   ARG  30           HA       ARG  30  14.946  -0.592   1.355
  291   1HB   ARG  30          HB2       ARG  30  13.661  -2.296   0.545
  292   2HB   ARG  30          HB1       ARG  30  12.353  -1.217   0.890
  293   1HG   ARG  30          HG2       ARG  30  11.771  -1.168  -1.235
  294   2HG   ARG  30          HG1       ARG  30  13.383  -0.720  -1.738
  295   1HD   ARG  30          HD2       ARG  30  13.846  -3.281  -1.257
  296   2HD   ARG  30          HD1       ARG  30  12.115  -3.398  -1.569
  297    HE   ARG  30           HE       ARG  30  13.584  -1.932  -3.568
  298   1HH1  ARG  30          1HH1      ARG  30  12.464  -5.078  -2.547
  299   2HH1  ARG  30          2HH1      ARG  30  12.528  -5.755  -4.140
  300   1HH2  ARG  30          1HH2      ARG  30  13.670  -2.824  -5.662
  301   2HH2  ARG  30          2HH2      ARG  30  13.214  -4.477  -5.907
  302    H    TRP  31           HN       TRP  31  13.414   1.456  -0.918
  303    HA   TRP  31           HA       TRP  31  15.012   1.092  -3.172
  304   1HB   TRP  31          HB2       TRP  31  12.723   2.474  -2.366
  305   2HB   TRP  31          HB1       TRP  31  13.820   3.668  -2.935
  306    HD1  TRP  31           HD1      TRP  31  11.731   0.916  -4.053
  307    HE1  TRP  31           HE1      TRP  31  11.819   0.757  -6.615
  308    HE3  TRP  31           HE3      TRP  31  15.390   4.044  -4.648
  309    HZ2  TRP  31           HZ2      TRP  31  13.380   1.933  -8.670
  310    HZ3  TRP  31           HZ3      TRP  31  16.266   4.594  -6.942
  311    HH2  TRP  31           HH2      TRP  31  15.260   3.533  -8.923
  312    H    ARG  32           HN       ARG  32  14.906   3.300  -0.393
  313    HA   ARG  32           HA       ARG  32  17.031   5.006  -1.024
  314   1HB   ARG  32          HB2       ARG  32  15.971   3.872   1.533
  315   2HB   ARG  32          HB1       ARG  32  17.043   5.276   1.457
  316   1HG   ARG  32          HG2       ARG  32  14.389   5.203   0.049
  317   2HG   ARG  32          HG1       ARG  32  14.555   5.716   1.708
  318   1HD   ARG  32          HD2       ARG  32  16.172   6.855  -0.522
  319   2HD   ARG  32          HD1       ARG  32  14.586   7.492  -0.102
  320    HE   ARG  32           HE       ARG  32  16.257   7.376   2.185
  321   1HH1  ARG  32          1HH1      ARG  32  15.721   9.216  -0.730
  322   2HH1  ARG  32          2HH1      ARG  32  16.365  10.682  -0.072
  323   1HH2  ARG  32          1HH2      ARG  32  17.104   9.304   3.053
  324   2HH2  ARG  32          2HH2      ARG  32  17.150  10.733   2.075
  325    H    LEU  33           HN       LEU  33  16.745   2.069   0.781
  326    HA   LEU  33           HA       LEU  33  19.351   1.572   1.569
  327   1HB   LEU  33          HB2       LEU  33  16.768   0.168   1.195
  328   2HB   LEU  33          HB1       LEU  33  18.152  -0.778   1.561
  329    HG   LEU  33           HG       LEU  33  16.456   0.426   3.311
  330   1HD1  LEU  33          HD11      LEU  33  18.384  -1.442   3.470
  331   2HD1  LEU  33          HD12      LEU  33  17.585  -0.750   4.882
  332   3HD1  LEU  33          HD13      LEU  33  19.152  -0.128   4.362
  333   1HD2  LEU  33          HD21      LEU  33  17.507   2.216   4.380
  334   2HD2  LEU  33          HD22      LEU  33  17.636   2.548   2.649
  335   3HD2  LEU  33          HD23      LEU  33  19.028   1.924   3.534
  336    H    PHE  34           HN       PHE  34  17.412   0.653  -1.091
  337    HA   PHE  34           HA       PHE  34  19.301  -1.115  -2.301
  338   1HB   PHE  34          HB2       PHE  34  16.615  -0.200  -2.795
  339   2HB   PHE  34          HB1       PHE  34  17.516  -0.489  -4.256
  340    HD1  PHE  34           HD1      PHE  34  16.511  -2.460  -5.020
  341    HD2  PHE  34           HD2      PHE  34  17.922  -2.079  -1.052
  342    HE1  PHE  34           HE1      PHE  34  16.218  -4.866  -4.705
  343    HE2  PHE  34           HE2      PHE  34  17.642  -4.486  -0.706
  344    HZ   PHE  34           HZ       PHE  34  16.777  -5.912  -2.535
  345    H    SER  35           HN       SER  35  18.651   2.133  -2.173
  346    HA   SER  35           HA       SER  35  20.216   2.738  -4.616
  347   1HB   SER  35          HB2       SER  35  18.094   4.127  -3.437
  348   2HB   SER  35          HB1       SER  35  19.517   5.102  -3.084
  349    HG   SER  35           HG       SER  35  18.198   5.030  -5.319
  350    H    LYS  36           HN       LYS  36  20.460   2.829  -1.137
  351    HA   LYS  36           HA       LYS  36  22.933   4.317  -1.184
  352   1HB   LYS  36          HB2       LYS  36  22.732   4.483   1.077
  353   2HB   LYS  36          HB1       LYS  36  21.060   4.129   0.685
  354   1HG   LYS  36          HG2       LYS  36  21.305   1.853   1.343
  355   2HG   LYS  36          HG1       LYS  36  23.053   2.030   1.507
  356   1HD   LYS  36          HD2       LYS  36  21.864   2.057   3.679
  357   2HD   LYS  36          HD1       LYS  36  22.777   3.535   3.367
  358   1HE   LYS  36          HE2       LYS  36  19.911   3.426   2.565
  359   2HE   LYS  36          HE1       LYS  36  20.303   3.615   4.273
  360   1HZ   LYS  36          HZ1       LYS  36  21.910   5.437   3.175
  361   2HZ   LYS  36          HZ2       LYS  36  20.349   5.780   3.728
  362   3HZ   LYS  36          HZ3       LYS  36  20.618   5.488   2.084
  363    H    HIS  37           HN       HIS  37  21.965   1.054  -1.315
  364    HA   HIS  37           HA       HIS  37  24.393  -0.134  -0.426
  365   1HB   HIS  37          HB2       HIS  37  21.814  -1.023  -1.362
  366   2HB   HIS  37          HB1       HIS  37  23.087  -1.922  -2.162
  367    HD1  HIS  37           HD1      HIS  37  23.570  -4.019  -0.956
  368    HD2  HIS  37           HD2      HIS  37  22.522  -0.949   1.640
  369    HE1  HIS  37           HE1      HIS  37  23.673  -5.024   1.347
  370    HE2  HIS  37           HE2      HIS  37  23.126  -3.123   2.909
  371    H    GLU  38           HN       GLU  38  22.987   0.460  -3.624
  372    HA   GLU  38           HA       GLU  38  25.507  -0.278  -4.890
  373   1HB   GLU  38          HB2       GLU  38  24.307  -0.183  -6.987
  374   2HB   GLU  38          HB1       GLU  38  23.368  -1.115  -5.828
  375   1HG   GLU  38          HG2       GLU  38  21.643   0.282  -5.948
  376   2HG   GLU  38          HG1       GLU  38  22.676   1.703  -5.797
  Start of MODEL   12
    1   1H    VAL   1          HT1       VAL   1 -26.184  -7.185   4.055
    2   2H    VAL   1          HT2       VAL   1 -24.963  -6.732   5.173
    3   3H    VAL   1          HT3       VAL   1 -24.831  -6.277   3.524
    4    HA   VAL   1           HA       VAL   1 -27.048  -5.128   3.917
    5    HB   VAL   1           HB       VAL   1 -26.008  -4.777   6.694
    6   1HG1  VAL   1          HG11      VAL   1 -28.806  -4.827   6.601
    7   2HG1  VAL   1          HG12      VAL   1 -28.294  -3.979   5.142
    8   3HG1  VAL   1          HG13      VAL   1 -27.761  -3.413   6.725
    9   1HG2  VAL   1          HG21      VAL   1 -27.485  -7.169   5.688
   10   2HG2  VAL   1          HG22      VAL   1 -27.839  -6.547   7.300
   11   3HG2  VAL   1          HG23      VAL   1 -26.202  -7.063   6.894
   12    H    MET   2           HN       MET   2 -26.873  -2.750   4.531
   13    HA   MET   2           HA       MET   2 -24.752  -1.571   3.238
   14   1HB   MET   2          HB2       MET   2 -27.029  -0.721   4.855
   15   2HB   MET   2          HB1       MET   2 -25.667   0.366   4.959
   16   1HG   MET   2          HG2       MET   2 -26.741  -0.576   2.336
   17   2HG   MET   2          HG1       MET   2 -27.407   0.825   3.171
   18   1HE   MET   2          HE1       MET   2 -25.588   2.846   4.061
   19   2HE   MET   2          HE2       MET   2 -26.696   3.088   2.711
   20   3HE   MET   2          HE3       MET   2 -25.019   3.615   2.581
   21    HA   PRO   3           HA       PRO   3 -23.008  -0.275   7.724
   22   1HB   PRO   3          HB2       PRO   3 -23.589  -2.552   9.332
   23   2HB   PRO   3          HB1       PRO   3 -24.154  -0.904   9.559
   24   1HG   PRO   3          HG2       PRO   3 -25.516  -3.206   8.304
   25   2HG   PRO   3          HG1       PRO   3 -26.213  -1.806   9.139
   26   1HD   PRO   3          HD2       PRO   3 -26.355  -2.058   6.479
   27   2HD   PRO   3          HD1       PRO   3 -26.110  -0.471   7.240
   28    H    LYS   4           HN       LYS   4 -23.300  -3.456   6.431
   29    HA   LYS   4           HA       LYS   4 -20.563  -4.153   7.182
   30   1HB   LYS   4          HB2       LYS   4 -22.536  -5.753   7.427
   31   2HB   LYS   4          HB1       LYS   4 -22.522  -5.873   5.673
   32   1HG   LYS   4          HG2       LYS   4 -21.197  -7.641   6.101
   33   2HG   LYS   4          HG1       LYS   4 -19.943  -6.400   6.170
   34   1HD   LYS   4          HD2       LYS   4 -20.627  -6.263   8.688
   35   2HD   LYS   4          HD1       LYS   4 -21.281  -7.876   8.396
   36   1HE   LYS   4          HE2       LYS   4 -19.236  -8.813   8.208
   37   2HE   LYS   4          HE1       LYS   4 -18.557  -7.410   7.382
   38   1HZ   LYS   4          HZ1       LYS   4 -18.898  -6.396   9.799
   39   2HZ   LYS   4          HZ2       LYS   4 -17.482  -7.199   9.340
   40   3HZ   LYS   4          HZ3       LYS   4 -18.667  -8.016  10.227
   41    H    GLN   5           HN       GLN   5 -22.387  -3.049   4.492
   42    HA   GLN   5           HA       GLN   5 -20.481  -3.937   2.533
   43   1HB   GLN   5          HB2       GLN   5 -22.255  -3.746   1.185
   44   2HB   GLN   5          HB1       GLN   5 -23.171  -3.153   2.548
   45   1HG   GLN   5          HG2       GLN   5 -23.413  -1.667   0.649
   46   2HG   GLN   5          HG1       GLN   5 -22.620  -0.886   1.966
   47   1HE2  GLN   5          HE21      GLN   5 -21.750  -2.660  -0.907
   48   2HE2  GLN   5          HE22      GLN   5 -20.454  -1.623  -1.296
   49    H    ILE   6           HN       ILE   6 -21.143  -1.047   4.308
   50    HA   ILE   6           HA       ILE   6 -19.308   0.474   2.698
   51    HB   ILE   6           HB       ILE   6 -19.676   2.191   4.575
   52   1HG1  ILE   6          HG12      ILE   6 -21.818   2.073   5.686
   53   2HG1  ILE   6          HG11      ILE   6 -22.146   0.515   4.982
   54   1HG2  ILE   6          HG21      ILE   6 -20.407   2.327   2.255
   55   2HG2  ILE   6          HG22      ILE   6 -21.560   3.072   3.369
   56   3HG2  ILE   6          HG23      ILE   6 -21.888   1.474   2.693
   57   1HD1  ILE   6          HD11      ILE   6 -21.225   0.779   7.430
   58   2HD1  ILE   6          HD12      ILE   6 -19.675   0.844   6.585
   59   3HD1  ILE   6          HD13      ILE   6 -20.723  -0.556   6.399
   60    H    VAL   7           HN       VAL   7 -19.398  -1.368   5.612
   61    HA   VAL   7           HA       VAL   7 -16.969  -0.377   6.752
   62    HB   VAL   7           HB       VAL   7 -19.031  -1.592   7.878
   63   1HG1  VAL   7          HG11      VAL   7 -18.759  -3.674   6.570
   64   2HG1  VAL   7          HG12      VAL   7 -18.676  -3.936   8.310
   65   3HG1  VAL   7          HG13      VAL   7 -17.198  -3.925   7.348
   66   1HG2  VAL   7          HG21      VAL   7 -17.739  -1.877   9.772
   67   2HG2  VAL   7          HG22      VAL   7 -16.880  -0.660   8.832
   68   3HG2  VAL   7          HG23      VAL   7 -16.312  -2.328   8.840
   69    H    TYR   8           HN       TYR   8 -18.103  -3.025   4.817
   70    HA   TYR   8           HA       TYR   8 -15.775  -4.609   4.632
   71   1HB   TYR   8          HB2       TYR   8 -18.348  -4.382   3.273
   72   2HB   TYR   8          HB1       TYR   8 -17.041  -4.773   2.162
   73    HD1  TYR   8           HD1      TYR   8 -15.271  -6.361   3.760
   74    HD2  TYR   8           HD2      TYR   8 -19.502  -6.376   3.653
   75    HE1  TYR   8           HE1      TYR   8 -15.258  -8.570   4.577
   76    HE2  TYR   8           HE2      TYR   8 -19.517  -8.644   4.464
   77    HH   TYR   8           HH       TYR   8 -16.834 -10.629   4.480
   78    H    TRP   9           HN       TRP   9 -17.159  -1.961   2.771
   79    HA   TRP   9           HA       TRP   9 -15.129  -1.714   0.807
   80   1HB   TRP   9          HB2       TRP   9 -17.458  -0.220   1.780
   81   2HB   TRP   9          HB1       TRP   9 -16.140   0.831   1.257
   82    HD1  TRP   9           HD1      TRP   9 -18.928  -1.109  -0.027
   83    HE1  TRP   9           HE1      TRP   9 -18.781  -1.132  -2.631
   84    HE3  TRP   9           HE3      TRP   9 -14.328   0.632  -0.514
   85    HZ2  TRP   9           HZ2      TRP   9 -16.915  -0.480  -4.604
   86    HZ3  TRP   9           HZ3      TRP   9 -13.350   0.944  -2.770
   87    HH2  TRP   9           HH2      TRP   9 -14.657   0.378  -4.770
   88    H    LYS  10           HN       LYS  10 -15.996   0.196   3.519
   89    HA   LYS  10           HA       LYS  10 -13.828   1.857   3.790
   90   1HB   LYS  10          HB2       LYS  10 -15.757   2.237   5.119
   91   2HB   LYS  10          HB1       LYS  10 -15.666   0.635   5.833
   92   1HG   LYS  10          HG2       LYS  10 -13.274   1.765   6.534
   93   2HG   LYS  10          HG1       LYS  10 -14.406   3.110   6.640
   94   1HD   LYS  10          HD2       LYS  10 -15.881   1.690   8.040
   95   2HD   LYS  10          HD1       LYS  10 -14.647   0.430   8.002
   96   1HE   LYS  10          HE2       LYS  10 -13.166   2.530   8.820
   97   2HE   LYS  10          HE1       LYS  10 -14.731   2.966   9.507
   98   1HZ   LYS  10          HZ1       LYS  10 -14.050   1.659  11.181
   99   2HZ   LYS  10          HZ2       LYS  10 -12.924   0.823  10.235
  100   3HZ   LYS  10          HZ3       LYS  10 -14.557   0.388  10.187
  101    H    GLN  11           HN       GLN  11 -14.233  -1.363   5.267
  102    HA   GLN  11           HA       GLN  11 -11.616  -1.275   6.434
  103   1HB   GLN  11          HB2       GLN  11 -12.069  -3.458   7.237
  104   2HB   GLN  11          HB1       GLN  11 -13.603  -2.611   7.303
  105   1HG   GLN  11          HG2       GLN  11 -14.307  -3.683   5.244
  106   2HG   GLN  11          HG1       GLN  11 -12.751  -4.476   5.109
  107   1HE2  GLN  11          HE21      GLN  11 -13.231  -4.593   8.335
  108   2HE2  GLN  11          HE22      GLN  11 -14.099  -6.079   8.451
  109    H    TRP  12           HN       TRP  12 -12.440  -1.442   3.365
  110    HA   TRP  12           HA       TRP  12 -10.238  -3.254   2.611
  111   1HB   TRP  12          HB2       TRP  12 -12.607  -3.661   1.743
  112   2HB   TRP  12          HB1       TRP  12 -12.410  -2.248   0.779
  113    HD1  TRP  12           HD1      TRP  12 -11.652  -5.812   0.818
  114    HE1  TRP  12           HE1      TRP  12 -10.148  -6.394  -1.171
  115    HE3  TRP  12           HE3      TRP  12 -10.586  -1.183  -0.539
  116    HZ2  TRP  12           HZ2      TRP  12  -8.686  -4.986  -3.137
  117    HZ3  TRP  12           HZ3      TRP  12  -9.118  -0.755  -2.514
  118    HH2  TRP  12           HH2      TRP  12  -8.178  -2.672  -3.796
  119    H    LEU  13           HN       LEU  13 -11.585   0.005   2.132
  120    HA   LEU  13           HA       LEU  13  -9.203   0.682   0.577
  121   1HB   LEU  13          HB2       LEU  13 -11.306   1.382  -0.404
  122   2HB   LEU  13          HB1       LEU  13 -11.775   2.192   1.079
  123    HG   LEU  13           HG       LEU  13  -9.242   3.171  -0.005
  124   1HD1  LEU  13          HD11      LEU  13  -9.919   3.069  -2.162
  125   2HD1  LEU  13          HD12      LEU  13 -10.779   4.540  -1.707
  126   3HD1  LEU  13          HD13      LEU  13 -11.629   2.994  -1.740
  127   1HD2  LEU  13          HD21      LEU  13 -10.374   4.299   1.793
  128   2HD2  LEU  13          HD22      LEU  13 -11.839   4.458   0.822
  129   3HD2  LEU  13          HD23      LEU  13 -10.380   5.339   0.368
  130    H    SER  14           HN       SER  14 -10.266   0.715   3.755
  131    HA   SER  14           HA       SER  14  -8.860   3.147   4.449
  132   1HB   SER  14          HB2       SER  14 -10.953   1.839   5.668
  133   2HB   SER  14          HB1       SER  14  -9.588   1.342   6.655
  134    HG   SER  14           HG       SER  14  -9.084   3.576   6.905
  135    H    LEU  15           HN       LEU  15  -8.558  -0.320   4.897
  136    HA   LEU  15           HA       LEU  15  -5.964  -0.079   6.073
  137   1HB   LEU  15          HB2       LEU  15  -7.438  -2.531   5.135
  138   2HB   LEU  15          HB1       LEU  15  -6.051  -2.479   6.202
  139    HG   LEU  15           HG       LEU  15  -7.772  -2.781   7.707
  140   1HD1  LEU  15          HD11      LEU  15  -6.491  -0.747   8.294
  141   2HD1  LEU  15          HD12      LEU  15  -8.162  -0.686   8.862
  142   3HD1  LEU  15          HD13      LEU  15  -7.684   0.217   7.421
  143   1HD2  LEU  15          HD21      LEU  15  -9.755  -0.905   7.024
  144   2HD2  LEU  15          HD22      LEU  15  -9.838  -2.666   6.931
  145   3HD2  LEU  15          HD23      LEU  15  -9.272  -1.730   5.536
  146    H    ARG  16           HN       ARG  16  -7.218  -1.697   3.194
  147    HA   ARG  16           HA       ARG  16  -4.836  -2.362   2.001
  148   1HB   ARG  16          HB2       ARG  16  -7.459  -1.562   0.850
  149   2HB   ARG  16          HB1       ARG  16  -6.119  -1.885  -0.217
  150   1HG   ARG  16          HG2       ARG  16  -7.428  -3.776   1.713
  151   2HG   ARG  16          HG1       ARG  16  -7.428  -3.864  -0.048
  152   1HD   ARG  16          HD2       ARG  16  -4.930  -4.115   0.070
  153   2HD   ARG  16          HD1       ARG  16  -5.102  -4.272   1.816
  154    HE   ARG  16           HE       ARG  16  -6.424  -6.119  -0.061
  155   1HH1  ARG  16          1HH1      ARG  16  -4.445  -5.549   2.770
  156   2HH1  ARG  16          2HH1      ARG  16  -4.384  -7.220   3.208
  157   1HH2  ARG  16          1HH2      ARG  16  -6.335  -8.312   0.526
  158   2HH2  ARG  16          2HH2      ARG  16  -5.452  -8.786   1.939
  159    H    ASN  17           HN       ASN  17  -6.235   0.735   2.292
  160    HA   ASN  17           HA       ASN  17  -4.872   2.116   0.304
  161   1HB   ASN  17          HB2       ASN  17  -6.552   2.687   2.559
  162   2HB   ASN  17          HB1       ASN  17  -5.322   3.880   2.402
  163   1HD2  ASN  17          HD21      ASN  17  -7.446   5.052   2.083
  164   2HD2  ASN  17          HD22      ASN  17  -7.940   5.251   0.449
  165    HA   PRO  18           HA       PRO  18  -1.601   3.734   3.350
  166   1HB   PRO  18          HB2       PRO  18  -1.623   2.634   5.880
  167   2HB   PRO  18          HB1       PRO  18  -2.242   4.232   5.453
  168   1HG   PRO  18          HG2       PRO  18  -3.701   1.646   5.680
  169   2HG   PRO  18          HG1       PRO  18  -4.176   3.254   6.260
  170   1HD   PRO  18          HD2       PRO  18  -5.221   2.317   4.031
  171   2HD   PRO  18          HD1       PRO  18  -4.683   4.001   4.106
  172    H    ILE  19           HN       ILE  19  -2.768   0.544   3.363
  173    HA   ILE  19           HA       ILE  19  -0.293  -0.709   4.085
  174    HB   ILE  19           HB       ILE  19  -2.779  -1.858   2.838
  175   1HG1  ILE  19          HG12      ILE  19  -1.694  -1.739   5.646
  176   2HG1  ILE  19          HG11      ILE  19  -3.192  -1.057   5.058
  177   1HG2  ILE  19          HG21      ILE  19  -0.160  -3.018   3.136
  178   2HG2  ILE  19          HG22      ILE  19  -1.602  -3.696   2.384
  179   3HG2  ILE  19          HG23      ILE  19  -1.334  -3.895   4.115
  180   1HD1  ILE  19          HD11      ILE  19  -4.086  -2.876   6.008
  181   2HD1  ILE  19          HD12      ILE  19  -2.581  -3.791   5.921
  182   3HD1  ILE  19          HD13      ILE  19  -3.613  -3.653   4.497
  183    H    LEU  20           HN       LEU  20  -1.739   0.264   1.098
  184    HA   LEU  20           HA       LEU  20   0.104  -1.245  -0.526
  185   1HB   LEU  20          HB2       LEU  20  -0.845  -0.209  -2.421
  186   2HB   LEU  20          HB1       LEU  20  -2.170  -0.526  -1.325
  187    HG   LEU  20           HG       LEU  20  -1.200   2.111  -0.832
  188   1HD1  LEU  20          HD11      LEU  20  -1.426   1.333  -3.686
  189   2HD1  LEU  20          HD12      LEU  20  -0.389   2.536  -2.920
  190   3HD1  LEU  20          HD13      LEU  20  -2.095   2.888  -3.192
  191   1HD2  LEU  20          HD21      LEU  20  -3.422   1.120  -0.385
  192   2HD2  LEU  20          HD22      LEU  20  -3.760   1.216  -2.115
  193   3HD2  LEU  20          HD23      LEU  20  -3.471   2.691  -1.186
  194    H    VAL  21           HN       VAL  21  -0.282   1.965   0.721
  195    HA   VAL  21           HA       VAL  21   1.877   3.282  -0.452
  196    HB   VAL  21           HB       VAL  21   0.328   3.437   2.072
  197   1HG1  VAL  21          HG11      VAL  21   2.652   5.208   1.428
  198   2HG1  VAL  21          HG12      VAL  21   2.636   3.909   2.625
  199   3HG1  VAL  21          HG13      VAL  21   1.591   5.321   2.836
  200   1HG2  VAL  21          HG21      VAL  21  -0.672   4.266   0.036
  201   2HG2  VAL  21          HG22      VAL  21   0.695   5.360  -0.214
  202   3HG2  VAL  21          HG23      VAL  21  -0.381   5.591   1.167
  203    H    PHE  22           HN       PHE  22   1.421   1.667   2.631
  204    HA   PHE  22           HA       PHE  22   3.931   1.835   3.756
  205   1HB   PHE  22          HB2       PHE  22   2.488   0.931   5.244
  206   2HB   PHE  22          HB1       PHE  22   1.495   0.253   3.979
  207    HD1  PHE  22           HD1      PHE  22   1.282  -1.861   3.876
  208    HD2  PHE  22           HD2      PHE  22   4.823  -0.225   5.419
  209    HE1  PHE  22           HE1      PHE  22   2.094  -4.145   4.348
  210    HE2  PHE  22           HE2      PHE  22   5.692  -2.467   5.902
  211    HZ   PHE  22           HZ       PHE  22   4.322  -4.449   5.349
  212    H    LEU  23           HN       LEU  23   2.648  -0.172   1.250
  213    HA   LEU  23           HA       LEU  23   4.954  -1.990   1.122
  214   1HB   LEU  23          HB2       LEU  23   2.587  -1.481  -0.659
  215   2HB   LEU  23          HB1       LEU  23   3.939  -2.422  -1.253
  216    HG   LEU  23           HG       LEU  23   1.823  -3.538  -0.133
  217   1HD1  LEU  23          HD11      LEU  23   3.689  -5.239   0.818
  218   2HD1  LEU  23          HD12      LEU  23   4.675  -4.258  -0.269
  219   3HD1  LEU  23          HD13      LEU  23   3.258  -5.110  -0.888
  220   1HD2  LEU  23          HD21      LEU  23   1.744  -3.568   2.100
  221   2HD2  LEU  23          HD22      LEU  23   2.712  -2.096   1.959
  222   3HD2  LEU  23          HD23      LEU  23   3.500  -3.648   2.261
  223    H    LYS  24           HN       LYS  24   3.886   0.867  -0.305
  224    HA   LYS  24           HA       LYS  24   5.763   1.094  -2.396
  225   1HB   LYS  24          HB2       LYS  24   3.448   2.407  -1.374
  226   2HB   LYS  24          HB1       LYS  24   4.664   3.605  -1.681
  227   1HG   LYS  24          HG2       LYS  24   3.995   3.531  -3.801
  228   2HG   LYS  24          HG1       LYS  24   4.729   1.927  -3.869
  229   1HD   LYS  24          HD2       LYS  24   2.450   1.232  -2.745
  230   2HD   LYS  24          HD1       LYS  24   1.878   2.685  -3.574
  231   1HE   LYS  24          HE2       LYS  24   2.857   1.773  -5.684
  232   2HE   LYS  24          HE1       LYS  24   3.209   0.280  -4.814
  233   1HZ   LYS  24          HZ1       LYS  24   1.185  -0.141  -5.824
  234   2HZ   LYS  24          HZ2       LYS  24   0.587   1.416  -5.544
  235   3HZ   LYS  24          HZ3       LYS  24   0.720   0.320  -4.263
  236    H    THR  25           HN       THR  25   5.460   2.352   0.805
  237    HA   THR  25           HA       THR  25   7.727   4.021   0.750
  238    HB   THR  25           HB       THR  25   6.836   3.293   3.395
  239    HG1  THR  25           HG1      THR  25   4.927   2.654   2.288
  240   1HG2  THR  25          HG21      THR  25   6.685   5.791   1.761
  241   2HG2  THR  25          HG22      THR  25   7.722   5.440   3.144
  242   3HG2  THR  25          HG23      THR  25   5.990   5.677   3.377
  243    H    ARG  26           HN       ARG  26   6.966   0.788   2.083
  244    HA   ARG  26           HA       ARG  26   9.407   0.401   3.421
  245   1HB   ARG  26          HB2       ARG  26   7.438  -1.463   2.122
  246   2HB   ARG  26          HB1       ARG  26   8.869  -2.068   2.946
  247   1HG   ARG  26          HG2       ARG  26   6.478  -0.687   4.092
  248   2HG   ARG  26          HG1       ARG  26   7.206  -2.213   4.553
  249   1HD   ARG  26          HD2       ARG  26   9.219  -0.866   5.297
  250   2HD   ARG  26          HD1       ARG  26   8.207   0.563   5.085
  251    HE   ARG  26           HE       ARG  26   7.170  -1.544   6.805
  252   1HH1  ARG  26          1HH1      ARG  26   8.770   1.554   6.575
  253   2HH1  ARG  26          2HH1      ARG  26   8.398   2.003   8.204
  254   1HH2  ARG  26          1HH2      ARG  26   6.685  -0.950   8.944
  255   2HH2  ARG  26          2HH2      ARG  26   7.217   0.584   9.549
  256    H    VAL  27           HN       VAL  27   8.354  -0.161   0.156
  257    HA   VAL  27           HA       VAL  27  10.728  -1.338  -0.873
  258    HB   VAL  27           HB       VAL  27   8.136  -0.326  -1.853
  259   1HG1  VAL  27          HG11      VAL  27  10.557  -0.468  -3.601
  260   2HG1  VAL  27          HG12      VAL  27   9.415   0.857  -3.389
  261   3HG1  VAL  27          HG13      VAL  27   8.915  -0.610  -4.232
  262   1HG2  VAL  27          HG21      VAL  27   9.762  -2.797  -2.436
  263   2HG2  VAL  27          HG22      VAL  27   8.128  -2.491  -3.027
  264   3HG2  VAL  27          HG23      VAL  27   8.423  -2.664  -1.297
  265    H    LEU  28           HN       LEU  28   9.673   1.842  -0.199
  266    HA   LEU  28           HA       LEU  28  11.365   3.223  -2.024
  267   1HB   LEU  28          HB2       LEU  28   9.932   4.899  -1.617
  268   2HB   LEU  28          HB1       LEU  28   8.987   3.731  -0.769
  269    HG   LEU  28           HG       LEU  28   9.931   4.405   1.332
  270   1HD1  LEU  28          HD11      LEU  28  11.217   6.802   0.898
  271   2HD1  LEU  28          HD12      LEU  28  11.867   5.753  -0.363
  272   3HD1  LEU  28          HD13      LEU  28  11.975   5.272   1.330
  273   1HD2  LEU  28          HD21      LEU  28   8.042   5.708   0.019
  274   2HD2  LEU  28          HD22      LEU  28   9.225   7.011   0.093
  275   3HD2  LEU  28          HD23      LEU  28   8.637   6.272   1.579
  276    H    LYS  29           HN       LYS  29  11.026   2.751   1.395
  277    HA   LYS  29           HA       LYS  29  13.421   4.058   2.137
  278   1HB   LYS  29          HB2       LYS  29  12.983   3.398   4.345
  279   2HB   LYS  29          HB1       LYS  29  11.387   3.573   3.634
  280   1HG   LYS  29          HG2       LYS  29  11.179   1.189   3.391
  281   2HG   LYS  29          HG1       LYS  29  12.841   0.952   3.937
  282   1HD   LYS  29          HD2       LYS  29  11.995   2.262   6.049
  283   2HD   LYS  29          HD1       LYS  29  10.415   1.709   5.495
  284   1HE   LYS  29          HE2       LYS  29  11.181  -0.597   5.545
  285   2HE   LYS  29          HE1       LYS  29  12.792  -0.069   6.027
  286   1HZ   LYS  29          HZ1       LYS  29  10.897  -0.824   7.743
  287   2HZ   LYS  29          HZ2       LYS  29  10.625   0.846   7.721
  288   3HZ   LYS  29          HZ3       LYS  29  12.149   0.243   8.141
  289    H    ARG  30           HN       ARG  30  12.578   1.004   0.990
  290    HA   ARG  30           HA       ARG  30  14.959  -0.367   1.749
  291   1HB   ARG  30          HB2       ARG  30  12.532  -0.898   0.136
  292   2HB   ARG  30          HB1       ARG  30  13.918  -1.908  -0.160
  293   1HG   ARG  30          HG2       ARG  30  13.399  -1.614   2.652
  294   2HG   ARG  30          HG1       ARG  30  11.976  -2.190   1.795
  295   1HD   ARG  30          HD2       ARG  30  14.116  -3.656   0.745
  296   2HD   ARG  30          HD1       ARG  30  14.396  -3.601   2.485
  297    HE   ARG  30           HE       ARG  30  11.786  -4.284   2.302
  298   1HH1  ARG  30          1HH1      ARG  30  14.694  -5.571   0.863
  299   2HH1  ARG  30          2HH1      ARG  30  14.085  -7.189   0.777
  300   1HH2  ARG  30          1HH2      ARG  30  10.983  -6.413   2.189
  301   2HH2  ARG  30          2HH2      ARG  30  11.979  -7.668   1.529
  302    H    TRP  31           HN       TRP  31  13.661   1.513  -0.808
  303    HA   TRP  31           HA       TRP  31  15.560   1.045  -2.807
  304   1HB   TRP  31          HB2       TRP  31  13.110   2.341  -2.437
  305   2HB   TRP  31          HB1       TRP  31  14.218   3.545  -2.965
  306    HD1  TRP  31           HD1      TRP  31  12.453   0.570  -4.078
  307    HE1  TRP  31           HE1      TRP  31  12.886   0.204  -6.584
  308    HE3  TRP  31           HE3      TRP  31  15.966   3.886  -4.491
  309    HZ2  TRP  31           HZ2      TRP  31  14.634   1.309  -8.523
  310    HZ3  TRP  31           HZ3      TRP  31  17.105   4.302  -6.698
  311    HH2  TRP  31           HH2      TRP  31  16.435   3.011  -8.683
  312    H    ARG  32           HN       ARG  32  14.949   3.401  -0.183
  313    HA   ARG  32           HA       ARG  32  17.081   5.177  -0.700
  314   1HB   ARG  32          HB2       ARG  32  15.774   4.175   1.791
  315   2HB   ARG  32          HB1       ARG  32  16.840   5.584   1.756
  316   1HG   ARG  32          HG2       ARG  32  15.284   6.703   0.258
  317   2HG   ARG  32          HG1       ARG  32  14.234   5.300   0.282
  318   1HD   ARG  32          HD2       ARG  32  13.222   6.196   2.019
  319   2HD   ARG  32          HD1       ARG  32  14.669   5.829   2.940
  320    HE   ARG  32           HE       ARG  32  15.018   8.071   3.105
  321   1HH1  ARG  32          1HH1      ARG  32  13.149   7.481   0.217
  322   2HH1  ARG  32          2HH1      ARG  32  13.000   9.159  -0.181
  323   1HH2  ARG  32          1HH2      ARG  32  14.821  10.280   2.585
  324   2HH2  ARG  32          2HH2      ARG  32  13.948  10.748   1.163
  325    H    LEU  33           HN       LEU  33  16.681   2.365   1.265
  326    HA   LEU  33           HA       LEU  33  19.169   2.043   2.418
  327   1HB   LEU  33          HB2       LEU  33  16.742   0.469   1.770
  328   2HB   LEU  33          HB1       LEU  33  18.101  -0.358   2.409
  329    HG   LEU  33           HG       LEU  33  16.087   0.855   3.796
  330   1HD1  LEU  33          HD11      LEU  33  17.964   0.606   5.723
  331   2HD1  LEU  33          HD12      LEU  33  18.664  -0.400   4.453
  332   3HD1  LEU  33          HD13      LEU  33  17.047  -0.748   5.063
  333   1HD2  LEU  33          HD21      LEU  33  18.536   2.499   4.276
  334   2HD2  LEU  33          HD22      LEU  33  16.905   2.755   4.898
  335   3HD2  LEU  33          HD23      LEU  33  17.248   2.996   3.182
  336    H    PHE  34           HN       PHE  34  17.670   0.884  -0.428
  337    HA   PHE  34           HA       PHE  34  19.797  -0.839  -1.250
  338   1HB   PHE  34          HB2       PHE  34  17.173  -0.108  -2.172
  339   2HB   PHE  34          HB1       PHE  34  18.286  -0.399  -3.476
  340    HD1  PHE  34           HD1      PHE  34  18.309  -1.830  -0.174
  341    HD2  PHE  34           HD2      PHE  34  17.512  -2.456  -4.278
  342    HE1  PHE  34           HE1      PHE  34  18.115  -4.235   0.245
  343    HE2  PHE  34           HE2      PHE  34  17.301  -4.859  -3.893
  344    HZ   PHE  34           HZ       PHE  34  17.601  -5.782  -1.617
  345    H    SER  35           HN       SER  35  18.995   2.369  -1.394
  346    HA   SER  35           HA       SER  35  20.896   2.927  -3.604
  347   1HB   SER  35          HB2       SER  35  18.513   4.221  -2.888
  348   2HB   SER  35          HB1       SER  35  19.799   5.333  -2.432
  349    HG   SER  35           HG       SER  35  18.940   4.566  -4.911
  350    H    LYS  36           HN       LYS  36  20.590   3.223  -0.143
  351    HA   LYS  36           HA       LYS  36  22.903   4.945   0.056
  352   1HB   LYS  36          HB2       LYS  36  22.080   5.457   2.065
  353   2HB   LYS  36          HB1       LYS  36  20.720   4.408   1.706
  354   1HG   LYS  36          HG2       LYS  36  21.731   2.578   2.850
  355   2HG   LYS  36          HG1       LYS  36  23.255   3.453   3.017
  356   1HD   LYS  36          HD2       LYS  36  21.969   3.448   5.108
  357   2HD   LYS  36          HD1       LYS  36  22.191   5.079   4.474
  358   1HE   LYS  36          HE2       LYS  36  19.783   3.957   3.405
  359   2HE   LYS  36          HE1       LYS  36  19.780   3.794   5.162
  360   1HZ   LYS  36          HZ1       LYS  36  19.748   6.212   3.519
  361   2HZ   LYS  36          HZ2       LYS  36  20.575   6.283   4.992
  362   3HZ   LYS  36          HZ3       LYS  36  18.933   5.876   4.965
  363    H    HIS  37           HN       HIS  37  22.264   1.596   0.027
  364    HA   HIS  37           HA       HIS  37  24.642   0.775   1.387
  365   1HB   HIS  37          HB2       HIS  37  22.296  -0.480   0.266
  366   2HB   HIS  37          HB1       HIS  37  23.745  -1.338  -0.221
  367    HD1  HIS  37           HD1      HIS  37  24.234  -3.192   1.334
  368    HD2  HIS  37           HD2      HIS  37  22.549   0.064   3.290
  369    HE1  HIS  37           HE1      HIS  37  24.096  -3.860   3.754
  370    HE2  HIS  37           HE2      HIS  37  23.007  -1.903   4.908
  371    H    GLU  38           HN       GLU  38  23.608   0.792  -2.012
  372    HA   GLU  38           HA       GLU  38  26.309   0.176  -2.874
  373   1HB   GLU  38          HB2       GLU  38  23.616   0.143  -4.089
  374   2HB   GLU  38          HB1       GLU  38  24.931   0.571  -5.173
  375   1HG   GLU  38          HG2       GLU  38  26.067  -1.497  -4.683
  376   2HG   GLU  38          HG1       GLU  38  24.847  -1.912  -3.479
  Start of MODEL   13
    1   1H    VAL   1          HT1       VAL   1 -24.266  -7.857   0.962
    2   2H    VAL   1          HT2       VAL   1 -25.607  -8.730   1.582
    3   3H    VAL   1          HT3       VAL   1 -24.456  -8.046   2.655
    4    HA   VAL   1           HA       VAL   1 -26.421  -6.683   0.955
    5    HB   VAL   1           HB       VAL   1 -25.966  -6.108   3.849
    6   1HG1  VAL   1          HG11      VAL   1 -27.904  -5.501   1.817
    7   2HG1  VAL   1          HG12      VAL   1 -27.721  -4.812   3.431
    8   3HG1  VAL   1          HG13      VAL   1 -28.688  -6.268   3.198
    9   1HG2  VAL   1          HG21      VAL   1 -27.325  -7.888   4.619
   10   2HG2  VAL   1          HG22      VAL   1 -26.105  -8.623   3.579
   11   3HG2  VAL   1          HG23      VAL   1 -27.745  -8.376   2.978
   12    H    MET   2           HN       MET   2 -26.406  -4.269   1.398
   13    HA   MET   2           HA       MET   2 -24.060  -3.136   0.490
   14   1HB   MET   2          HB2       MET   2 -26.656  -2.225   1.472
   15   2HB   MET   2          HB1       MET   2 -25.365  -1.087   1.769
   16   1HG   MET   2          HG2       MET   2 -26.028  -2.275  -0.903
   17   2HG   MET   2          HG1       MET   2 -26.541  -0.683  -0.347
   18   1HE   MET   2          HE1       MET   2 -25.848   0.880  -1.547
   19   2HE   MET   2          HE2       MET   2 -24.305   1.139  -2.360
   20   3HE   MET   2          HE3       MET   2 -24.508   1.629  -0.678
   21    HA   PRO   3           HA       PRO   3 -23.467  -1.393   5.142
   22   1HB   PRO   3          HB2       PRO   3 -24.250  -3.641   6.721
   23   2HB   PRO   3          HB1       PRO   3 -24.937  -2.024   6.726
   24   1HG   PRO   3          HG2       PRO   3 -25.860  -4.456   5.324
   25   2HG   PRO   3          HG1       PRO   3 -26.800  -3.071   5.908
   26   1HD   PRO   3          HD2       PRO   3 -26.341  -3.424   3.303
   27   2HD   PRO   3          HD1       PRO   3 -26.319  -1.797   4.017
   28    H    LYS   4           HN       LYS   4 -23.233  -4.669   4.064
   29    HA   LYS   4           HA       LYS   4 -20.667  -5.048   5.426
   30   1HB   LYS   4          HB2       LYS   4 -22.521  -6.908   3.954
   31   2HB   LYS   4          HB1       LYS   4 -20.918  -7.399   4.485
   32   1HG   LYS   4          HG2       LYS   4 -22.587  -6.175   6.568
   33   2HG   LYS   4          HG1       LYS   4 -23.180  -7.713   5.937
   34   1HD   LYS   4          HD2       LYS   4 -20.355  -7.285   6.892
   35   2HD   LYS   4          HD1       LYS   4 -21.651  -7.887   7.926
   36   1HE   LYS   4          HE2       LYS   4 -21.988  -9.659   6.077
   37   2HE   LYS   4          HE1       LYS   4 -20.375  -9.186   5.546
   38   1HZ   LYS   4          HZ1       LYS   4 -21.153 -10.797   7.778
   39   2HZ   LYS   4          HZ2       LYS   4 -20.102  -9.551   8.233
   40   3HZ   LYS   4          HZ3       LYS   4 -19.642 -10.649   7.031
   41    H    GLN   5           HN       GLN   5 -21.937  -4.297   2.330
   42    HA   GLN   5           HA       GLN   5 -19.576  -5.183   0.939
   43   1HB   GLN   5          HB2       GLN   5 -21.082  -5.409  -0.718
   44   2HB   GLN   5          HB1       GLN   5 -22.291  -4.650   0.297
   45   1HG   GLN   5          HG2       GLN   5 -22.319  -3.341  -1.555
   46   2HG   GLN   5          HG1       GLN   5 -21.274  -2.435  -0.495
   47   1HE2  GLN   5          HE21      GLN   5 -19.022  -4.229  -1.015
   48   2HE2  GLN   5          HE22      GLN   5 -18.539  -3.888  -2.615
   49    H    ILE   6           HN       ILE   6 -20.908  -2.254   2.234
   50    HA   ILE   6           HA       ILE   6 -18.956  -0.639   0.867
   51    HB   ILE   6           HB       ILE   6 -19.893   1.154   2.452
   52   1HG1  ILE   6          HG12      ILE   6 -22.190   0.851   3.128
   53   2HG1  ILE   6          HG11      ILE   6 -22.196  -0.784   2.535
   54   1HG2  ILE   6          HG21      ILE   6 -21.568   0.012   0.250
   55   2HG2  ILE   6          HG22      ILE   6 -20.146   1.037   0.038
   56   3HG2  ILE   6          HG23      ILE   6 -21.591   1.682   0.823
   57   1HD1  ILE   6          HD11      ILE   6 -20.976  -1.555   4.301
   58   2HD1  ILE   6          HD12      ILE   6 -21.847  -0.235   5.075
   59   3HD1  ILE   6          HD13      ILE   6 -20.171  -0.012   4.561
   60    H    VAL   7           HN       VAL   7 -19.450  -2.256   3.879
   61    HA   VAL   7           HA       VAL   7 -17.439  -0.885   5.379
   62    HB   VAL   7           HB       VAL   7 -19.522  -2.283   6.199
   63   1HG1  VAL   7          HG11      VAL   7 -17.390  -4.413   6.175
   64   2HG1  VAL   7          HG12      VAL   7 -18.804  -4.386   5.121
   65   3HG1  VAL   7          HG13      VAL   7 -19.008  -4.544   6.865
   66   1HG2  VAL   7          HG21      VAL   7 -17.021  -2.703   7.743
   67   2HG2  VAL   7          HG22      VAL   7 -18.629  -2.241   8.303
   68   3HG2  VAL   7          HG23      VAL   7 -17.627  -1.077   7.438
   69    H    TYR   8           HN       TYR   8 -17.851  -3.782   3.511
   70    HA   TYR   8           HA       TYR   8 -15.356  -5.040   3.863
   71   1HB   TYR   8          HB2       TYR   8 -17.643  -5.245   2.084
   72   2HB   TYR   8          HB1       TYR   8 -16.130  -5.452   1.209
   73    HD1  TYR   8           HD1      TYR   8 -14.427  -6.698   3.161
   74    HD2  TYR   8           HD2      TYR   8 -18.524  -7.392   2.349
   75    HE1  TYR   8           HE1      TYR   8 -14.218  -8.858   4.082
   76    HE2  TYR   8           HE2      TYR   8 -18.331  -9.612   3.262
   77    HH   TYR   8           HH       TYR   8 -16.573 -11.309   3.696
   78    H    TRP   9           HN       TRP   9 -16.682  -2.750   1.537
   79    HA   TRP   9           HA       TRP   9 -14.400  -2.277  -0.047
   80   1HB   TRP   9          HB2       TRP   9 -16.995  -0.996   0.495
   81   2HB   TRP   9          HB1       TRP   9 -15.715   0.153   0.107
   82    HD1  TRP   9           HD1      TRP   9 -18.197  -1.894  -1.497
   83    HE1  TRP   9           HE1      TRP   9 -17.623  -2.075  -4.034
   84    HE3  TRP   9           HE3      TRP   9 -13.555  -0.159  -1.343
   85    HZ2  TRP   9           HZ2      TRP   9 -15.463  -1.529  -5.715
   86    HZ3  TRP   9           HZ3      TRP   9 -12.239   0.024  -3.419
   87    HH2  TRP   9           HH2      TRP   9 -13.205  -0.666  -5.568
   88    H    LYS  10           HN       LYS  10 -15.894  -0.362   2.370
   89    HA   LYS  10           HA       LYS  10 -13.999   1.541   2.893
   90   1HB   LYS  10          HB2       LYS  10 -16.172   1.748   3.832
   91   2HB   LYS  10          HB1       LYS  10 -16.027   0.217   4.679
   92   1HG   LYS  10          HG2       LYS  10 -13.933   1.694   5.664
   93   2HG   LYS  10          HG1       LYS  10 -15.229   2.874   5.486
   94   1HD   LYS  10          HD2       LYS  10 -16.061   0.316   6.653
   95   2HD   LYS  10          HD1       LYS  10 -14.904   1.220   7.631
   96   1HE   LYS  10          HE2       LYS  10 -16.695   3.152   6.818
   97   2HE   LYS  10          HE1       LYS  10 -17.719   1.745   7.101
   98   1HZ   LYS  10          HZ1       LYS  10 -17.006   1.603   9.321
   99   2HZ   LYS  10          HZ2       LYS  10 -17.317   3.245   9.063
  100   3HZ   LYS  10          HZ3       LYS  10 -15.724   2.680   9.079
  101    H    GLN  11           HN       GLN  11 -14.348  -1.606   4.535
  102    HA   GLN  11           HA       GLN  11 -11.959  -1.152   6.069
  103   1HB   GLN  11          HB2       GLN  11 -12.358  -3.230   7.075
  104   2HB   GLN  11          HB1       GLN  11 -13.961  -2.603   6.760
  105   1HG   GLN  11          HG2       GLN  11 -14.267  -4.065   4.923
  106   2HG   GLN  11          HG1       GLN  11 -12.568  -4.512   4.909
  107   1HE2  GLN  11          HE21      GLN  11 -13.158  -4.474   8.118
  108   2HE2  GLN  11          HE22      GLN  11 -13.703  -6.094   8.336
  109    H    TRP  12           HN       TRP  12 -12.245  -1.596   2.960
  110    HA   TRP  12           HA       TRP  12  -9.838  -3.278   2.699
  111   1HB   TRP  12          HB2       TRP  12 -11.998  -3.952   1.514
  112   2HB   TRP  12          HB1       TRP  12 -11.757  -2.597   0.480
  113    HD1  TRP  12           HD1      TRP  12 -10.747  -6.068   0.932
  114    HE1  TRP  12           HE1      TRP  12  -8.902  -6.656  -0.744
  115    HE3  TRP  12           HE3      TRP  12  -9.832  -1.473  -0.630
  116    HZ2  TRP  12           HZ2      TRP  12  -7.256  -5.267  -2.573
  117    HZ3  TRP  12           HZ3      TRP  12  -8.102  -1.059  -2.385
  118    HH2  TRP  12           HH2      TRP  12  -6.826  -2.971  -3.340
  119    H    LEU  13           HN       LEU  13 -11.336  -0.190   1.749
  120    HA   LEU  13           HA       LEU  13  -8.814   0.585   0.497
  121   1HB   LEU  13          HB2       LEU  13 -10.916   1.015  -0.728
  122   2HB   LEU  13          HB1       LEU  13 -11.473   2.023   0.594
  123    HG   LEU  13           HG       LEU  13  -9.445   3.493   0.156
  124   1HD1  LEU  13          HD11      LEU  13  -9.013   3.092  -2.515
  125   2HD1  LEU  13          HD12      LEU  13  -9.079   1.445  -1.891
  126   3HD1  LEU  13          HD13      LEU  13  -7.927   2.598  -1.218
  127   1HD2  LEU  13          HD21      LEU  13 -11.819   3.181  -1.610
  128   2HD2  LEU  13          HD22      LEU  13 -10.575   4.348  -2.061
  129   3HD2  LEU  13          HD23      LEU  13 -11.396   4.488  -0.506
  130    H    SER  14           HN       SER  14 -10.389   0.790   3.471
  131    HA   SER  14           HA       SER  14  -9.234   3.333   4.182
  132   1HB   SER  14          HB2       SER  14 -11.403   1.950   5.166
  133   2HB   SER  14          HB1       SER  14 -10.179   1.634   6.385
  134    HG   SER  14           HG       SER  14 -11.166   4.134   5.507
  135    H    LEU  15           HN       LEU  15  -8.777  -0.059   4.967
  136    HA   LEU  15           HA       LEU  15  -6.419   0.480   6.487
  137   1HB   LEU  15          HB2       LEU  15  -7.540  -2.152   5.551
  138   2HB   LEU  15          HB1       LEU  15  -6.354  -1.899   6.810
  139    HG   LEU  15           HG       LEU  15  -8.265  -2.249   8.049
  140   1HD1  LEU  15          HD11      LEU  15  -7.255  -0.075   8.659
  141   2HD1  LEU  15          HD12      LEU  15  -8.993  -0.122   8.955
  142   3HD1  LEU  15          HD13      LEU  15  -8.362   0.720   7.537
  143   1HD2  LEU  15          HD21      LEU  15 -10.252  -0.608   6.917
  144   2HD2  LEU  15          HD22      LEU  15 -10.184  -2.371   6.961
  145   3HD2  LEU  15          HD23      LEU  15  -9.478  -1.490   5.595
  146    H    ARG  16           HN       ARG  16  -7.098  -1.431   3.593
  147    HA   ARG  16           HA       ARG  16  -4.540  -2.010   2.840
  148   1HB   ARG  16          HB2       ARG  16  -6.955  -1.421   1.217
  149   2HB   ARG  16          HB1       ARG  16  -5.439  -1.713   0.409
  150   1HG   ARG  16          HG2       ARG  16  -6.946  -3.592   2.209
  151   2HG   ARG  16          HG1       ARG  16  -6.668  -3.755   0.474
  152   1HD   ARG  16          HD2       ARG  16  -4.235  -3.909   0.931
  153   2HD   ARG  16          HD1       ARG  16  -4.592  -3.874   2.658
  154    HE   ARG  16           HE       ARG  16  -6.078  -5.940   1.841
  155   1HH1  ARG  16          1HH1      ARG  16  -2.741  -5.123   1.216
  156   2HH1  ARG  16          2HH1      ARG  16  -2.238  -6.772   1.061
  157   1HH2  ARG  16          1HH2      ARG  16  -5.415  -8.108   1.642
  158   2HH2  ARG  16          2HH2      ARG  16  -3.755  -8.466   1.303
  159    H    ASN  17           HN       ASN  17  -6.157   1.005   2.613
  160    HA   ASN  17           HA       ASN  17  -4.553   2.389   0.846
  161   1HB   ASN  17          HB2       ASN  17  -6.579   2.942   2.807
  162   2HB   ASN  17          HB1       ASN  17  -5.406   4.197   2.781
  163   1HD2  ASN  17          HD21      ASN  17  -7.573   5.179   2.109
  164   2HD2  ASN  17          HD22      ASN  17  -7.805   5.315   0.411
  165    HA   PRO  18           HA       PRO  18  -1.856   4.311   4.292
  166   1HB   PRO  18          HB2       PRO  18  -2.185   3.196   6.807
  167   2HB   PRO  18          HB1       PRO  18  -2.783   4.775   6.292
  168   1HG   PRO  18          HG2       PRO  18  -4.187   2.155   6.355
  169   2HG   PRO  18          HG1       PRO  18  -4.790   3.762   6.798
  170   1HD   PRO  18          HD2       PRO  18  -5.454   2.700   4.472
  171   2HD   PRO  18          HD1       PRO  18  -5.018   4.412   4.571
  172    H    ILE  19           HN       ILE  19  -2.837   1.055   4.229
  173    HA   ILE  19           HA       ILE  19  -0.391  -0.038   5.232
  174    HB   ILE  19           HB       ILE  19  -2.558  -1.368   3.629
  175   1HG1  ILE  19          HG12      ILE  19  -2.003  -1.211   6.589
  176   2HG1  ILE  19          HG11      ILE  19  -3.380  -0.535   5.750
  177   1HG2  ILE  19          HG21      ILE  19  -0.603  -2.820   5.361
  178   2HG2  ILE  19          HG22      ILE  19  -0.190  -2.418   3.698
  179   3HG2  ILE  19          HG23      ILE  19  -1.588  -3.432   4.033
  180   1HD1  ILE  19          HD11      ILE  19  -4.236  -2.441   6.737
  181   2HD1  ILE  19          HD12      ILE  19  -2.790  -3.389   6.392
  182   3HD1  ILE  19          HD13      ILE  19  -3.900  -2.967   5.088
  183    H    LEU  20           HN       LEU  20  -1.653   0.669   2.095
  184    HA   LEU  20           HA       LEU  20   0.318  -0.528   0.486
  185   1HB   LEU  20          HB2       LEU  20  -1.379   1.911  -0.077
  186   2HB   LEU  20          HB1       LEU  20  -0.399   1.081  -1.266
  187    HG   LEU  20           HG       LEU  20  -3.058   0.440  -0.242
  188   1HD1  LEU  20          HD11      LEU  20  -3.468   0.152  -2.412
  189   2HD1  LEU  20          HD12      LEU  20  -2.095  -0.937  -2.615
  190   3HD1  LEU  20          HD13      LEU  20  -1.853   0.808  -2.683
  191   1HD2  LEU  20          HD21      LEU  20  -1.792  -1.327   0.889
  192   2HD2  LEU  20          HD22      LEU  20  -1.090  -1.806  -0.659
  193   3HD2  LEU  20          HD23      LEU  20  -2.825  -1.973  -0.389
  194    H    VAL  21           HN       VAL  21  -0.152   2.600   1.899
  195    HA   VAL  21           HA       VAL  21   2.050   4.003   1.046
  196    HB   VAL  21           HB       VAL  21   0.345   3.854   3.453
  197   1HG1  VAL  21          HG11      VAL  21   1.576   5.425   4.670
  198   2HG1  VAL  21          HG12      VAL  21   2.604   5.811   3.287
  199   3HG1  VAL  21          HG13      VAL  21   2.751   4.242   4.086
  200   1HG2  VAL  21          HG21      VAL  21  -0.468   4.972   1.476
  201   2HG2  VAL  21          HG22      VAL  21   0.929   6.057   1.481
  202   3HG2  VAL  21          HG23      VAL  21  -0.254   6.131   2.791
  203    H    PHE  22           HN       PHE  22   1.473   2.015   3.877
  204    HA   PHE  22           HA       PHE  22   3.967   2.080   5.100
  205   1HB   PHE  22          HB2       PHE  22   2.520   1.070   6.485
  206   2HB   PHE  22          HB1       PHE  22   1.505   0.543   5.167
  207    HD1  PHE  22           HD1      PHE  22   4.771  -0.141   6.629
  208    HD2  PHE  22           HD2      PHE  22   1.305  -1.587   4.739
  209    HE1  PHE  22           HE1      PHE  22   5.644  -2.424   6.840
  210    HE2  PHE  22           HE2      PHE  22   2.127  -3.897   4.930
  211    HZ   PHE  22           HZ       PHE  22   4.319  -4.324   5.975
  212    H    LEU  23           HN       LEU  23   2.734   0.350   2.372
  213    HA   LEU  23           HA       LEU  23   5.100  -1.423   2.266
  214   1HB   LEU  23          HB2       LEU  23   2.824  -1.027   0.340
  215   2HB   LEU  23          HB1       LEU  23   4.188  -2.075   0.005
  216    HG   LEU  23           HG       LEU  23   3.334  -3.003   2.439
  217   1HD1  LEU  23          HD11      LEU  23   0.787  -2.882   1.018
  218   2HD1  LEU  23          HD12      LEU  23   1.365  -1.328   1.637
  219   3HD1  LEU  23          HD13      LEU  23   1.150  -2.696   2.736
  220   1HD2  LEU  23          HD21      LEU  23   3.130  -3.818  -0.381
  221   2HD2  LEU  23          HD22      LEU  23   1.986  -4.602   0.708
  222   3HD2  LEU  23          HD23      LEU  23   3.718  -4.714   1.019
  223    H    LYS  24           HN       LYS  24   3.866   1.438   0.870
  224    HA   LYS  24           HA       LYS  24   5.612   1.720  -1.299
  225   1HB   LYS  24          HB2       LYS  24   3.486   3.107  -0.022
  226   2HB   LYS  24          HB1       LYS  24   4.754   4.247  -0.334
  227   1HG   LYS  24          HG2       LYS  24   3.952   4.375  -2.402
  228   2HG   LYS  24          HG1       LYS  24   4.549   2.730  -2.632
  229   1HD   LYS  24          HD2       LYS  24   2.265   2.191  -1.354
  230   2HD   LYS  24          HD1       LYS  24   1.797   3.690  -2.171
  231   1HE   LYS  24          HE2       LYS  24   3.031   2.402  -4.195
  232   2HE   LYS  24          HE1       LYS  24   2.408   1.026  -3.285
  233   1HZ   LYS  24          HZ1       LYS  24   0.305   1.509  -3.836
  234   2HZ   LYS  24          HZ2       LYS  24   1.000   2.386  -5.104
  235   3HZ   LYS  24          HZ3       LYS  24   0.520   3.182  -3.692
  236    H    THR  25           HN       THR  25   5.647   2.839   1.980
  237    HA   THR  25           HA       THR  25   8.046   4.317   1.812
  238    HB   THR  25           HB       THR  25   6.552   4.935   3.540
  239    HG1  THR  25           HG1      THR  25   8.814   4.734   4.177
  240   1HG2  THR  25          HG21      THR  25   5.657   2.391   3.590
  241   2HG2  THR  25          HG22      THR  25   5.302   3.599   4.829
  242   3HG2  THR  25          HG23      THR  25   6.607   2.440   5.079
  243    H    ARG  26           HN       ARG  26   7.172   1.073   2.972
  244    HA   ARG  26           HA       ARG  26   9.705   0.323   3.928
  245   1HB   ARG  26          HB2       ARG  26   7.416  -1.209   2.728
  246   2HB   ARG  26          HB1       ARG  26   8.855  -2.022   3.334
  247   1HG   ARG  26          HG2       ARG  26   6.769  -0.511   4.854
  248   2HG   ARG  26          HG1       ARG  26   7.343  -2.151   5.097
  249   1HD   ARG  26          HD2       ARG  26   9.501  -1.260   5.861
  250   2HD   ARG  26          HD1       ARG  26   8.886   0.378   5.631
  251    HE   ARG  26           HE       ARG  26   7.814   0.201   7.632
  252   1HH1  ARG  26          1HH1      ARG  26   8.553  -3.017   6.503
  253   2HH1  ARG  26          2HH1      ARG  26   7.988  -3.788   7.947
  254   1HH2  ARG  26          1HH2      ARG  26   7.071  -0.809   9.531
  255   2HH2  ARG  26          2HH2      ARG  26   7.147  -2.535   9.667
  256    H    VAL  27           HN       VAL  27   8.240   0.224   0.781
  257    HA   VAL  27           HA       VAL  27  10.347  -1.086  -0.617
  258    HB   VAL  27           HB       VAL  27   7.765   0.228  -1.201
  259   1HG1  VAL  27          HG11      VAL  27   8.216   0.035  -3.661
  260   2HG1  VAL  27          HG12      VAL  27   9.928  -0.062  -3.244
  261   3HG1  VAL  27          HG13      VAL  27   8.995   1.370  -2.813
  262   1HG2  VAL  27          HG21      VAL  27   8.092  -2.222  -0.775
  263   2HG2  VAL  27          HG22      VAL  27   8.949  -2.304  -2.315
  264   3HG2  VAL  27          HG23      VAL  27   7.251  -1.828  -2.275
  265    H    LEU  28           HN       LEU  28   9.658   2.092   0.427
  266    HA   LEU  28           HA       LEU  28  11.208   3.509  -1.485
  267   1HB   LEU  28          HB2       LEU  28  10.042   5.256  -0.691
  268   2HB   LEU  28          HB1       LEU  28   9.104   4.088   0.165
  269    HG   LEU  28           HG       LEU  28  10.450   4.408   2.152
  270   1HD1  LEU  28          HD11      LEU  28  12.528   5.173   1.917
  271   2HD1  LEU  28          HD12      LEU  28  11.818   6.778   1.756
  272   3HD1  LEU  28          HD13      LEU  28  12.187   5.829   0.317
  273   1HD2  LEU  28          HD21      LEU  28   8.550   6.108   1.138
  274   2HD2  LEU  28          HD22      LEU  28   9.846   7.206   1.612
  275   3HD2  LEU  28          HD23      LEU  28   9.147   6.103   2.797
  276    H    LYS  29           HN       LYS  29  11.323   2.747   1.897
  277    HA   LYS  29           HA       LYS  29  13.916   3.760   2.351
  278   1HB   LYS  29          HB2       LYS  29  13.793   2.787   4.534
  279   2HB   LYS  29          HB1       LYS  29  12.198   3.413   4.150
  280   1HG   LYS  29          HG2       LYS  29  11.430   1.168   3.609
  281   2HG   LYS  29          HG1       LYS  29  13.041   0.527   3.947
  282   1HD   LYS  29          HD2       LYS  29  11.782   2.142   6.080
  283   2HD   LYS  29          HD1       LYS  29  11.058   0.567   5.756
  284   1HE   LYS  29          HE2       LYS  29  13.963   0.466   5.863
  285   2HE   LYS  29          HE1       LYS  29  13.251   1.063   7.361
  286   1HZ   LYS  29          HZ1       LYS  29  11.691  -0.976   7.039
  287   2HZ   LYS  29          HZ2       LYS  29  13.231  -1.185   7.707
  288   3HZ   LYS  29          HZ3       LYS  29  12.956  -1.563   6.081
  289    H    ARG  30           HN       ARG  30  12.626   0.902   1.099
  290    HA   ARG  30           HA       ARG  30  14.985  -0.685   1.370
  291   1HB   ARG  30          HB2       ARG  30  12.284  -0.951   0.193
  292   2HB   ARG  30          HB1       ARG  30  13.515  -2.038  -0.379
  293   1HG   ARG  30          HG2       ARG  30  13.497  -1.847   2.491
  294   2HG   ARG  30          HG1       ARG  30  11.918  -2.294   1.864
  295   1HD   ARG  30          HD2       ARG  30  14.521  -3.694   1.256
  296   2HD   ARG  30          HD1       ARG  30  13.275  -4.273   2.356
  297    HE   ARG  30           HE       ARG  30  11.900  -4.766   0.517
  298   1HH1  ARG  30          1HH1      ARG  30  14.995  -3.480  -0.484
  299   2HH1  ARG  30          2HH1      ARG  30  14.832  -4.038  -2.113
  300   1HH2  ARG  30          1HH2      ARG  30  11.698  -5.494  -1.628
  301   2HH2  ARG  30          2HH2      ARG  30  12.968  -5.178  -2.762
  302    H    TRP  31           HN       TRP  31  13.419   1.422  -0.853
  303    HA   TRP  31           HA       TRP  31  14.934   0.908  -3.154
  304   1HB   TRP  31          HB2       TRP  31  12.681   2.382  -2.345
  305   2HB   TRP  31          HB1       TRP  31  13.794   3.499  -3.028
  306    HD1  TRP  31           HD1      TRP  31  11.627   0.710  -3.896
  307    HE1  TRP  31           HE1      TRP  31  11.616   0.399  -6.446
  308    HE3  TRP  31           HE3      TRP  31  15.279   3.766  -4.807
  309    HZ2  TRP  31           HZ2      TRP  31  13.108   1.439  -8.622
  310    HZ3  TRP  31           HZ3      TRP  31  16.074   4.172  -7.161
  311    HH2  TRP  31           HH2      TRP  31  14.990   3.004  -9.038
  312    H    ARG  32           HN       ARG  32  14.900   3.159  -0.412
  313    HA   ARG  32           HA       ARG  32  17.016   4.854  -1.125
  314   1HB   ARG  32          HB2       ARG  32  16.022   3.750   1.473
  315   2HB   ARG  32          HB1       ARG  32  17.100   5.145   1.355
  316   1HG   ARG  32          HG2       ARG  32  14.414   5.082   0.017
  317   2HG   ARG  32          HG1       ARG  32  14.618   5.596   1.671
  318   1HD   ARG  32          HD2       ARG  32  16.034   6.723  -0.706
  319   2HD   ARG  32          HD1       ARG  32  14.604   7.434   0.034
  320    HE   ARG  32           HE       ARG  32  17.134   7.113   1.515
  321   1HH1  ARG  32          1HH1      ARG  32  14.444   9.102   0.485
  322   2HH1  ARG  32          2HH1      ARG  32  14.916  10.449   1.461
  323   1HH2  ARG  32          1HH2      ARG  32  17.743   8.888   2.790
  324   2HH2  ARG  32          2HH2      ARG  32  16.784  10.331   2.765
  325    H    LEU  33           HN       LEU  33  16.764   1.926   0.697
  326    HA   LEU  33           HA       LEU  33  19.390   1.435   1.428
  327   1HB   LEU  33          HB2       LEU  33  16.803   0.026   1.123
  328   2HB   LEU  33          HB1       LEU  33  18.195  -0.911   1.470
  329    HG   LEU  33           HG       LEU  33  16.526   0.307   3.242
  330   1HD1  LEU  33          HD11      LEU  33  19.208  -0.223   4.302
  331   2HD1  LEU  33          HD12      LEU  33  18.510  -1.542   3.362
  332   3HD1  LEU  33          HD13      LEU  33  17.652  -0.910   4.767
  333   1HD2  LEU  33          HD21      LEU  33  17.597   2.103   4.278
  334   2HD2  LEU  33          HD22      LEU  33  17.706   2.420   2.543
  335   3HD2  LEU  33          HD23      LEU  33  19.107   1.796   3.416
  336    H    PHE  34           HN       PHE  34  17.376   0.511  -1.179
  337    HA   PHE  34           HA       PHE  34  19.252  -1.261  -2.421
  338   1HB   PHE  34          HB2       PHE  34  16.530  -0.426  -2.825
  339   2HB   PHE  34          HB1       PHE  34  17.384  -0.686  -4.320
  340    HD1  PHE  34           HD1      PHE  34  16.468  -2.706  -5.059
  341    HD2  PHE  34           HD2      PHE  34  17.926  -2.239  -1.118
  342    HE1  PHE  34           HE1      PHE  34  16.284  -5.121  -4.728
  343    HE2  PHE  34           HE2      PHE  34  17.753  -4.656  -0.754
  344    HZ   PHE  34           HZ       PHE  34  16.922  -6.129  -2.561
  345    H    SER  35           HN       SER  35  18.604   1.975  -2.302
  346    HA   SER  35           HA       SER  35  20.056   2.547  -4.827
  347   1HB   SER  35          HB2       SER  35  17.939   3.920  -3.594
  348   2HB   SER  35          HB1       SER  35  19.352   4.943  -3.364
  349    HG   SER  35           HG       SER  35  18.461   3.870  -5.833
  350    H    LYS  36           HN       LYS  36  20.378   2.821  -1.355
  351    HA   LYS  36           HA       LYS  36  22.794   4.373  -1.509
  352   1HB   LYS  36          HB2       LYS  36  22.725   4.468   0.783
  353   2HB   LYS  36          HB1       LYS  36  21.033   4.195   0.412
  354   1HG   LYS  36          HG2       LYS  36  21.254   1.850   0.952
  355   2HG   LYS  36          HG1       LYS  36  22.984   2.056   1.236
  356   1HD   LYS  36          HD2       LYS  36  21.601   2.011   3.315
  357   2HD   LYS  36          HD1       LYS  36  22.572   3.471   3.124
  358   1HE   LYS  36          HE2       LYS  36  19.793   3.489   2.067
  359   2HE   LYS  36          HE1       LYS  36  20.011   3.561   3.815
  360   1HZ   LYS  36          HZ1       LYS  36  20.421   5.712   3.607
  361   2HZ   LYS  36          HZ2       LYS  36  20.307   5.622   1.923
  362   3HZ   LYS  36          HZ3       LYS  36  21.797   5.372   2.684
  363    H    HIS  37           HN       HIS  37  21.981   1.090  -1.666
  364    HA   HIS  37           HA       HIS  37  24.485   0.011  -0.847
  365   1HB   HIS  37          HB2       HIS  37  23.140  -1.744  -0.704
  366   2HB   HIS  37          HB1       HIS  37  21.876  -0.952  -1.570
  367    HD1  HIS  37           HD1      HIS  37  24.583  -3.473  -1.993
  368    HD2  HIS  37           HD2      HIS  37  21.647  -1.589  -4.236
  369    HE1  HIS  37           HE1      HIS  37  24.392  -4.828  -4.106
  370    HE2  HIS  37           HE2      HIS  37  22.521  -3.739  -5.400
  371    H    GLU  38           HN       GLU  38  22.855   0.088  -3.983
  372    HA   GLU  38           HA       GLU  38  25.507   0.227  -5.259
  373   1HB   GLU  38          HB2       GLU  38  24.724  -1.034  -7.105
  374   2HB   GLU  38          HB1       GLU  38  24.197  -1.890  -5.669
  375   1HG   GLU  38          HG2       GLU  38  22.043  -1.683  -6.203
  376   2HG   GLU  38          HG1       GLU  38  22.220   0.013  -6.646
  Start of MODEL   14
    1   1H    VAL   1          HT1       VAL   1 -26.370   2.396  -1.116
    2   2H    VAL   1          HT2       VAL   1 -26.939   1.812   0.394
    3   3H    VAL   1          HT3       VAL   1 -27.364   1.001  -1.057
    4    HA   VAL   1           HA       VAL   1 -25.356   0.078  -1.324
    5    HB   VAL   1           HB       VAL   1 -23.323   0.897  -0.101
    6   1HG1  VAL   1          HG11      VAL   1 -23.822   3.287  -1.557
    7   2HG1  VAL   1          HG12      VAL   1 -24.605   1.950  -2.399
    8   3HG1  VAL   1          HG13      VAL   1 -22.880   1.878  -2.041
    9   1HG2  VAL   1          HG21      VAL   1 -24.418   2.089   1.706
   10   2HG2  VAL   1          HG22      VAL   1 -25.126   3.225   0.557
   11   3HG2  VAL   1          HG23      VAL   1 -23.379   3.187   0.798
   12    H    MET   2           HN       MET   2 -24.883  -1.777  -0.275
   13    HA   MET   2           HA       MET   2 -26.201  -2.420   2.102
   14   1HB   MET   2          HB2       MET   2 -24.425  -3.726   0.177
   15   2HB   MET   2          HB1       MET   2 -24.296  -4.353   1.802
   16   1HG   MET   2          HG2       MET   2 -26.729  -4.718   1.829
   17   2HG   MET   2          HG1       MET   2 -26.795  -4.144   0.162
   18   1HE   MET   2          HE1       MET   2 -26.305  -8.203   1.677
   19   2HE   MET   2          HE2       MET   2 -26.452  -6.692   2.575
   20   3HE   MET   2          HE3       MET   2 -24.857  -7.355   2.218
   21    HA   PRO   3           HA       PRO   3 -23.556  -0.501   5.160
   22   1HB   PRO   3          HB2       PRO   3 -24.229  -2.512   7.047
   23   2HB   PRO   3          HB1       PRO   3 -24.914  -0.900   6.908
   24   1HG   PRO   3          HG2       PRO   3 -25.948  -3.484   5.915
   25   2HG   PRO   3          HG1       PRO   3 -26.838  -2.034   6.413
   26   1HD   PRO   3          HD2       PRO   3 -26.612  -2.721   3.839
   27   2HD   PRO   3          HD1       PRO   3 -26.576  -1.017   4.343
   28    H    LYS   4           HN       LYS   4 -23.502  -3.854   4.381
   29    HA   LYS   4           HA       LYS   4 -20.905  -4.256   5.658
   30   1HB   LYS   4          HB2       LYS   4 -22.732  -6.184   4.226
   31   2HB   LYS   4          HB1       LYS   4 -21.244  -6.626   5.051
   32   1HG   LYS   4          HG2       LYS   4 -22.269  -5.684   7.154
   33   2HG   LYS   4          HG1       LYS   4 -23.790  -5.591   6.264
   34   1HD   LYS   4          HD2       LYS   4 -22.783  -8.175   5.814
   35   2HD   LYS   4          HD1       LYS   4 -22.558  -7.856   7.536
   36   1HE   LYS   4          HE2       LYS   4 -24.690  -8.563   7.686
   37   2HE   LYS   4          HE1       LYS   4 -25.063  -6.913   7.188
   38   1HZ   LYS   4          HZ1       LYS   4 -24.633  -9.005   5.160
   39   2HZ   LYS   4          HZ2       LYS   4 -25.527  -7.575   5.044
   40   3HZ   LYS   4          HZ3       LYS   4 -26.130  -8.877   5.937
   41    H    GLN   5           HN       GLN   5 -22.221  -3.610   2.560
   42    HA   GLN   5           HA       GLN   5 -19.951  -4.712   1.165
   43   1HB   GLN   5          HB2       GLN   5 -21.455  -4.898  -0.488
   44   2HB   GLN   5          HB1       GLN   5 -22.626  -4.150   0.574
   45   1HG   GLN   5          HG2       GLN   5 -22.809  -2.752  -1.152
   46   2HG   GLN   5          HG1       GLN   5 -21.504  -1.938  -0.340
   47   1HE2  GLN   5          HE21      GLN   5 -19.447  -3.606  -1.083
   48   2HE2  GLN   5          HE22      GLN   5 -19.259  -3.494  -2.778
   49    H    ILE   6           HN       ILE   6 -21.034  -1.667   2.353
   50    HA   ILE   6           HA       ILE   6 -19.017  -0.258   0.839
   51    HB   ILE   6           HB       ILE   6 -19.831   1.692   2.291
   52   1HG1  ILE   6          HG12      ILE   6 -22.141   1.567   2.999
   53   2HG1  ILE   6          HG11      ILE   6 -22.232  -0.108   2.540
   54   1HG2  ILE   6          HG21      ILE   6 -21.642   2.097   0.656
   55   2HG2  ILE   6          HG22      ILE   6 -21.452   0.424   0.125
   56   3HG2  ILE   6          HG23      ILE   6 -20.118   1.565  -0.060
   57   1HD1  ILE   6          HD11      ILE   6 -21.053  -0.793   4.359
   58   2HD1  ILE   6          HD12      ILE   6 -21.815   0.645   5.025
   59   3HD1  ILE   6          HD13      ILE   6 -20.140   0.705   4.473
   60    H    VAL   7           HN       VAL   7 -19.584  -1.648   3.936
   61    HA   VAL   7           HA       VAL   7 -17.485  -0.315   5.347
   62    HB   VAL   7           HB       VAL   7 -19.641  -1.535   6.254
   63   1HG1  VAL   7          HG11      VAL   7 -17.640  -3.784   6.357
   64   2HG1  VAL   7          HG12      VAL   7 -19.041  -3.734   5.289
   65   3HG1  VAL   7          HG13      VAL   7 -19.266  -3.782   7.036
   66   1HG2  VAL   7          HG21      VAL   7 -17.130  -1.986   7.780
   67   2HG2  VAL   7          HG22      VAL   7 -18.716  -1.475   8.358
   68   3HG2  VAL   7          HG23      VAL   7 -17.713  -0.362   7.430
   69    H    TYR   8           HN       TYR   8 -18.081  -3.271   3.631
   70    HA   TYR   8           HA       TYR   8 -15.673  -4.673   4.060
   71   1HB   TYR   8          HB2       TYR   8 -17.972  -4.829   2.294
   72   2HB   TYR   8          HB1       TYR   8 -16.480  -5.168   1.427
   73    HD1  TYR   8           HD1      TYR   8 -14.846  -6.415   3.441
   74    HD2  TYR   8           HD2      TYR   8 -18.977  -6.908   2.656
   75    HE1  TYR   8           HE1      TYR   8 -14.760  -8.539   4.458
   76    HE2  TYR   8           HE2      TYR   8 -18.911  -9.093   3.668
   77    HH   TYR   8           HH       TYR   8 -16.519 -10.145   5.649
   78    H    TRP   9           HN       TRP   9 -16.846  -2.421   1.618
   79    HA   TRP   9           HA       TRP   9 -14.529  -2.205   0.021
   80   1HB   TRP   9          HB2       TRP   9 -17.045  -0.740   0.447
   81   2HB   TRP   9          HB1       TRP   9 -15.695   0.305   0.003
   82    HD1  TRP   9           HD1      TRP   9 -18.257  -1.754  -1.488
   83    HE1  TRP   9           HE1      TRP   9 -17.676  -2.112  -4.005
   84    HE3  TRP   9           HE3      TRP   9 -13.563  -0.164  -1.405
   85    HZ2  TRP   9           HZ2      TRP   9 -15.488  -1.744  -5.699
   86    HZ3  TRP   9           HZ3      TRP   9 -12.227  -0.155  -3.480
   87    HH2  TRP   9           HH2      TRP   9 -13.202  -0.947  -5.588
   88    H    LYS  10           HN       LYS  10 -15.918  -0.053   2.294
   89    HA   LYS  10           HA       LYS  10 -13.909   1.753   2.731
   90   1HB   LYS  10          HB2       LYS  10 -16.066   2.145   3.650
   91   2HB   LYS  10          HB1       LYS  10 -16.016   0.654   4.578
   92   1HG   LYS  10          HG2       LYS  10 -13.834   2.054   5.486
   93   2HG   LYS  10          HG1       LYS  10 -15.061   3.294   5.251
   94   1HD   LYS  10          HD2       LYS  10 -16.401   2.469   6.894
   95   2HD   LYS  10          HD1       LYS  10 -15.922   0.797   6.585
   96   1HE   LYS  10          HE2       LYS  10 -15.005   1.268   8.679
   97   2HE   LYS  10          HE1       LYS  10 -13.653   1.471   7.566
   98   1HZ   LYS  10          HZ1       LYS  10 -15.278   3.599   8.838
   99   2HZ   LYS  10          HZ2       LYS  10 -14.198   3.897   7.570
  100   3HZ   LYS  10          HZ3       LYS  10 -13.626   3.298   9.045
  101    H    GLN  11           HN       GLN  11 -14.449  -1.274   4.532
  102    HA   GLN  11           HA       GLN  11 -12.054  -0.893   6.068
  103   1HB   GLN  11          HB2       GLN  11 -12.576  -2.906   7.152
  104   2HB   GLN  11          HB1       GLN  11 -14.136  -2.190   6.804
  105   1HG   GLN  11          HG2       GLN  11 -14.509  -3.691   5.000
  106   2HG   GLN  11          HG1       GLN  11 -12.852  -4.265   5.056
  107   1HE2  GLN  11          HE21      GLN  11 -13.522  -4.037   8.241
  108   2HE2  GLN  11          HE22      GLN  11 -14.194  -5.602   8.513
  109    H    TRP  12           HN       TRP  12 -12.337  -1.480   2.978
  110    HA   TRP  12           HA       TRP  12 -10.020  -3.299   2.836
  111   1HB   TRP  12          HB2       TRP  12 -12.199  -3.911   1.652
  112   2HB   TRP  12          HB1       TRP  12 -11.871  -2.624   0.558
  113    HD1  TRP  12           HD1      TRP  12 -11.058  -6.120   1.191
  114    HE1  TRP  12           HE1      TRP  12  -9.231  -6.886  -0.432
  115    HE3  TRP  12           HE3      TRP  12  -9.876  -1.661  -0.576
  116    HZ2  TRP  12           HZ2      TRP  12  -7.492  -5.679  -2.303
  117    HZ3  TRP  12           HZ3      TRP  12  -8.110  -1.426  -2.325
  118    HH2  TRP  12           HH2      TRP  12  -6.930  -3.448  -3.172
  119    H    LEU  13           HN       LEU  13 -11.331  -0.183   1.715
  120    HA   LEU  13           HA       LEU  13  -8.744   0.384   0.478
  121   1HB   LEU  13          HB2       LEU  13 -10.895   0.854  -0.745
  122   2HB   LEU  13          HB1       LEU  13 -11.242   2.083   0.456
  123    HG   LEU  13           HG       LEU  13  -8.902   3.033  -0.266
  124   1HD1  LEU  13          HD11      LEU  13  -9.738   1.599  -2.778
  125   2HD1  LEU  13          HD12      LEU  13  -8.423   1.071  -1.726
  126   3HD1  LEU  13          HD13      LEU  13  -8.325   2.628  -2.549
  127   1HD2  LEU  13          HD21      LEU  13 -11.122   3.385  -2.241
  128   2HD2  LEU  13          HD22      LEU  13 -10.005   4.584  -1.592
  129   3HD2  LEU  13          HD23      LEU  13 -11.298   3.945  -0.578
  130    H    SER  14           HN       SER  14 -10.353   0.817   3.406
  131    HA   SER  14           HA       SER  14  -9.082   3.334   4.016
  132   1HB   SER  14          HB2       SER  14 -11.333   2.116   5.023
  133   2HB   SER  14          HB1       SER  14 -10.151   1.795   6.279
  134    HG   SER  14           HG       SER  14 -10.892   4.321   5.228
  135    H    LEU  15           HN       LEU  15  -8.804  -0.037   4.954
  136    HA   LEU  15           HA       LEU  15  -6.448   0.452   6.500
  137   1HB   LEU  15          HB2       LEU  15  -7.703  -2.155   5.673
  138   2HB   LEU  15          HB1       LEU  15  -6.522  -1.908   6.941
  139    HG   LEU  15           HG       LEU  15  -8.467  -2.083   8.162
  140   1HD1  LEU  15          HD11      LEU  15  -8.409   0.855   7.492
  141   2HD1  LEU  15          HD12      LEU  15  -7.347   0.070   8.665
  142   3HD1  LEU  15          HD13      LEU  15  -9.087   0.121   8.948
  143   1HD2  LEU  15          HD21      LEU  15 -10.368  -2.165   7.040
  144   2HD2  LEU  15          HD22      LEU  15  -9.596  -1.388   5.649
  145   3HD2  LEU  15          HD23      LEU  15 -10.345  -0.403   6.914
  146    H    ARG  16           HN       ARG  16  -7.185  -1.558   3.688
  147    HA   ARG  16           HA       ARG  16  -4.639  -2.309   3.017
  148   1HB   ARG  16          HB2       ARG  16  -7.004  -1.690   1.328
  149   2HB   ARG  16          HB1       ARG  16  -5.490  -2.075   0.554
  150   1HG   ARG  16          HG2       ARG  16  -7.127  -3.812   2.376
  151   2HG   ARG  16          HG1       ARG  16  -6.758  -4.072   0.671
  152   1HD   ARG  16          HD2       ARG  16  -4.307  -4.135   1.403
  153   2HD   ARG  16          HD1       ARG  16  -4.933  -4.302   3.043
  154    HE   ARG  16           HE       ARG  16  -4.821  -6.324   1.044
  155   1HH1  ARG  16          1HH1      ARG  16  -6.709  -5.195   3.756
  156   2HH1  ARG  16          2HH1      ARG  16  -7.369  -6.757   4.104
  157   1HH2  ARG  16          1HH2      ARG  16  -5.690  -8.377   1.503
  158   2HH2  ARG  16          2HH2      ARG  16  -6.789  -8.563   2.830
  159    H    ASN  17           HN       ASN  17  -6.106   0.755   2.613
  160    HA   ASN  17           HA       ASN  17  -4.409   1.993   0.822
  161   1HB   ASN  17          HB2       ASN  17  -6.420   2.712   2.742
  162   2HB   ASN  17          HB1       ASN  17  -5.176   3.896   2.705
  163   1HD2  ASN  17          HD21      ASN  17  -7.273   4.988   1.982
  164   2HD2  ASN  17          HD22      ASN  17  -7.474   5.101   0.278
  165    HA   PRO  18           HA       PRO  18  -1.753   3.856   4.359
  166   1HB   PRO  18          HB2       PRO  18  -2.147   2.637   6.823
  167   2HB   PRO  18          HB1       PRO  18  -2.692   4.254   6.367
  168   1HG   PRO  18          HG2       PRO  18  -4.168   1.674   6.307
  169   2HG   PRO  18          HG1       PRO  18  -4.739   3.284   6.778
  170   1HD   PRO  18          HD2       PRO  18  -5.368   2.294   4.408
  171   2HD   PRO  18          HD1       PRO  18  -4.909   3.995   4.565
  172    H    ILE  19           HN       ILE  19  -2.801   0.608   4.239
  173    HA   ILE  19           HA       ILE  19  -0.336  -0.552   5.182
  174    HB   ILE  19           HB       ILE  19  -2.529  -1.862   3.585
  175   1HG1  ILE  19          HG12      ILE  19  -2.031  -1.695   6.558
  176   2HG1  ILE  19          HG11      ILE  19  -3.375  -0.989   5.685
  177   1HG2  ILE  19          HG21      ILE  19  -0.058  -2.865   3.903
  178   2HG2  ILE  19          HG22      ILE  19  -1.506  -3.866   3.829
  179   3HG2  ILE  19          HG23      ILE  19  -0.808  -3.439   5.390
  180   1HD1  ILE  19          HD11      ILE  19  -4.556  -2.845   5.903
  181   2HD1  ILE  19          HD12      ILE  19  -3.266  -3.491   6.917
  182   3HD1  ILE  19          HD13      ILE  19  -3.264  -3.804   5.181
  183    H    LEU  20           HN       LEU  20  -1.599   0.370   2.110
  184    HA   LEU  20           HA       LEU  20   0.406  -0.936   0.570
  185   1HB   LEU  20          HB2       LEU  20  -1.335   1.416  -0.207
  186   2HB   LEU  20          HB1       LEU  20  -0.372   0.452  -1.309
  187    HG   LEU  20           HG       LEU  20  -3.024  -0.066  -0.177
  188   1HD1  LEU  20          HD11      LEU  20  -1.532  -1.011  -2.616
  189   2HD1  LEU  20          HD12      LEU  20  -2.723   0.288  -2.533
  190   3HD1  LEU  20          HD13      LEU  20  -3.220  -1.383  -2.264
  191   1HD2  LEU  20          HD21      LEU  20  -1.764  -1.735   1.076
  192   2HD2  LEU  20          HD22      LEU  20  -1.047  -2.330  -0.423
  193   3HD2  LEU  20          HD23      LEU  20  -2.782  -2.495  -0.148
  194    H    VAL  21           HN       VAL  21  -0.178   2.269   1.801
  195    HA   VAL  21           HA       VAL  21   2.023   3.659   0.872
  196    HB   VAL  21           HB       VAL  21   0.329   3.614   3.298
  197   1HG1  VAL  21          HG11      VAL  21   2.630   5.502   2.975
  198   2HG1  VAL  21          HG12      VAL  21   2.637   4.057   3.991
  199   3HG1  VAL  21          HG13      VAL  21   1.518   5.382   4.342
  200   1HG2  VAL  21          HG21      VAL  21  -0.534   4.608   1.269
  201   2HG2  VAL  21          HG22      VAL  21   0.833   5.725   1.206
  202   3HG2  VAL  21          HG23      VAL  21  -0.339   5.838   2.522
  203    H    PHE  22           HN       PHE  22   1.421   1.872   3.812
  204    HA   PHE  22           HA       PHE  22   3.869   1.990   5.083
  205   1HB   PHE  22          HB2       PHE  22   2.362   1.070   6.479
  206   2HB   PHE  22          HB1       PHE  22   1.399   0.454   5.161
  207    HD1  PHE  22           HD1      PHE  22   1.252  -1.691   4.823
  208    HD2  PHE  22           HD2      PHE  22   4.592  -0.111   6.821
  209    HE1  PHE  22           HE1      PHE  22   2.080  -3.980   5.178
  210    HE2  PHE  22           HE2      PHE  22   5.462  -2.371   7.217
  211    HZ   PHE  22           HZ       PHE  22   4.206  -4.328   6.375
  212    H    LEU  23           HN       LEU  23   2.763   0.081   2.375
  213    HA   LEU  23           HA       LEU  23   5.214  -1.559   2.612
  214   1HB   LEU  23          HB2       LEU  23   4.065  -3.193   1.615
  215   2HB   LEU  23          HB1       LEU  23   2.642  -2.166   1.754
  216    HG   LEU  23           HG       LEU  23   4.320  -1.669  -0.603
  217   1HD1  LEU  23          HD11      LEU  23   2.720  -4.206  -0.285
  218   2HD1  LEU  23          HD12      LEU  23   4.451  -4.085  -0.601
  219   3HD1  LEU  23          HD13      LEU  23   3.292  -3.569  -1.826
  220   1HD2  LEU  23          HD21      LEU  23   1.969  -0.892   0.362
  221   2HD2  LEU  23          HD22      LEU  23   1.449  -2.180  -0.739
  222   3HD2  LEU  23          HD23      LEU  23   2.401  -0.823  -1.353
  223    H    LYS  24           HN       LYS  24   3.969   1.139   0.998
  224    HA   LYS  24           HA       LYS  24   5.635   1.176  -1.266
  225   1HB   LYS  24          HB2       LYS  24   3.485   2.652  -0.090
  226   2HB   LYS  24          HB1       LYS  24   4.726   3.765  -0.565
  227   1HG   LYS  24          HG2       LYS  24   3.853   3.645  -2.607
  228   2HG   LYS  24          HG1       LYS  24   4.492   2.001  -2.672
  229   1HD   LYS  24          HD2       LYS  24   2.311   1.508  -3.062
  230   2HD   LYS  24          HD1       LYS  24   2.294   1.501  -1.293
  231   1HE   LYS  24          HE2       LYS  24   0.842   3.184  -1.249
  232   2HE   LYS  24          HE1       LYS  24   1.887   4.171  -2.269
  233   1HZ   LYS  24          HZ1       LYS  24  -0.055   3.972  -3.489
  234   2HZ   LYS  24          HZ2       LYS  24  -0.287   2.348  -3.077
  235   3HZ   LYS  24          HZ3       LYS  24   0.930   2.776  -4.170
  236    H    THR  25           HN       THR  25   5.610   2.587   1.914
  237    HA   THR  25           HA       THR  25   7.939   4.138   1.647
  238    HB   THR  25           HB       THR  25   6.375   4.738   3.352
  239    HG1  THR  25           HG1      THR  25   8.085   5.262   4.434
  240   1HG2  THR  25          HG21      THR  25   5.649   2.235   3.644
  241   2HG2  THR  25          HG22      THR  25   5.459   3.405   4.950
  242   3HG2  THR  25          HG23      THR  25   6.822   2.287   4.960
  243    H    ARG  26           HN       ARG  26   7.257   0.918   3.032
  244    HA   ARG  26           HA       ARG  26   9.848   0.366   3.952
  245   1HB   ARG  26          HB2       ARG  26   7.663  -1.376   2.844
  246   2HB   ARG  26          HB1       ARG  26   9.144  -2.049   3.518
  247   1HG   ARG  26          HG2       ARG  26   6.929  -0.596   4.908
  248   2HG   ARG  26          HG1       ARG  26   7.594  -2.184   5.253
  249   1HD   ARG  26          HD2       ARG  26   9.495   0.040   5.490
  250   2HD   ARG  26          HD1       ARG  26   8.162   0.081   6.633
  251    HE   ARG  26           HE       ARG  26   9.025  -1.776   7.680
  252   1HH1  ARG  26          1HH1      ARG  26  10.692  -1.279   4.653
  253   2HH1  ARG  26          2HH1      ARG  26  11.928  -2.441   5.001
  254   1HH2  ARG  26          1HH2      ARG  26  10.649  -3.303   8.136
  255   2HH2  ARG  26          2HH2      ARG  26  11.903  -3.591   6.975
  256    H    VAL  27           HN       VAL  27   8.335   0.034   0.847
  257    HA   VAL  27           HA       VAL  27  10.486  -1.213  -0.540
  258    HB   VAL  27           HB       VAL  27   7.824  -0.070  -1.114
  259   1HG1  VAL  27          HG11      VAL  27   9.969  -0.257  -3.190
  260   2HG1  VAL  27          HG12      VAL  27   8.932   1.109  -2.785
  261   3HG1  VAL  27          HG13      VAL  27   8.250  -0.307  -3.585
  262   1HG2  VAL  27          HG21      VAL  27   8.168  -2.450  -0.649
  263   2HG2  VAL  27          HG22      VAL  27   9.216  -2.570  -2.063
  264   3HG2  VAL  27          HG23      VAL  27   7.506  -2.187  -2.262
  265    H    LEU  28           HN       LEU  28   9.653   1.967   0.386
  266    HA   LEU  28           HA       LEU  28  11.108   3.384  -1.595
  267   1HB   LEU  28          HB2       LEU  28   9.873   5.105  -0.868
  268   2HB   LEU  28          HB1       LEU  28   8.985   3.926   0.027
  269    HG   LEU  28           HG       LEU  28  10.319   4.381   2.007
  270   1HD1  LEU  28          HD11      LEU  28  11.977   5.813   0.116
  271   2HD1  LEU  28          HD12      LEU  28  12.342   5.261   1.751
  272   3HD1  LEU  28          HD13      LEU  28  11.545   6.815   1.503
  273   1HD2  LEU  28          HD21      LEU  28   9.607   7.116   1.552
  274   2HD2  LEU  28          HD22      LEU  28   8.790   5.901   2.532
  275   3HD2  LEU  28          HD23      LEU  28   8.401   6.059   0.820
  276    H    LYS  29           HN       LYS  29  11.293   2.764   1.816
  277    HA   LYS  29           HA       LYS  29  13.837   3.927   2.179
  278   1HB   LYS  29          HB2       LYS  29  13.793   3.106   4.418
  279   2HB   LYS  29          HB1       LYS  29  12.163   3.620   4.022
  280   1HG   LYS  29          HG2       LYS  29  11.728   1.655   5.074
  281   2HG   LYS  29          HG1       LYS  29  11.852   1.082   3.418
  282   1HD   LYS  29          HD2       LYS  29  13.118  -0.417   4.749
  283   2HD   LYS  29          HD1       LYS  29  14.287   0.592   3.900
  284   1HE   LYS  29          HE2       LYS  29  13.867   2.027   6.178
  285   2HE   LYS  29          HE1       LYS  29  13.709   0.372   6.765
  286   1HZ   LYS  29          HZ1       LYS  29  15.941   0.617   6.943
  287   2HZ   LYS  29          HZ2       LYS  29  16.049   1.749   5.691
  288   3HZ   LYS  29          HZ3       LYS  29  15.894   0.104   5.330
  289    H    ARG  30           HN       ARG  30  12.694   0.993   1.027
  290    HA   ARG  30           HA       ARG  30  15.120  -0.477   1.366
  291   1HB   ARG  30          HB2       ARG  30  12.436  -0.903   0.194
  292   2HB   ARG  30          HB1       ARG  30  13.717  -1.949  -0.345
  293   1HG   ARG  30          HG2       ARG  30  13.695  -1.680   2.514
  294   2HG   ARG  30          HG1       ARG  30  12.130  -2.201   1.909
  295   1HD   ARG  30          HD2       ARG  30  12.947  -4.187   1.084
  296   2HD   ARG  30          HD1       ARG  30  14.574  -3.543   0.864
  297    HE   ARG  30           HE       ARG  30  15.086  -4.259   2.967
  298   1HH1  ARG  30          1HH1      ARG  30  11.612  -4.071   2.686
  299   2HH1  ARG  30          2HH1      ARG  30  11.324  -4.775   4.241
  300   1HH2  ARG  30          1HH2      ARG  30  14.707  -5.189   5.011
  301   2HH2  ARG  30          2HH2      ARG  30  13.078  -5.410   5.560
  302    H    TRP  31           HN       TRP  31  13.456   1.496  -0.900
  303    HA   TRP  31           HA       TRP  31  14.966   1.011  -3.208
  304   1HB   TRP  31          HB2       TRP  31  12.659   2.383  -2.401
  305   2HB   TRP  31          HB1       TRP  31  13.706   3.550  -3.104
  306    HD1  TRP  31           HD1      TRP  31  11.665   0.656  -3.924
  307    HE1  TRP  31           HE1      TRP  31  11.647   0.314  -6.467
  308    HE3  TRP  31           HE3      TRP  31  15.169   3.862  -4.903
  309    HZ2  TRP  31           HZ2      TRP  31  13.071   1.393  -8.670
  310    HZ3  TRP  31           HZ3      TRP  31  15.922   4.274  -7.269
  311    HH2  TRP  31           HH2      TRP  31  14.874   3.037  -9.122
  312    H    ARG  32           HN       ARG  32  14.836   3.364  -0.523
  313    HA   ARG  32           HA       ARG  32  16.897   5.089  -1.345
  314   1HB   ARG  32          HB2       ARG  32  15.932   4.111   1.307
  315   2HB   ARG  32          HB1       ARG  32  17.041   5.477   1.132
  316   1HG   ARG  32          HG2       ARG  32  15.358   6.668  -0.151
  317   2HG   ARG  32          HG1       ARG  32  14.264   5.310  -0.014
  318   1HD   ARG  32          HD2       ARG  32  13.724   7.052   1.599
  319   2HD   ARG  32          HD1       ARG  32  14.202   5.545   2.374
  320    HE   ARG  32           HE       ARG  32  16.465   7.172   2.127
  321   1HH1  ARG  32          1HH1      ARG  32  13.442   7.081   3.870
  322   2HH1  ARG  32          2HH1      ARG  32  14.056   7.955   5.232
  323   1HH2  ARG  32          1HH2      ARG  32  17.275   8.323   3.919
  324   2HH2  ARG  32          2HH2      ARG  32  16.232   8.662   5.260
  325    H    LEU  33           HN       LEU  33  16.798   2.315   0.727
  326    HA   LEU  33           HA       LEU  33  19.428   1.928   1.408
  327   1HB   LEU  33          HB2       LEU  33  16.892   0.409   1.188
  328   2HB   LEU  33          HB1       LEU  33  18.326  -0.469   1.538
  329    HG   LEU  33           HG       LEU  33  16.651   0.749   3.306
  330   1HD1  LEU  33          HD11      LEU  33  19.520   0.032   3.866
  331   2HD1  LEU  33          HD12      LEU  33  18.215  -1.145   3.724
  332   3HD1  LEU  33          HD13      LEU  33  18.185   0.053   5.018
  333   1HD2  LEU  33          HD21      LEU  33  17.768   2.872   2.496
  334   2HD2  LEU  33          HD22      LEU  33  19.179   2.327   3.404
  335   3HD2  LEU  33          HD23      LEU  33  17.653   2.625   4.241
  336    H    PHE  34           HN       PHE  34  17.457   0.793  -1.147
  337    HA   PHE  34           HA       PHE  34  19.367  -0.958  -2.319
  338   1HB   PHE  34          HB2       PHE  34  16.680  -0.080  -2.847
  339   2HB   PHE  34          HB1       PHE  34  17.581  -0.393  -4.300
  340    HD1  PHE  34           HD1      PHE  34  16.574  -2.381  -5.016
  341    HD2  PHE  34           HD2      PHE  34  18.016  -1.917  -1.069
  342    HE1  PHE  34           HE1      PHE  34  16.294  -4.781  -4.653
  343    HE2  PHE  34           HE2      PHE  34  17.751  -4.317  -0.675
  344    HZ   PHE  34           HZ       PHE  34  16.880  -5.783  -2.468
  345    H    SER  35           HN       SER  35  18.646   2.283  -2.308
  346    HA   SER  35           HA       SER  35  20.252   2.838  -4.734
  347   1HB   SER  35          HB2       SER  35  18.065   4.200  -3.676
  348   2HB   SER  35          HB1       SER  35  19.443   5.237  -3.315
  349    HG   SER  35           HG       SER  35  19.764   5.562  -5.392
  350    H    LYS  36           HN       LYS  36  20.522   2.964  -1.255
  351    HA   LYS  36           HA       LYS  36  22.955   4.548  -1.414
  352   1HB   LYS  36          HB2       LYS  36  21.869   3.210   1.053
  353   2HB   LYS  36          HB1       LYS  36  22.984   4.563   0.964
  354   1HG   LYS  36          HG2       LYS  36  20.512   5.147  -0.384
  355   2HG   LYS  36          HG1       LYS  36  20.240   4.666   1.289
  356   1HD   LYS  36          HD2       LYS  36  20.531   7.026   1.290
  357   2HD   LYS  36          HD1       LYS  36  22.027   6.336   1.923
  358   1HE   LYS  36          HE2       LYS  36  23.212   7.266   0.288
  359   2HE   LYS  36          HE1       LYS  36  22.170   6.540  -0.936
  360   1HZ   LYS  36          HZ1       LYS  36  21.866   9.165   0.398
  361   2HZ   LYS  36          HZ2       LYS  36  20.588   8.430  -0.432
  362   3HZ   LYS  36          HZ3       LYS  36  22.008   8.839  -1.256
  363    H    HIS  37           HN       HIS  37  21.957   1.317  -0.637
  364    HA   HIS  37           HA       HIS  37  24.600   0.344  -0.142
  365   1HB   HIS  37          HB2       HIS  37  21.915  -0.661   0.053
  366   2HB   HIS  37          HB1       HIS  37  22.928  -1.829  -0.771
  367    HD1  HIS  37           HD1      HIS  37  23.797  -3.477   0.856
  368    HD2  HIS  37           HD2      HIS  37  23.539   0.335   2.487
  369    HE1  HIS  37           HE1      HIS  37  24.659  -3.694   3.210
  370    HE2  HIS  37           HE2      HIS  37  24.445  -1.385   4.196
  371    H    GLU  38           HN       GLU  38  22.458   0.404  -2.940
  372    HA   GLU  38           HA       GLU  38  22.696  -0.333  -5.078
  373   1HB   GLU  38          HB2       GLU  38  24.869   0.380  -6.126
  374   2HB   GLU  38          HB1       GLU  38  24.009   1.643  -5.258
  375   1HG   GLU  38          HG2       GLU  38  25.506   1.417  -3.376
  376   2HG   GLU  38          HG1       GLU  38  26.330   0.071  -4.162
  Start of MODEL   15
    1   1H    VAL   1          HT1       VAL   1 -26.835   0.382  -0.154
    2   2H    VAL   1          HT2       VAL   1 -27.267  -0.155  -1.725
    3   3H    VAL   1          HT3       VAL   1 -26.199   1.175  -1.533
    4    HA   VAL   1           HA       VAL   1 -25.421  -1.279  -2.027
    5    HB   VAL   1           HB       VAL   1 -23.220  -0.627  -1.148
    6   1HG1  VAL   1          HG11      VAL   1 -22.862   1.167  -2.610
    7   2HG1  VAL   1          HG12      VAL   1 -24.484   1.810  -2.359
    8   3HG1  VAL   1          HG13      VAL   1 -24.257   0.324  -3.281
    9   1HG2  VAL   1          HG21      VAL   1 -23.408   1.915  -0.221
   10   2HG2  VAL   1          HG22      VAL   1 -23.294   0.486   0.807
   11   3HG2  VAL   1          HG23      VAL   1 -24.870   1.199   0.459
   12    H    MET   2           HN       MET   2 -24.515  -3.054  -0.946
   13    HA   MET   2           HA       MET   2 -25.835  -3.846   1.392
   14   1HB   MET   2          HB2       MET   2 -23.866  -4.947  -0.477
   15   2HB   MET   2          HB1       MET   2 -23.730  -5.561   1.154
   16   1HG   MET   2          HG2       MET   2 -26.234  -6.009   1.012
   17   2HG   MET   2          HG1       MET   2 -26.046  -5.734  -0.719
   18   1HE   MET   2          HE1       MET   2 -23.937  -7.679  -2.153
   19   2HE   MET   2          HE2       MET   2 -25.619  -7.158  -2.246
   20   3HE   MET   2          HE3       MET   2 -25.234  -8.874  -2.120
   21    HA   PRO   3           HA       PRO   3 -23.482  -1.605   4.489
   22   1HB   PRO   3          HB2       PRO   3 -24.041  -3.642   6.385
   23   2HB   PRO   3          HB1       PRO   3 -24.858  -2.098   6.198
   24   1HG   PRO   3          HG2       PRO   3 -25.631  -4.775   5.215
   25   2HG   PRO   3          HG1       PRO   3 -26.660  -3.400   5.660
   26   1HD   PRO   3          HD2       PRO   3 -26.289  -4.102   3.109
   27   2HD   PRO   3          HD1       PRO   3 -26.412  -2.393   3.583
   28    H    LYS   4           HN       LYS   4 -23.111  -4.942   3.751
   29    HA   LYS   4           HA       LYS   4 -20.546  -5.125   5.139
   30   1HB   LYS   4          HB2       LYS   4 -22.306  -6.940   5.248
   31   2HB   LYS   4          HB1       LYS   4 -21.962  -7.257   3.551
   32   1HG   LYS   4          HG2       LYS   4 -20.164  -8.461   4.052
   33   2HG   LYS   4          HG1       LYS   4 -19.541  -7.211   5.131
   34   1HD   LYS   4          HD2       LYS   4 -21.527  -8.161   6.659
   35   2HD   LYS   4          HD1       LYS   4 -21.154  -9.617   5.735
   36   1HE   LYS   4          HE2       LYS   4 -19.525  -9.979   7.214
   37   2HE   LYS   4          HE1       LYS   4 -18.669  -8.644   6.443
   38   1HZ   LYS   4          HZ1       LYS   4 -20.266  -7.328   8.127
   39   2HZ   LYS   4          HZ2       LYS   4 -18.691  -7.810   8.512
   40   3HZ   LYS   4          HZ3       LYS   4 -20.007  -8.748   9.011
   41    H    GLN   5           HN       GLN   5 -21.758  -4.583   1.973
   42    HA   GLN   5           HA       GLN   5 -19.331  -5.500   0.718
   43   1HB   GLN   5          HB2       GLN   5 -20.755  -5.846  -0.986
   44   2HB   GLN   5          HB1       GLN   5 -22.020  -5.081  -0.049
   45   1HG   GLN   5          HG2       GLN   5 -22.031  -3.863  -1.965
   46   2HG   GLN   5          HG1       GLN   5 -21.050  -2.870  -0.920
   47   1HE2  GLN   5          HE21      GLN   5 -18.725  -4.617  -1.283
   48   2HE2  GLN   5          HE22      GLN   5 -18.204  -4.336  -2.883
   49    H    ILE   6           HN       ILE   6 -20.756  -2.546   1.808
   50    HA   ILE   6           HA       ILE   6 -18.790  -0.960   0.420
   51    HB   ILE   6           HB       ILE   6 -19.820   0.896   1.864
   52   1HG1  ILE   6          HG12      ILE   6 -22.132   0.576   2.485
   53   2HG1  ILE   6          HG11      ILE   6 -22.077  -1.094   1.994
   54   1HG2  ILE   6          HG21      ILE   6 -21.432   1.317   0.146
   55   2HG2  ILE   6          HG22      ILE   6 -21.438  -0.392  -0.296
   56   3HG2  ILE   6          HG23      ILE   6 -19.990   0.583  -0.559
   57   1HD1  ILE   6          HD11      ILE   6 -20.891  -1.717   3.834
   58   2HD1  ILE   6          HD12      ILE   6 -21.816  -0.379   4.503
   59   3HD1  ILE   6          HD13      ILE   6 -20.133  -0.142   4.021
   60    H    VAL   7           HN       VAL   7 -19.357  -2.431   3.489
   61    HA   VAL   7           HA       VAL   7 -17.427  -0.948   4.992
   62    HB   VAL   7           HB       VAL   7 -19.499  -2.384   5.794
   63   1HG1  VAL   7          HG11      VAL   7 -18.909  -4.590   6.600
   64   2HG1  VAL   7          HG12      VAL   7 -17.286  -4.426   5.929
   65   3HG1  VAL   7          HG13      VAL   7 -18.680  -4.506   4.853
   66   1HG2  VAL   7          HG21      VAL   7 -17.037  -2.622   7.438
   67   2HG2  VAL   7          HG22      VAL   7 -18.685  -2.230   7.930
   68   3HG2  VAL   7          HG23      VAL   7 -17.721  -1.046   7.053
   69    H    TYR   8           HN       TYR   8 -17.707  -3.911   3.222
   70    HA   TYR   8           HA       TYR   8 -15.184  -5.102   3.682
   71   1HB   TYR   8          HB2       TYR   8 -17.422  -5.691   2.149
   72   2HB   TYR   8          HB1       TYR   8 -16.176  -5.369   0.950
   73    HD1  TYR   8           HD1      TYR   8 -15.430  -7.427   0.165
   74    HD2  TYR   8           HD2      TYR   8 -15.987  -6.856   4.325
   75    HE1  TYR   8           HE1      TYR   8 -14.410  -9.567   0.593
   76    HE2  TYR   8           HE2      TYR   8 -14.982  -8.943   4.770
   77    HH   TYR   8           HH       TYR   8 -13.370 -10.545   3.658
   78    H    TRP   9           HN       TRP   9 -16.516  -2.951   1.232
   79    HA   TRP   9           HA       TRP   9 -14.217  -2.469  -0.315
   80   1HB   TRP   9          HB2       TRP   9 -16.838  -1.200   0.157
   81   2HB   TRP   9          HB1       TRP   9 -15.562  -0.065  -0.288
   82    HD1  TRP   9           HD1      TRP   9 -18.035  -2.198  -1.803
   83    HE1  TRP   9           HE1      TRP   9 -17.439  -2.515  -4.320
   84    HE3  TRP   9           HE3      TRP   9 -13.389  -0.465  -1.701
   85    HZ2  TRP   9           HZ2      TRP   9 -15.262  -2.068  -6.011
   86    HZ3  TRP   9           HZ3      TRP   9 -12.054  -0.400  -3.772
   87    HH2  TRP   9           HH2      TRP   9 -13.003  -1.204  -5.891
   88    H    LYS  10           HN       LYS  10 -15.778  -0.488   2.002
   89    HA   LYS  10           HA       LYS  10 -13.904   1.446   2.503
   90   1HB   LYS  10          HB2       LYS  10 -16.130   1.627   3.365
   91   2HB   LYS  10          HB1       LYS  10 -15.937   0.168   4.324
   92   1HG   LYS  10          HG2       LYS  10 -13.917   1.751   5.241
   93   2HG   LYS  10          HG1       LYS  10 -15.204   2.911   4.919
   94   1HD   LYS  10          HD2       LYS  10 -16.639   1.939   6.453
   95   2HD   LYS  10          HD1       LYS  10 -15.809   0.382   6.388
   96   1HE   LYS  10          HE2       LYS  10 -14.185   1.029   7.861
   97   2HE   LYS  10          HE1       LYS  10 -14.297   2.729   7.407
   98   1HZ   LYS  10          HZ1       LYS  10 -16.713   2.251   8.508
   99   2HZ   LYS  10          HZ2       LYS  10 -15.398   2.939   9.321
  100   3HZ   LYS  10          HZ3       LYS  10 -15.704   1.282   9.459
  101    H    GLN  11           HN       GLN  11 -14.311  -1.611   4.279
  102    HA   GLN  11           HA       GLN  11 -11.980  -1.139   5.874
  103   1HB   GLN  11          HB2       GLN  11 -12.389  -3.188   6.901
  104   2HB   GLN  11          HB1       GLN  11 -13.991  -2.628   6.485
  105   1HG   GLN  11          HG2       GLN  11 -14.263  -4.215   4.838
  106   2HG   GLN  11          HG1       GLN  11 -12.534  -4.443   4.612
  107   1HE2  GLN  11          HE21      GLN  11 -12.679  -4.511   7.856
  108   2HE2  GLN  11          HE22      GLN  11 -13.010  -6.182   8.108
  109    H    TRP  12           HN       TRP  12 -12.130  -1.625   2.755
  110    HA   TRP  12           HA       TRP  12  -9.686  -3.256   2.631
  111   1HB   TRP  12          HB2       TRP  12 -11.789  -3.960   1.352
  112   2HB   TRP  12          HB1       TRP  12 -11.488  -2.630   0.302
  113    HD1  TRP  12           HD1      TRP  12 -10.525  -6.094   0.883
  114    HE1  TRP  12           HE1      TRP  12  -8.582  -6.722  -0.665
  115    HE3  TRP  12           HE3      TRP  12  -9.485  -1.531  -0.699
  116    HZ2  TRP  12           HZ2      TRP  12  -6.814  -5.376  -2.409
  117    HZ3  TRP  12           HZ3      TRP  12  -7.641  -1.160  -2.348
  118    HH2  TRP  12           HH2      TRP  12  -6.320  -3.097  -3.186
  119    H    LEU  13           HN       LEU  13 -11.197  -0.192   1.612
  120    HA   LEU  13           HA       LEU  13  -8.647   0.651   0.466
  121   1HB   LEU  13          HB2       LEU  13 -11.371   1.961   0.454
  122   2HB   LEU  13          HB1       LEU  13  -9.935   2.651  -0.279
  123    HG   LEU  13           HG       LEU  13 -11.107  -0.001  -1.103
  124   1HD1  LEU  13          HD11      LEU  13 -12.798   1.428  -1.738
  125   2HD1  LEU  13          HD12      LEU  13 -11.755   1.460  -3.160
  126   3HD1  LEU  13          HD13      LEU  13 -11.701   2.784  -1.996
  127   1HD2  LEU  13          HD21      LEU  13  -9.079   1.829  -2.384
  128   2HD2  LEU  13          HD22      LEU  13  -9.726   0.355  -3.105
  129   3HD2  LEU  13          HD23      LEU  13  -8.756   0.265  -1.635
  130    H    SER  14           HN       SER  14 -10.335   0.786   3.374
  131    HA   SER  14           HA       SER  14  -9.283   3.356   4.153
  132   1HB   SER  14          HB2       SER  14 -11.452   1.943   5.032
  133   2HB   SER  14          HB1       SER  14 -10.276   1.579   6.286
  134    HG   SER  14           HG       SER  14 -11.058   4.165   5.415
  135    H    LEU  15           HN       LEU  15  -8.771  -0.023   4.937
  136    HA   LEU  15           HA       LEU  15  -6.473   0.550   6.540
  137   1HB   LEU  15          HB2       LEU  15  -7.521  -2.096   5.561
  138   2HB   LEU  15          HB1       LEU  15  -6.386  -1.827   6.866
  139    HG   LEU  15           HG       LEU  15  -8.338  -2.208   8.032
  140   1HD1  LEU  15          HD11      LEU  15  -7.380  -0.020   8.679
  141   2HD1  LEU  15          HD12      LEU  15  -9.128  -0.094   8.915
  142   3HD1  LEU  15          HD13      LEU  15  -8.461   0.761   7.522
  143   1HD2  LEU  15          HD21      LEU  15 -10.213  -2.356   6.870
  144   2HD2  LEU  15          HD22      LEU  15  -9.472  -1.458   5.535
  145   3HD2  LEU  15          HD23      LEU  15 -10.308  -0.593   6.833
  146    H    ARG  16           HN       ARG  16  -7.031  -1.345   3.611
  147    HA   ARG  16           HA       ARG  16  -4.430  -1.870   2.943
  148   1HB   ARG  16          HB2       ARG  16  -6.811  -1.357   1.244
  149   2HB   ARG  16          HB1       ARG  16  -5.262  -1.618   0.491
  150   1HG   ARG  16          HG2       ARG  16  -6.776  -3.514   2.265
  151   2HG   ARG  16          HG1       ARG  16  -6.450  -3.690   0.540
  152   1HD   ARG  16          HD2       ARG  16  -4.065  -3.876   0.996
  153   2HD   ARG  16          HD1       ARG  16  -4.366  -3.647   2.717
  154    HE   ARG  16           HE       ARG  16  -5.045  -6.020   1.137
  155   1HH1  ARG  16          1HH1      ARG  16  -4.827  -4.433   4.247
  156   2HH1  ARG  16          2HH1      ARG  16  -5.011  -5.903   5.142
  157   1HH2  ARG  16          1HH2      ARG  16  -5.289  -7.944   2.322
  158   2HH2  ARG  16          2HH2      ARG  16  -5.274  -7.892   4.053
  159    H    ASN  17           HN       ASN  17  -6.100   1.103   2.742
  160    HA   ASN  17           HA       ASN  17  -4.530   2.543   0.988
  161   1HB   ASN  17          HB2       ASN  17  -6.592   3.033   2.905
  162   2HB   ASN  17          HB1       ASN  17  -5.437   4.306   2.943
  163   1HD2  ASN  17          HD21      ASN  17  -7.594   5.276   2.234
  164   2HD2  ASN  17          HD22      ASN  17  -7.781   5.452   0.535
  165    HA   PRO  18           HA       PRO  18  -1.834   4.503   4.372
  166   1HB   PRO  18          HB2       PRO  18  -2.185   3.575   6.944
  167   2HB   PRO  18          HB1       PRO  18  -2.816   5.099   6.314
  168   1HG   PRO  18          HG2       PRO  18  -4.154   2.446   6.507
  169   2HG   PRO  18          HG1       PRO  18  -4.793   4.051   6.906
  170   1HD   PRO  18          HD2       PRO  18  -5.450   2.930   4.617
  171   2HD   PRO  18          HD1       PRO  18  -5.005   4.643   4.654
  172    H    ILE  19           HN       ILE  19  -2.842   1.269   4.409
  173    HA   ILE  19           HA       ILE  19  -0.443   0.215   5.557
  174    HB   ILE  19           HB       ILE  19  -2.652  -1.157   4.063
  175   1HG1  ILE  19          HG12      ILE  19  -1.991  -0.779   6.971
  176   2HG1  ILE  19          HG11      ILE  19  -3.452  -0.304   6.135
  177   1HG2  ILE  19          HG21      ILE  19  -1.720  -3.262   4.887
  178   2HG2  ILE  19          HG22      ILE  19  -0.361  -2.386   5.589
  179   3HG2  ILE  19          HG23      ILE  19  -0.575  -2.426   3.840
  180   1HD1  ILE  19          HD11      ILE  19  -4.179  -2.563   5.957
  181   2HD1  ILE  19          HD12      ILE  19  -3.705  -2.273   7.630
  182   3HD1  ILE  19          HD13      ILE  19  -2.631  -3.164   6.551
  183    H    LEU  20           HN       LEU  20  -1.557   0.807   2.318
  184    HA   LEU  20           HA       LEU  20   0.538  -0.623   1.017
  185   1HB   LEU  20          HB2       LEU  20  -0.165   0.361  -1.009
  186   2HB   LEU  20          HB1       LEU  20  -1.613   0.013  -0.094
  187    HG   LEU  20           HG       LEU  20  -0.825   2.684   0.488
  188   1HD1  LEU  20          HD11      LEU  20  -1.372   3.417  -1.985
  189   2HD1  LEU  20          HD12      LEU  20  -0.596   1.880  -2.362
  190   3HD1  LEU  20          HD13      LEU  20   0.283   3.114  -1.461
  191   1HD2  LEU  20          HD21      LEU  20  -3.114   1.732  -1.189
  192   2HD2  LEU  20          HD22      LEU  20  -3.030   3.164  -0.160
  193   3HD2  LEU  20          HD23      LEU  20  -3.044   1.553   0.563
  194    H    VAL  21           HN       VAL  21  -0.068   2.578   2.149
  195    HA   VAL  21           HA       VAL  21   2.138   3.973   1.245
  196    HB   VAL  21           HB       VAL  21   0.389   3.974   3.636
  197   1HG1  VAL  21          HG11      VAL  21   2.604   5.952   3.329
  198   2HG1  VAL  21          HG12      VAL  21   2.781   4.448   4.239
  199   3HG1  VAL  21          HG13      VAL  21   1.576   5.647   4.733
  200   1HG2  VAL  21          HG21      VAL  21  -0.424   4.912   1.559
  201   2HG2  VAL  21          HG22      VAL  21   0.945   6.031   1.506
  202   3HG2  VAL  21          HG23      VAL  21  -0.261   6.170   2.789
  203    H    PHE  22           HN       PHE  22   1.490   2.168   4.183
  204    HA   PHE  22           HA       PHE  22   3.936   2.309   5.486
  205   1HB   PHE  22          HB2       PHE  22   2.438   1.366   6.870
  206   2HB   PHE  22          HB1       PHE  22   1.478   0.760   5.542
  207    HD1  PHE  22           HD1      PHE  22   1.307  -1.388   5.224
  208    HD2  PHE  22           HD2      PHE  22   4.690   0.181   7.164
  209    HE1  PHE  22           HE1      PHE  22   2.135  -3.679   5.566
  210    HE2  PHE  22           HE2      PHE  22   5.559  -2.081   7.542
  211    HZ   PHE  22           HZ       PHE  22   4.281  -4.034   6.724
  212    H    LEU  23           HN       LEU  23   2.817   0.434   2.816
  213    HA   LEU  23           HA       LEU  23   5.187  -1.327   2.881
  214   1HB   LEU  23          HB2       LEU  23   2.960  -1.053   0.878
  215   2HB   LEU  23          HB1       LEU  23   4.355  -2.075   0.603
  216    HG   LEU  23           HG       LEU  23   3.517  -2.986   3.027
  217   1HD1  LEU  23          HD11      LEU  23   0.927  -2.930   1.716
  218   2HD1  LEU  23          HD12      LEU  23   1.507  -1.329   2.193
  219   3HD1  LEU  23          HD13      LEU  23   1.358  -2.613   3.400
  220   1HD2  LEU  23          HD21      LEU  23   3.510  -3.854   0.288
  221   2HD2  LEU  23          HD22      LEU  23   2.067  -4.451   1.109
  222   3HD2  LEU  23          HD23      LEU  23   3.667  -4.813   1.760
  223    H    LYS  24           HN       LYS  24   3.970   1.431   1.258
  224    HA   LYS  24           HA       LYS  24   5.807   1.629  -0.830
  225   1HB   LYS  24          HB2       LYS  24   3.622   3.058   0.266
  226   2HB   LYS  24          HB1       LYS  24   4.903   4.198  -0.006
  227   1HG   LYS  24          HG2       LYS  24   4.217   4.249  -2.117
  228   2HG   LYS  24          HG1       LYS  24   4.864   2.613  -2.255
  229   1HD   LYS  24          HD2       LYS  24   2.540   2.012  -1.141
  230   2HD   LYS  24          HD1       LYS  24   2.065   3.515  -1.947
  231   1HE   LYS  24          HE2       LYS  24   2.625   2.674  -4.077
  232   2HE   LYS  24          HE1       LYS  24   3.531   1.326  -3.393
  233   1HZ   LYS  24          HZ1       LYS  24   0.683   1.600  -3.846
  234   2HZ   LYS  24          HZ2       LYS  24   1.110   0.880  -2.377
  235   3HZ   LYS  24          HZ3       LYS  24   1.650   0.212  -3.833
  236    H    THR  25           HN       THR  25   5.718   2.927   2.390
  237    HA   THR  25           HA       THR  25   8.103   4.407   2.260
  238    HB   THR  25           HB       THR  25   6.607   4.977   4.004
  239    HG1  THR  25           HG1      THR  25   7.970   4.994   5.635
  240   1HG2  THR  25          HG21      THR  25   5.645   2.512   3.998
  241   2HG2  THR  25          HG22      THR  25   5.446   3.599   5.374
  242   3HG2  THR  25          HG23      THR  25   6.711   2.371   5.399
  243    H    ARG  26           HN       ARG  26   7.270   1.146   3.379
  244    HA   ARG  26           HA       ARG  26   9.847   0.395   4.255
  245   1HB   ARG  26          HB2       ARG  26   7.509  -1.139   3.148
  246   2HB   ARG  26          HB1       ARG  26   8.962  -1.944   3.731
  247   1HG   ARG  26          HG2       ARG  26   6.927  -0.395   5.283
  248   2HG   ARG  26          HG1       ARG  26   7.473  -2.047   5.522
  249   1HD   ARG  26          HD2       ARG  26   9.704  -1.138   6.146
  250   2HD   ARG  26          HD1       ARG  26   9.010   0.482   6.054
  251    HE   ARG  26           HE       ARG  26   7.378  -0.473   7.803
  252   1HH1  ARG  26          1HH1      ARG  26  10.771  -1.290   7.579
  253   2HH1  ARG  26          2HH1      ARG  26  10.917  -1.650   9.265
  254   1HH2  ARG  26          1HH2      ARG  26   7.580  -0.943  10.016
  255   2HH2  ARG  26          2HH2      ARG  26   9.111  -1.452  10.647
  256    H    VAL  27           HN       VAL  27   8.228   0.347   1.188
  257    HA   VAL  27           HA       VAL  27  10.294  -0.981  -0.259
  258    HB   VAL  27           HB       VAL  27   7.665   0.275  -0.781
  259   1HG1  VAL  27          HG11      VAL  27   8.034   0.021  -3.253
  260   2HG1  VAL  27          HG12      VAL  27   9.760  -0.031  -2.892
  261   3HG1  VAL  27          HG13      VAL  27   8.812   1.393  -2.467
  262   1HG2  VAL  27          HG21      VAL  27   7.977  -2.138  -0.304
  263   2HG2  VAL  27          HG22      VAL  27   8.880  -2.280  -1.813
  264   3HG2  VAL  27          HG23      VAL  27   7.177  -1.820  -1.843
  265    H    LEU  28           HN       LEU  28   9.585   2.208   0.739
  266    HA   LEU  28           HA       LEU  28  11.005   3.637  -1.248
  267   1HB   LEU  28          HB2       LEU  28   9.968   5.400  -0.307
  268   2HB   LEU  28          HB1       LEU  28   9.060   4.227   0.574
  269    HG   LEU  28           HG       LEU  28  10.576   4.437   2.463
  270   1HD1  LEU  28          HD11      LEU  28  12.629   5.206   2.113
  271   2HD1  LEU  28          HD12      LEU  28  11.924   6.820   2.027
  272   3HD1  LEU  28          HD13      LEU  28  12.182   5.891   0.550
  273   1HD2  LEU  28          HD21      LEU  28   9.994   7.249   2.184
  274   2HD2  LEU  28          HD22      LEU  28   9.273   6.049   3.256
  275   3HD2  LEU  28          HD23      LEU  28   8.652   6.252   1.618
  276    H    LYS  29           HN       LYS  29  11.405   2.784   2.086
  277    HA   LYS  29           HA       LYS  29  14.069   3.697   2.295
  278   1HB   LYS  29          HB2       LYS  29  14.097   2.753   4.490
  279   2HB   LYS  29          HB1       LYS  29  12.506   3.455   4.246
  280   1HG   LYS  29          HG2       LYS  29  11.899   1.487   5.182
  281   2HG   LYS  29          HG1       LYS  29  11.932   0.988   3.495
  282   1HD   LYS  29          HD2       LYS  29  14.117   0.025   3.758
  283   2HD   LYS  29          HD1       LYS  29  14.257   0.688   5.387
  284   1HE   LYS  29          HE2       LYS  29  11.942  -0.737   5.568
  285   2HE   LYS  29          HE1       LYS  29  12.874  -1.717   4.436
  286   1HZ   LYS  29          HZ1       LYS  29  14.221  -0.777   6.855
  287   2HZ   LYS  29          HZ2       LYS  29  14.420  -2.223   6.002
  288   3HZ   LYS  29          HZ3       LYS  29  13.088  -2.022   7.023
  289    H    ARG  30           HN       ARG  30  12.553   0.991   0.995
  290    HA   ARG  30           HA       ARG  30  14.839  -0.745   1.148
  291   1HB   ARG  30          HB2       ARG  30  13.416  -2.356   0.386
  292   2HB   ARG  30          HB1       ARG  30  12.189  -1.238   0.881
  293   1HG   ARG  30          HG2       ARG  30  11.441  -1.073  -1.186
  294   2HG   ARG  30          HG1       ARG  30  13.024  -0.669  -1.800
  295   1HD   ARG  30          HD2       ARG  30  13.570  -2.891  -2.220
  296   2HD   ARG  30          HD1       ARG  30  12.320  -3.495  -1.136
  297    HE   ARG  30           HE       ARG  30  11.796  -2.284  -3.773
  298   1HH1  ARG  30          1HH1      ARG  30  10.947  -4.522  -1.219
  299   2HH1  ARG  30          2HH1      ARG  30   9.603  -5.182  -2.086
  300   1HH2  ARG  30          1HH2      ARG  30  10.030  -3.158  -4.899
  301   2HH2  ARG  30          2HH2      ARG  30   9.082  -4.411  -4.169
  302    H    TRP  31           HN       TRP  31  13.201   1.457  -0.905
  303    HA   TRP  31           HA       TRP  31  14.574   1.123  -3.302
  304   1HB   TRP  31          HB2       TRP  31  12.441   2.587  -2.238
  305   2HB   TRP  31          HB1       TRP  31  13.548   3.741  -2.866
  306    HD1  TRP  31           HD1      TRP  31  11.221   1.142  -3.886
  307    HE1  TRP  31           HE1      TRP  31  11.072   1.080  -6.447
  308    HE3  TRP  31           HE3      TRP  31  14.971   4.108  -4.699
  309    HZ2  TRP  31           HZ2      TRP  31  12.504   2.258  -8.594
  310    HZ3  TRP  31           HZ3      TRP  31  15.668   4.704  -7.044
  311    HH2  TRP  31           HH2      TRP  31  14.436   3.772  -8.962
  312    H    ARG  32           HN       ARG  32  14.821   3.231  -0.449
  313    HA   ARG  32           HA       ARG  32  16.968   4.851  -1.219
  314   1HB   ARG  32          HB2       ARG  32  16.089   3.674   1.387
  315   2HB   ARG  32          HB1       ARG  32  17.224   5.023   1.260
  316   1HG   ARG  32          HG2       ARG  32  14.456   5.142   0.102
  317   2HG   ARG  32          HG1       ARG  32  14.797   5.577   1.757
  318   1HD   ARG  32          HD2       ARG  32  16.168   6.729  -0.634
  319   2HD   ARG  32          HD1       ARG  32  14.762   7.464   0.130
  320    HE   ARG  32           HE       ARG  32  16.624   7.126   2.137
  321   1HH1  ARG  32          1HH1      ARG  32  16.463   8.846  -0.896
  322   2HH1  ARG  32          2HH1      ARG  32  17.536  10.104  -0.382
  323   1HH2  ARG  32          1HH2      ARG  32  18.035   8.779   2.815
  324   2HH2  ARG  32          2HH2      ARG  32  18.429  10.065   1.724
  325    H    LEU  33           HN       LEU  33  16.707   1.866   0.513
  326    HA   LEU  33           HA       LEU  33  19.352   1.227   1.021
  327   1HB   LEU  33          HB2       LEU  33  16.677  -0.040   0.876
  328   2HB   LEU  33          HB1       LEU  33  18.042  -1.064   1.071
  329    HG   LEU  33           HG       LEU  33  16.602   0.160   3.022
  330   1HD1  LEU  33          HD11      LEU  33  19.393  -0.571   3.694
  331   2HD1  LEU  33          HD12      LEU  33  18.382  -1.815   2.961
  332   3HD1  LEU  33          HD13      LEU  33  17.883  -1.049   4.469
  333   1HD2  LEU  33          HD21      LEU  33  17.780   2.253   2.300
  334   2HD2  LEU  33          HD22      LEU  33  19.246   1.550   2.984
  335   3HD2  LEU  33          HD23      LEU  33  17.854   1.868   4.022
  336    H    PHE  34           HN       PHE  34  17.118   0.483  -1.457
  337    HA   PHE  34           HA       PHE  34  18.789  -1.335  -2.891
  338   1HB   PHE  34          HB2       PHE  34  16.118  -0.278  -3.101
  339   2HB   PHE  34          HB1       PHE  34  16.860  -0.568  -4.647
  340    HD1  PHE  34           HD1      PHE  34  15.693  -2.468  -5.359
  341    HD2  PHE  34           HD2      PHE  34  17.481  -2.265  -1.532
  342    HE1  PHE  34           HE1      PHE  34  15.308  -4.863  -5.073
  343    HE2  PHE  34           HE2      PHE  34  17.111  -4.662  -1.218
  344    HZ   PHE  34           HZ       PHE  34  16.011  -5.995  -2.989
  345    H    SER  35           HN       SER  35  18.326   1.932  -2.611
  346    HA   SER  35           HA       SER  35  19.671   2.544  -5.181
  347   1HB   SER  35          HB2       SER  35  17.728   3.978  -3.756
  348   2HB   SER  35          HB1       SER  35  19.216   4.895  -3.550
  349    HG   SER  35           HG       SER  35  19.440   4.902  -5.814
  350    H    LYS  36           HN       LYS  36  20.252   2.530  -1.738
  351    HA   LYS  36           HA       LYS  36  22.758   3.939  -2.006
  352   1HB   LYS  36          HB2       LYS  36  22.777   4.097   0.263
  353   2HB   LYS  36          HB1       LYS  36  21.064   3.802   0.030
  354   1HG   LYS  36          HG2       LYS  36  21.271   1.534   0.684
  355   2HG   LYS  36          HG1       LYS  36  23.033   1.610   0.627
  356   1HD   LYS  36          HD2       LYS  36  22.130   1.689   2.931
  357   2HD   LYS  36          HD1       LYS  36  23.080   3.114   2.507
  358   1HE   LYS  36          HE2       LYS  36  20.293   3.486   1.844
  359   2HE   LYS  36          HE1       LYS  36  20.489   3.056   3.543
  360   1HZ   LYS  36          HZ1       LYS  36  20.718   5.539   2.599
  361   2HZ   LYS  36          HZ2       LYS  36  22.338   5.053   2.544
  362   3HZ   LYS  36          HZ3       LYS  36  21.488   4.998   4.006
  363    H    HIS  37           HN       HIS  37  21.672   0.705  -2.037
  364    HA   HIS  37           HA       HIS  37  24.204  -0.503  -1.460
  365   1HB   HIS  37          HB2       HIS  37  21.479  -1.377  -1.908
  366   2HB   HIS  37          HB1       HIS  37  22.621  -2.385  -2.769
  367    HD1  HIS  37           HD1      HIS  37  23.229  -4.362  -1.425
  368    HD2  HIS  37           HD2      HIS  37  22.589  -1.017   0.955
  369    HE1  HIS  37           HE1      HIS  37  23.632  -5.129   0.936
  370    HE2  HIS  37           HE2      HIS  37  23.141  -3.114   2.365
  371    H    GLU  38           HN       GLU  38  22.225  -0.158  -4.393
  372    HA   GLU  38           HA       GLU  38  24.484  -0.981  -6.030
  373   1HB   GLU  38          HB2       GLU  38  21.552  -0.785  -6.385
  374   2HB   GLU  38          HB1       GLU  38  22.525  -0.467  -7.811
  375   1HG   GLU  38          HG2       GLU  38  23.567  -2.630  -7.641
  376   2HG   GLU  38          HG1       GLU  38  22.730  -2.944  -6.120
  Start of MODEL   16
    1   1H    VAL   1          HT1       VAL   1 -29.215   3.920   2.856
    2   2H    VAL   1          HT2       VAL   1 -30.514   3.349   1.890
    3   3H    VAL   1          HT3       VAL   1 -29.279   4.313   1.189
    4    HA   VAL   1           HA       VAL   1 -29.403   1.650   1.145
    5    HB   VAL   1           HB       VAL   1 -26.958   1.790   0.532
    6   1HG1  VAL   1          HG11      VAL   1 -28.963   2.205  -1.000
    7   2HG1  VAL   1          HG12      VAL   1 -27.390   2.791  -1.540
    8   3HG1  VAL   1          HG13      VAL   1 -28.562   3.916  -0.854
    9   1HG2  VAL   1          HG21      VAL   1 -27.133   4.747   0.591
   10   2HG2  VAL   1          HG22      VAL   1 -25.732   3.689   0.759
   11   3HG2  VAL   1          HG23      VAL   1 -26.826   3.928   2.122
   12    H    MET   2           HN       MET   2 -28.584  -0.087   2.219
   13    HA   MET   2           HA       MET   2 -28.030   0.166   4.968
   14   1HB   MET   2          HB2       MET   2 -28.309  -1.986   2.981
   15   2HB   MET   2          HB1       MET   2 -27.254  -2.355   4.323
   16   1HG   MET   2          HG2       MET   2 -29.102  -1.673   5.860
   17   2HG   MET   2          HG1       MET   2 -30.136  -1.556   4.436
   18   1HE   MET   2          HE1       MET   2 -31.775  -4.821   5.067
   19   2HE   MET   2          HE2       MET   2 -31.832  -3.218   4.336
   20   3HE   MET   2          HE3       MET   2 -31.674  -3.386   6.086
   21    HA   PRO   3           HA       PRO   3 -23.595   0.403   4.778
   22   1HB   PRO   3          HB2       PRO   3 -23.015   0.088   7.323
   23   2HB   PRO   3          HB1       PRO   3 -24.220   1.304   6.900
   24   1HG   PRO   3          HG2       PRO   3 -24.655  -1.519   7.807
   25   2HG   PRO   3          HG1       PRO   3 -25.355  -0.027   8.479
   26   1HD   PRO   3          HD2       PRO   3 -26.616  -1.605   6.594
   27   2HD   PRO   3          HD1       PRO   3 -26.924   0.132   6.798
   28    H    LYS   4           HN       LYS   4 -21.927  -1.263   6.531
   29    HA   LYS   4           HA       LYS   4 -20.889  -3.270   6.644
   30   1HB   LYS   4          HB2       LYS   4 -23.343  -4.029   6.962
   31   2HB   LYS   4          HB1       LYS   4 -23.226  -4.582   5.298
   32   1HG   LYS   4          HG2       LYS   4 -21.083  -5.796   6.132
   33   2HG   LYS   4          HG1       LYS   4 -21.806  -5.575   7.727
   34   1HD   LYS   4          HD2       LYS   4 -23.932  -6.529   6.383
   35   2HD   LYS   4          HD1       LYS   4 -22.630  -7.318   5.490
   36   1HE   LYS   4          HE2       LYS   4 -21.719  -8.118   7.668
   37   2HE   LYS   4          HE1       LYS   4 -23.155  -7.463   8.454
   38   1HZ   LYS   4          HZ1       LYS   4 -24.368  -8.925   6.694
   39   2HZ   LYS   4          HZ2       LYS   4 -23.773  -9.623   8.115
   40   3HZ   LYS   4          HZ3       LYS   4 -22.907  -9.780   6.670
   41    H    GLN   5           HN       GLN   5 -22.357  -2.304   3.614
   42    HA   GLN   5           HA       GLN   5 -20.440  -3.907   2.137
   43   1HB   GLN   5          HB2       GLN   5 -22.128  -4.040   0.650
   44   2HB   GLN   5          HB1       GLN   5 -23.083  -2.978   1.664
   45   1HG   GLN   5          HG2       GLN   5 -23.108  -1.882  -0.323
   46   2HG   GLN   5          HG1       GLN   5 -21.791  -1.072   0.482
   47   1HE2  GLN   5          HE21      GLN   5 -19.944  -3.244   0.001
   48   2HE2  GLN   5          HE22      GLN   5 -19.627  -3.219  -1.677
   49    H    ILE   6           HN       ILE   6 -21.116  -0.697   3.133
   50    HA   ILE   6           HA       ILE   6 -19.113   0.475   1.445
   51    HB   ILE   6           HB       ILE   6 -19.638   2.512   2.961
   52   1HG1  ILE   6          HG12      ILE   6 -21.907   2.594   3.810
   53   2HG1  ILE   6          HG11      ILE   6 -22.190   0.936   3.349
   54   1HG2  ILE   6          HG21      ILE   6 -21.412   3.139   1.423
   55   2HG2  ILE   6          HG22      ILE   6 -21.589   1.446   0.955
   56   3HG2  ILE   6          HG23      ILE   6 -20.091   2.308   0.597
   57   1HD1  ILE   6          HD11      ILE   6 -21.481   1.737   5.813
   58   2HD1  ILE   6          HD12      ILE   6 -19.892   1.398   5.127
   59   3HD1  ILE   6          HD13      ILE   6 -21.125   0.136   5.169
   60    H    VAL   7           HN       VAL   7 -19.548  -0.783   4.635
   61    HA   VAL   7           HA       VAL   7 -17.227   0.372   5.838
   62    HB   VAL   7           HB       VAL   7 -19.432  -0.653   6.914
   63   1HG1  VAL   7          HG11      VAL   7 -17.574  -3.029   6.929
   64   2HG1  VAL   7          HG12      VAL   7 -19.087  -2.913   6.033
   65   3HG1  VAL   7          HG13      VAL   7 -19.103  -2.893   7.796
   66   1HG2  VAL   7          HG21      VAL   7 -18.329  -0.712   8.988
   67   2HG2  VAL   7          HG22      VAL   7 -17.489   0.476   7.994
   68   3HG2  VAL   7          HG23      VAL   7 -16.789  -1.123   8.235
   69    H    TYR   8           HN       TYR   8 -18.227  -2.571   4.299
   70    HA   TYR   8           HA       TYR   8 -15.915  -4.169   4.555
   71   1HB   TYR   8          HB2       TYR   8 -18.397  -4.370   3.290
   72   2HB   TYR   8          HB1       TYR   8 -17.227  -4.418   1.976
   73    HD1  TYR   8           HD1      TYR   8 -17.038  -6.650   1.340
   74    HD2  TYR   8           HD2      TYR   8 -17.002  -5.637   5.452
   75    HE1  TYR   8           HE1      TYR   8 -16.453  -8.920   1.892
   76    HE2  TYR   8           HE2      TYR   8 -16.418  -7.852   6.018
   77    HH   TYR   8           HH       TYR   8 -16.816 -10.297   4.727
   78    H    TRP   9           HN       TRP   9 -17.134  -1.925   2.139
   79    HA   TRP   9           HA       TRP   9 -14.988  -1.930   0.315
   80   1HB   TRP   9          HB2       TRP   9 -17.275  -0.182   1.002
   81   2HB   TRP   9          HB1       TRP   9 -15.896   0.660   0.296
   82    HD1  TRP   9           HD1      TRP   9 -18.909  -1.045  -0.706
   83    HE1  TRP   9           HE1      TRP   9 -18.729  -1.638  -3.233
   84    HE3  TRP   9           HE3      TRP   9 -14.049  -0.260  -1.318
   85    HZ2  TRP   9           HZ2      TRP   9 -16.758  -1.744  -5.208
   86    HZ3  TRP   9           HZ3      TRP   9 -13.019  -0.602  -3.536
   87    HH2  TRP   9           HH2      TRP   9 -14.382  -1.339  -5.441
   88    H    LYS  10           HN       LYS  10 -15.908   0.395   2.657
   89    HA   LYS  10           HA       LYS  10 -13.693   1.997   2.828
   90   1HB   LYS  10          HB2       LYS  10 -15.726   2.620   3.914
   91   2HB   LYS  10          HB1       LYS  10 -15.704   1.176   4.914
   92   1HG   LYS  10          HG2       LYS  10 -13.331   2.415   5.522
   93   2HG   LYS  10          HG1       LYS  10 -14.465   3.751   5.338
   94   1HD   LYS  10          HD2       LYS  10 -15.527   1.484   6.852
   95   2HD   LYS  10          HD1       LYS  10 -14.132   2.256   7.608
   96   1HE   LYS  10          HE2       LYS  10 -16.374   3.930   6.564
   97   2HE   LYS  10          HE1       LYS  10 -16.541   3.117   8.118
   98   1HZ   LYS  10          HZ1       LYS  10 -14.810   5.337   7.359
   99   2HZ   LYS  10          HZ2       LYS  10 -14.174   4.219   8.457
  100   3HZ   LYS  10          HZ3       LYS  10 -15.609   5.038   8.821
  101    H    GLN  11           HN       GLN  11 -14.390  -0.868   4.831
  102    HA   GLN  11           HA       GLN  11 -11.868  -0.726   6.159
  103   1HB   GLN  11          HB2       GLN  11 -12.463  -2.690   7.280
  104   2HB   GLN  11          HB1       GLN  11 -13.989  -1.872   7.033
  105   1HG   GLN  11          HG2       GLN  11 -14.634  -3.359   5.344
  106   2HG   GLN  11          HG1       GLN  11 -13.004  -3.978   5.141
  107   1HE2  GLN  11          HE21      GLN  11 -13.180  -3.847   8.391
  108   2HE2  GLN  11          HE22      GLN  11 -13.863  -5.396   8.714
  109    H    TRP  12           HN       TRP  12 -12.439  -1.293   3.095
  110    HA   TRP  12           HA       TRP  12 -10.277  -3.266   2.783
  111   1HB   TRP  12          HB2       TRP  12 -12.586  -3.690   1.767
  112   2HB   TRP  12          HB1       TRP  12 -12.237  -2.428   0.649
  113    HD1  TRP  12           HD1      TRP  12 -11.688  -5.983   1.212
  114    HE1  TRP  12           HE1      TRP  12 -10.054  -6.894  -0.536
  115    HE3  TRP  12           HE3      TRP  12 -10.234  -1.631  -0.617
  116    HZ2  TRP  12           HZ2      TRP  12  -8.347  -5.831  -2.519
  117    HZ3  TRP  12           HZ3      TRP  12  -8.576  -1.540  -2.483
  118    HH2  TRP  12           HH2      TRP  12  -7.646  -3.652  -3.416
  119    H    LEU  13           HN       LEU  13 -11.432  -0.047   1.771
  120    HA   LEU  13           HA       LEU  13  -8.882   0.352   0.387
  121   1HB   LEU  13          HB2       LEU  13 -11.360   2.088   0.482
  122   2HB   LEU  13          HB1       LEU  13  -9.905   2.458  -0.423
  123    HG   LEU  13           HG       LEU  13 -11.535  -0.019  -0.930
  124   1HD1  LEU  13          HD11      LEU  13 -11.705   2.556  -2.477
  125   2HD1  LEU  13          HD12      LEU  13 -12.848   2.117  -1.207
  126   3HD1  LEU  13          HD13      LEU  13 -12.704   1.115  -2.650
  127   1HD2  LEU  13          HD21      LEU  13  -9.890   1.349  -2.982
  128   2HD2  LEU  13          HD22      LEU  13 -10.197  -0.370  -2.735
  129   3HD2  LEU  13          HD23      LEU  13  -9.039   0.475  -1.709
  130    H    SER  14           HN       SER  14 -10.217   0.793   3.418
  131    HA   SER  14           HA       SER  14  -8.810   3.270   3.950
  132   1HB   SER  14          HB2       SER  14 -11.066   2.206   5.076
  133   2HB   SER  14          HB1       SER  14  -9.847   1.758   6.259
  134    HG   SER  14           HG       SER  14  -9.562   3.804   6.765
  135    H    LEU  15           HN       LEU  15  -8.667  -0.118   4.807
  136    HA   LEU  15           HA       LEU  15  -6.195   0.204   6.210
  137   1HB   LEU  15          HB2       LEU  15  -7.694  -2.301   5.470
  138   2HB   LEU  15          HB1       LEU  15  -6.406  -2.153   6.648
  139    HG   LEU  15           HG       LEU  15  -8.267  -2.178   8.009
  140   1HD1  LEU  15          HD11      LEU  15  -8.650   0.071   8.826
  141   2HD1  LEU  15          HD12      LEU  15  -8.013   0.744   7.322
  142   3HD1  LEU  15          HD13      LEU  15  -6.943  -0.126   8.424
  143   1HD2  LEU  15          HD21      LEU  15 -10.243  -2.101   7.023
  144   2HD2  LEU  15          HD22      LEU  15  -9.511  -1.376   5.583
  145   3HD2  LEU  15          HD23      LEU  15 -10.087  -0.347   6.902
  146    H    ARG  16           HN       ARG  16  -7.261  -1.754   3.467
  147    HA   ARG  16           HA       ARG  16  -4.820  -2.652   2.593
  148   1HB   ARG  16          HB2       ARG  16  -7.299  -1.928   1.115
  149   2HB   ARG  16          HB1       ARG  16  -5.888  -2.429   0.222
  150   1HG   ARG  16          HG2       ARG  16  -7.465  -4.005   2.230
  151   2HG   ARG  16          HG1       ARG  16  -7.250  -4.340   0.510
  152   1HD   ARG  16          HD2       ARG  16  -4.700  -4.387   1.224
  153   2HD   ARG  16          HD1       ARG  16  -5.400  -4.792   2.788
  154    HE   ARG  16           HE       ARG  16  -5.804  -6.353   0.318
  155   1HH1  ARG  16          1HH1      ARG  16  -5.587  -6.168   3.806
  156   2HH1  ARG  16          2HH1      ARG  16  -5.727  -7.878   4.022
  157   1HH2  ARG  16          1HH2      ARG  16  -5.988  -8.597   0.617
  158   2HH2  ARG  16          2HH2      ARG  16  -5.954  -9.254   2.219
  159    H    ASN  17           HN       ASN  17  -6.107   0.497   2.348
  160    HA   ASN  17           HA       ASN  17  -4.506   1.563   0.329
  161   1HB   ASN  17          HB2       ASN  17  -6.392   2.469   2.290
  162   2HB   ASN  17          HB1       ASN  17  -5.108   3.603   2.115
  163   1HD2  ASN  17          HD21      ASN  17  -7.112   4.792   1.405
  164   2HD2  ASN  17          HD22      ASN  17  -7.434   4.771  -0.283
  165    HA   PRO  18           HA       PRO  18  -1.627   3.527   3.604
  166   1HB   PRO  18          HB2       PRO  18  -1.971   2.618   6.189
  167   2HB   PRO  18          HB1       PRO  18  -2.527   4.173   5.563
  168   1HG   PRO  18          HG2       PRO  18  -4.009   1.603   5.804
  169   2HG   PRO  18          HG1       PRO  18  -4.553   3.249   6.180
  170   1HD   PRO  18          HD2       PRO  18  -5.293   2.114   3.918
  171   2HD   PRO  18          HD1       PRO  18  -4.775   3.807   3.924
  172    H    ILE  19           HN       ILE  19  -2.775   0.339   3.716
  173    HA   ILE  19           HA       ILE  19  -0.433  -0.848   4.842
  174    HB   ILE  19           HB       ILE  19  -2.728  -2.099   3.353
  175   1HG1  ILE  19          HG12      ILE  19  -2.019  -1.771   6.262
  176   2HG1  ILE  19          HG11      ILE  19  -3.449  -1.195   5.439
  177   1HG2  ILE  19          HG21      ILE  19  -1.324  -3.963   5.004
  178   2HG2  ILE  19          HG22      ILE  19  -0.181  -3.218   3.890
  179   3HG2  ILE  19          HG23      ILE  19  -1.617  -4.027   3.267
  180   1HD1  ILE  19          HD11      ILE  19  -3.777  -3.800   5.019
  181   2HD1  ILE  19          HD12      ILE  19  -4.360  -2.983   6.469
  182   3HD1  ILE  19          HD13      ILE  19  -2.837  -3.873   6.509
  183    H    LEU  20           HN       LEU  20  -1.552  -0.317   1.602
  184    HA   LEU  20           HA       LEU  20   0.543  -1.806   0.354
  185   1HB   LEU  20          HB2       LEU  20  -0.234  -0.987  -1.718
  186   2HB   LEU  20          HB1       LEU  20  -1.649  -1.310  -0.745
  187    HG   LEU  20           HG       LEU  20  -0.898   1.424  -0.398
  188   1HD1  LEU  20          HD11      LEU  20   0.099   0.829  -2.739
  189   2HD1  LEU  20          HD12      LEU  20  -0.843   2.305  -2.526
  190   3HD1  LEU  20          HD13      LEU  20  -1.589   0.878  -3.247
  191   1HD2  LEU  20          HD21      LEU  20  -3.257   0.181  -1.781
  192   2HD2  LEU  20          HD22      LEU  20  -3.160   1.806  -1.099
  193   3HD2  LEU  20          HD23      LEU  20  -3.091   0.397  -0.041
  194    H    VAL  21           HN       VAL  21  -0.120   1.448   1.290
  195    HA   VAL  21           HA       VAL  21   2.062   2.807   0.229
  196    HB   VAL  21           HB       VAL  21   0.327   3.001   2.616
  197   1HG1  VAL  21          HG11      VAL  21   1.441   4.887   3.456
  198   2HG1  VAL  21          HG12      VAL  21   2.492   4.975   2.038
  199   3HG1  VAL  21          HG13      VAL  21   2.654   3.632   3.176
  200   1HG2  VAL  21          HG21      VAL  21   0.747   4.829   0.261
  201   2HG2  VAL  21          HG22      VAL  21  -0.437   5.064   1.549
  202   3HG2  VAL  21          HG23      VAL  21  -0.570   3.672   0.468
  203    H    PHE  22           HN       PHE  22   1.392   1.315   3.342
  204    HA   PHE  22           HA       PHE  22   3.753   1.649   4.706
  205   1HB   PHE  22          HB2       PHE  22   2.268   0.715   6.095
  206   2HB   PHE  22          HB1       PHE  22   1.391  -0.030   4.778
  207    HD1  PHE  22           HD1      PHE  22   1.327  -2.190   4.635
  208    HD2  PHE  22           HD2      PHE  22   4.577  -0.326   6.529
  209    HE1  PHE  22           HE1      PHE  22   2.240  -4.412   5.179
  210    HE2  PHE  22           HE2      PHE  22   5.534  -2.509   7.109
  211    HZ   PHE  22           HZ       PHE  22   4.367  -4.580   6.419
  212    H    LEU  23           HN       LEU  23   2.865  -0.510   2.141
  213    HA   LEU  23           HA       LEU  23   5.348  -2.091   2.443
  214   1HB   LEU  23          HB2       LEU  23   3.237  -2.082   0.297
  215   2HB   LEU  23          HB1       LEU  23   4.692  -3.055   0.197
  216    HG   LEU  23           HG       LEU  23   3.659  -3.754   2.655
  217   1HD1  LEU  23          HD11      LEU  23   1.417  -3.681   2.654
  218   2HD1  LEU  23          HD12      LEU  23   1.305  -3.995   0.918
  219   3HD1  LEU  23          HD13      LEU  23   1.678  -2.365   1.502
  220   1HD2  LEU  23          HD21      LEU  23   4.380  -5.556   1.482
  221   2HD2  LEU  23          HD22      LEU  23   3.794  -4.923  -0.055
  222   3HD2  LEU  23          HD23      LEU  23   2.672  -5.691   1.068
  223    H    LYS  24           HN       LYS  24   4.055   0.437   0.525
  224    HA   LYS  24           HA       LYS  24   6.037   0.619  -1.433
  225   1HB   LYS  24          HB2       LYS  24   3.670   1.951  -0.614
  226   2HB   LYS  24          HB1       LYS  24   4.877   3.158  -0.911
  227   1HG   LYS  24          HG2       LYS  24   4.394   2.961  -3.069
  228   2HG   LYS  24          HG1       LYS  24   5.073   1.332  -2.997
  229   1HD   LYS  24          HD2       LYS  24   3.049   0.580  -3.527
  230   2HD   LYS  24          HD1       LYS  24   2.573   1.035  -1.883
  231   1HE   LYS  24          HE2       LYS  24   1.145   2.515  -2.744
  232   2HE   LYS  24          HE1       LYS  24   2.499   3.385  -3.461
  233   1HZ   LYS  24          HZ1       LYS  24   2.269   1.537  -5.271
  234   2HZ   LYS  24          HZ2       LYS  24   1.273   2.903  -5.306
  235   3HZ   LYS  24          HZ3       LYS  24   0.682   1.443  -4.693
  236    H    THR  25           HN       THR  25   5.593   2.144   1.650
  237    HA   THR  25           HA       THR  25   7.814   3.848   1.566
  238    HB   THR  25           HB       THR  25   6.093   4.390   3.101
  239    HG1  THR  25           HG1      THR  25   7.208   4.536   4.999
  240   1HG2  THR  25          HG21      THR  25   5.183   2.071   3.279
  241   2HG2  THR  25          HG22      THR  25   5.223   2.982   4.791
  242   3HG2  THR  25          HG23      THR  25   6.439   1.747   4.472
  243    H    ARG  26           HN       ARG  26   7.217   0.614   2.893
  244    HA   ARG  26           HA       ARG  26   9.753   0.262   4.084
  245   1HB   ARG  26          HB2       ARG  26   7.746  -1.640   2.901
  246   2HB   ARG  26          HB1       ARG  26   9.215  -2.206   3.690
  247   1HG   ARG  26          HG2       ARG  26   6.846  -0.829   4.889
  248   2HG   ARG  26          HG1       ARG  26   7.577  -2.359   5.337
  249   1HD   ARG  26          HD2       ARG  26   9.554  -1.148   6.156
  250   2HD   ARG  26          HD1       ARG  26   8.773   0.375   5.733
  251    HE   ARG  26           HE       ARG  26   8.107  -1.375   7.963
  252   1HH1  ARG  26          1HH1      ARG  26   7.314   1.463   6.091
  253   2HH1  ARG  26          2HH1      ARG  26   6.246   2.108   7.289
  254   1HH2  ARG  26          1HH2      ARG  26   6.701  -0.522   9.540
  255   2HH2  ARG  26          2HH2      ARG  26   5.900   0.984   9.246
  256    H    VAL  27           HN       VAL  27   8.486  -0.270   0.894
  257    HA   VAL  27           HA       VAL  27  10.870  -1.373  -0.222
  258    HB   VAL  27           HB       VAL  27   8.153  -0.582  -1.098
  259   1HG1  VAL  27          HG11      VAL  27   9.305   0.550  -2.776
  260   2HG1  VAL  27          HG12      VAL  27   8.806  -0.984  -3.489
  261   3HG1  VAL  27          HG13      VAL  27  10.477  -0.749  -2.974
  262   1HG2  VAL  27          HG21      VAL  27   8.379  -2.829  -0.487
  263   2HG2  VAL  27          HG22      VAL  27   9.899  -3.007  -1.365
  264   3HG2  VAL  27          HG23      VAL  27   8.383  -2.845  -2.251
  265    H    LEU  28           HN       LEU  28   9.610   1.752   0.386
  266    HA   LEU  28           HA       LEU  28  11.024   3.190  -1.600
  267   1HB   LEU  28          HB2       LEU  28   9.676   4.867  -0.961
  268   2HB   LEU  28          HB1       LEU  28   8.823   3.659  -0.071
  269    HG   LEU  28           HG       LEU  28  10.051   4.248   1.946
  270   1HD1  LEU  28          HD11      LEU  28  11.129   6.739   1.448
  271   2HD1  LEU  28          HD12      LEU  28  11.661   5.766   0.075
  272   3HD1  LEU  28          HD13      LEU  28  12.019   5.242   1.718
  273   1HD2  LEU  28          HD21      LEU  28   8.074   5.771   0.641
  274   2HD2  LEU  28          HD22      LEU  28   9.172   6.914   1.410
  275   3HD2  LEU  28          HD23      LEU  28   8.393   5.659   2.371
  276    H    LYS  29           HN       LYS  29  11.174   2.681   1.822
  277    HA   LYS  29           HA       LYS  29  13.641   4.000   2.218
  278   1HB   LYS  29          HB2       LYS  29  13.556   3.239   4.477
  279   2HB   LYS  29          HB1       LYS  29  11.914   3.657   4.015
  280   1HG   LYS  29          HG2       LYS  29  11.183   1.516   4.137
  281   2HG   LYS  29          HG1       LYS  29  12.739   0.834   3.663
  282   1HD   LYS  29          HD2       LYS  29  13.159   2.127   6.126
  283   2HD   LYS  29          HD1       LYS  29  11.654   1.220   6.289
  284   1HE   LYS  29          HE2       LYS  29  13.648  -0.087   6.941
  285   2HE   LYS  29          HE1       LYS  29  12.750  -0.814   5.609
  286   1HZ   LYS  29          HZ1       LYS  29  14.648  -0.846   4.491
  287   2HZ   LYS  29          HZ2       LYS  29  15.450   0.045   5.683
  288   3HZ   LYS  29          HZ3       LYS  29  14.623   0.845   4.444
  289    H    ARG  30           HN       ARG  30  12.687   1.008   1.035
  290    HA   ARG  30           HA       ARG  30  15.174  -0.340   1.560
  291   1HB   ARG  30          HB2       ARG  30  14.081  -2.204   0.823
  292   2HB   ARG  30          HB1       ARG  30  12.660  -1.252   1.094
  293   1HG   ARG  30          HG2       ARG  30  12.141  -1.280  -1.059
  294   2HG   ARG  30          HG1       ARG  30  13.757  -0.834  -1.543
  295   1HD   ARG  30          HD2       ARG  30  13.116  -3.007  -2.453
  296   2HD   ARG  30          HD1       ARG  30  14.470  -3.157  -1.333
  297    HE   ARG  30           HE       ARG  30  12.512  -3.690   0.318
  298   1HH1  ARG  30          1HH1      ARG  30  12.852  -4.761  -2.991
  299   2HH1  ARG  30          2HH1      ARG  30  11.937  -6.208  -2.742
  300   1HH2  ARG  30          1HH2      ARG  30  11.312  -5.591   0.638
  301   2HH2  ARG  30          2HH2      ARG  30  11.063  -6.681  -0.685
  302    H    TRP  31           HN       TRP  31  13.466   1.445  -0.807
  303    HA   TRP  31           HA       TRP  31  15.133   1.151  -3.014
  304   1HB   TRP  31          HB2       TRP  31  12.706   2.342  -2.312
  305   2HB   TRP  31          HB1       TRP  31  13.698   3.602  -2.926
  306    HD1  TRP  31           HD1      TRP  31  11.903   0.608  -3.938
  307    HE1  TRP  31           HE1      TRP  31  12.063   0.331  -6.485
  308    HE3  TRP  31           HE3      TRP  31  15.256   4.044  -4.630
  309    HZ2  TRP  31           HZ2      TRP  31  13.551   1.547  -8.570
  310    HZ3  TRP  31           HZ3      TRP  31  16.127   4.559  -6.933
  311    HH2  TRP  31           HH2      TRP  31  15.275   3.308  -8.874
  312    H    ARG  32           HN       ARG  32  14.776   3.490  -0.321
  313    HA   ARG  32           HA       ARG  32  16.762   5.331  -1.054
  314   1HB   ARG  32          HB2       ARG  32  15.813   4.231   1.556
  315   2HB   ARG  32          HB1       ARG  32  16.837   5.667   1.434
  316   1HG   ARG  32          HG2       ARG  32  15.089   6.792   0.171
  317   2HG   ARG  32          HG1       ARG  32  14.079   5.364   0.267
  318   1HD   ARG  32          HD2       ARG  32  13.493   5.741   2.379
  319   2HD   ARG  32          HD1       ARG  32  15.088   6.314   2.838
  320    HE   ARG  32           HE       ARG  32  12.868   7.909   1.856
  321   1HH1  ARG  32          1HH1      ARG  32  16.272   7.780   2.636
  322   2HH1  ARG  32          2HH1      ARG  32  16.427   9.498   2.783
  323   1HH2  ARG  32          1HH2      ARG  32  13.079  10.166   2.048
  324   2HH2  ARG  32          2HH2      ARG  32  14.618  10.852   2.448
  325    H    LEU  33           HN       LEU  33  16.745   2.476   0.888
  326    HA   LEU  33           HA       LEU  33  19.375   2.228   1.677
  327   1HB   LEU  33          HB2       LEU  33  16.923   0.592   1.351
  328   2HB   LEU  33          HB1       LEU  33  18.385  -0.218   1.744
  329    HG   LEU  33           HG       LEU  33  16.591   0.890   3.460
  330   1HD1  LEU  33          HD11      LEU  33  18.614  -0.825   3.698
  331   2HD1  LEU  33          HD12      LEU  33  17.847  -0.074   5.098
  332   3HD1  LEU  33          HD13      LEU  33  19.358   0.579   4.463
  333   1HD2  LEU  33          HD21      LEU  33  17.486   2.800   4.467
  334   2HD2  LEU  33          HD22      LEU  33  17.576   3.084   2.725
  335   3HD2  LEU  33          HD23      LEU  33  19.022   2.615   3.617
  336    H    PHE  34           HN       PHE  34  17.535   1.046  -0.948
  337    HA   PHE  34           HA       PHE  34  19.618  -0.555  -2.097
  338   1HB   PHE  34          HB2       PHE  34  16.829  -0.025  -2.581
  339   2HB   PHE  34          HB1       PHE  34  17.742  -0.260  -4.044
  340    HD1  PHE  34           HD1      PHE  34  18.376  -1.620  -0.773
  341    HD2  PHE  34           HD2      PHE  34  17.028  -2.387  -4.705
  342    HE1  PHE  34           HE1      PHE  34  18.438  -4.024  -0.311
  343    HE2  PHE  34           HE2      PHE  34  17.069  -4.791  -4.273
  344    HZ   PHE  34           HZ       PHE  34  17.777  -5.643  -2.061
  345    H    SER  35           HN       SER  35  18.594   2.592  -2.109
  346    HA   SER  35           HA       SER  35  20.057   3.237  -4.608
  347   1HB   SER  35          HB2       SER  35  17.732   4.387  -3.493
  348   2HB   SER  35          HB1       SER  35  19.001   5.594  -3.345
  349    HG   SER  35           HG       SER  35  17.915   5.706  -5.358
  350    H    LYS  36           HN       LYS  36  20.350   3.462  -1.157
  351    HA   LYS  36           HA       LYS  36  22.521   5.385  -1.366
  352   1HB   LYS  36          HB2       LYS  36  22.342   5.684   0.903
  353   2HB   LYS  36          HB1       LYS  36  20.707   5.210   0.496
  354   1HG   LYS  36          HG2       LYS  36  21.127   3.992   2.395
  355   2HG   LYS  36          HG1       LYS  36  21.479   2.832   1.116
  356   1HD   LYS  36          HD2       LYS  36  23.857   4.284   1.642
  357   2HD   LYS  36          HD1       LYS  36  23.183   3.775   3.193
  358   1HE   LYS  36          HE2       LYS  36  23.485   1.573   2.756
  359   2HE   LYS  36          HE1       LYS  36  23.197   1.771   1.028
  360   1HZ   LYS  36          HZ1       LYS  36  25.687   2.433   2.508
  361   2HZ   LYS  36          HZ2       LYS  36  25.424   2.811   0.881
  362   3HZ   LYS  36          HZ3       LYS  36  25.478   1.194   1.375
  363    H    HIS  37           HN       HIS  37  22.034   2.060  -1.368
  364    HA   HIS  37           HA       HIS  37  24.603   1.260  -0.384
  365   1HB   HIS  37          HB2       HIS  37  22.150  -0.023  -1.223
  366   2HB   HIS  37          HB1       HIS  37  23.544  -0.823  -1.919
  367    HD1  HIS  37           HD1      HIS  37  24.785  -2.406  -0.435
  368    HD2  HIS  37           HD2      HIS  37  22.262   0.124   1.687
  369    HE1  HIS  37           HE1      HIS  37  24.842  -3.238   1.938
  370    HE2  HIS  37           HE2      HIS  37  23.287  -1.708   3.202
  371    H    GLU  38           HN       GLU  38  23.072   1.344  -3.589
  372    HA   GLU  38           HA       GLU  38  25.765   1.370  -4.777
  373   1HB   GLU  38          HB2       GLU  38  24.825   0.227  -6.735
  374   2HB   GLU  38          HB1       GLU  38  24.623  -0.730  -5.274
  375   1HG   GLU  38          HG2       GLU  38  22.357  -0.497  -5.264
  376   2HG   GLU  38          HG1       GLU  38  22.401   1.063  -6.085
  Start of MODEL   17
    1   1H    VAL   1          HT1       VAL   1 -27.763  -6.924   3.806
    2   2H    VAL   1          HT2       VAL   1 -26.876  -5.890   2.763
    3   3H    VAL   1          HT3       VAL   1 -28.561  -6.110   2.527
    4    HA   VAL   1           HA       VAL   1 -29.136  -4.855   4.283
    5    HB   VAL   1           HB       VAL   1 -27.538  -4.210   6.076
    6   1HG1  VAL   1          HG11      VAL   1 -27.247  -6.976   6.531
    7   2HG1  VAL   1          HG12      VAL   1 -28.741  -6.761   5.619
    8   3HG1  VAL   1          HG13      VAL   1 -28.505  -5.899   7.139
    9   1HG2  VAL   1          HG21      VAL   1 -25.706  -5.858   4.405
   10   2HG2  VAL   1          HG22      VAL   1 -25.507  -5.884   6.157
   11   3HG2  VAL   1          HG23      VAL   1 -25.395  -4.359   5.280
   12    H    MET   2           HN       MET   2 -28.521  -2.544   4.925
   13    HA   MET   2           HA       MET   2 -27.870  -1.113   2.609
   14   1HB   MET   2          HB2       MET   2 -28.621  -0.537   5.386
   15   2HB   MET   2          HB1       MET   2 -27.621   0.687   4.643
   16   1HG   MET   2          HG2       MET   2 -30.143  -0.378   3.428
   17   2HG   MET   2          HG1       MET   2 -30.071   1.064   4.440
   18   1HE   MET   2          HE1       MET   2 -27.850   3.288   3.129
   19   2HE   MET   2          HE2       MET   2 -29.352   3.057   4.025
   20   3HE   MET   2          HE3       MET   2 -29.385   3.799   2.426
   21    HA   PRO   3           HA       PRO   3 -23.609  -0.290   4.519
   22   1HB   PRO   3          HB2       PRO   3 -23.092  -0.679   7.066
   23   2HB   PRO   3          HB1       PRO   3 -24.354   0.479   6.656
   24   1HG   PRO   3          HG2       PRO   3 -24.649  -2.404   7.424
   25   2HG   PRO   3          HG1       PRO   3 -25.454  -0.987   8.140
   26   1HD   PRO   3          HD2       PRO   3 -26.568  -2.539   6.149
   27   2HD   PRO   3          HD1       PRO   3 -26.973  -0.831   6.415
   28    H    LYS   4           HN       LYS   4 -21.911  -1.947   6.274
   29    HA   LYS   4           HA       LYS   4 -20.750  -3.882   6.330
   30   1HB   LYS   4          HB2       LYS   4 -22.995  -4.891   6.730
   31   2HB   LYS   4          HB1       LYS   4 -23.148  -5.139   4.998
   32   1HG   LYS   4          HG2       LYS   4 -20.901  -6.415   5.239
   33   2HG   LYS   4          HG1       LYS   4 -21.340  -6.494   6.947
   34   1HD   LYS   4          HD2       LYS   4 -23.652  -7.202   5.519
   35   2HD   LYS   4          HD1       LYS   4 -22.319  -8.054   4.736
   36   1HE   LYS   4          HE2       LYS   4 -21.697  -8.502   7.309
   37   2HE   LYS   4          HE1       LYS   4 -23.449  -8.369   7.449
   38   1HZ   LYS   4          HZ1       LYS   4 -23.763 -10.157   5.988
   39   2HZ   LYS   4          HZ2       LYS   4 -22.518 -10.659   7.017
   40   3HZ   LYS   4          HZ3       LYS   4 -22.158 -10.130   5.451
   41    H    GLN   5           HN       GLN   5 -22.213  -2.909   3.308
   42    HA   GLN   5           HA       GLN   5 -20.193  -4.363   1.817
   43   1HB   GLN   5          HB2       GLN   5 -21.788  -4.493   0.249
   44   2HB   GLN   5          HB1       GLN   5 -22.866  -3.651   1.346
   45   1HG   GLN   5          HG2       GLN   5 -23.066  -2.146  -0.287
   46   2HG   GLN   5          HG1       GLN   5 -21.512  -1.606   0.224
   47   1HE2  GLN   5          HE21      GLN   5 -22.890  -4.000  -1.890
   48   2HE2  GLN   5          HE22      GLN   5 -21.711  -3.784  -3.106
   49    H    ILE   6           HN       ILE   6 -21.040  -1.241   2.916
   50    HA   ILE   6           HA       ILE   6 -19.071   0.104   1.312
   51    HB   ILE   6           HB       ILE   6 -19.738   2.049   2.879
   52   1HG1  ILE   6          HG12      ILE   6 -22.015   1.978   3.709
   53   2HG1  ILE   6          HG11      ILE   6 -22.199   0.319   3.198
   54   1HG2  ILE   6          HG21      ILE   6 -21.631   0.961   0.832
   55   2HG2  ILE   6          HG22      ILE   6 -20.159   1.876   0.499
   56   3HG2  ILE   6          HG23      ILE   6 -21.507   2.647   1.342
   57   1HD1  ILE   6          HD11      ILE   6 -21.050  -0.474   4.985
   58   2HD1  ILE   6          HD12      ILE   6 -21.591   1.046   5.691
   59   3HD1  ILE   6          HD13      ILE   6 -19.960   0.911   5.034
   60    H    VAL   7           HN       VAL   7 -19.513  -1.321   4.420
   61    HA   VAL   7           HA       VAL   7 -17.311  -0.074   5.752
   62    HB   VAL   7           HB       VAL   7 -19.498  -1.284   6.685
   63   1HG1  VAL   7          HG11      VAL   7 -19.047  -3.511   7.518
   64   2HG1  VAL   7          HG12      VAL   7 -17.461  -3.503   6.749
   65   3HG1  VAL   7          HG13      VAL   7 -18.922  -3.476   5.760
   66   1HG2  VAL   7          HG21      VAL   7 -17.765  -0.026   7.911
   67   2HG2  VAL   7          HG22      VAL   7 -16.863  -1.530   8.085
   68   3HG2  VAL   7          HG23      VAL   7 -18.459  -1.370   8.816
   69    H    TYR   8           HN       TYR   8 -18.084  -2.996   4.063
   70    HA   TYR   8           HA       TYR   8 -15.694  -4.474   4.334
   71   1HB   TYR   8          HB2       TYR   8 -18.121  -4.740   2.960
   72   2HB   TYR   8          HB1       TYR   8 -16.890  -4.698   1.704
   73    HD1  TYR   8           HD1      TYR   8 -16.753  -6.009   5.153
   74    HD2  TYR   8           HD2      TYR   8 -16.594  -6.900   1.015
   75    HE1  TYR   8           HE1      TYR   8 -16.090  -8.213   5.677
   76    HE2  TYR   8           HE2      TYR   8 -15.944  -9.162   1.525
   77    HH   TYR   8           HH       TYR   8 -16.012 -10.765   3.337
   78    H    TRP   9           HN       TRP   9 -16.964  -2.212   1.953
   79    HA   TRP   9           HA       TRP   9 -14.769  -2.004   0.218
   80   1HB   TRP   9          HB2       TRP   9 -17.188  -0.455   0.893
   81   2HB   TRP   9          HB1       TRP   9 -15.846   0.533   0.315
   82    HD1  TRP   9           HD1      TRP   9 -18.633  -1.419  -0.913
   83    HE1  TRP   9           HE1      TRP   9 -18.328  -1.778  -3.473
   84    HE3  TRP   9           HE3      TRP   9 -13.901  -0.005  -1.304
   85    HZ2  TRP   9           HZ2      TRP   9 -16.317  -1.480  -5.385
   86    HZ3  TRP   9           HZ3      TRP   9 -12.784  -0.031  -3.510
   87    HH2  TRP   9           HH2      TRP   9 -14.004  -0.770  -5.509
   88    H    LYS  10           HN       LYS  10 -15.901   0.167   2.621
   89    HA   LYS  10           HA       LYS  10 -13.788   1.878   2.934
   90   1HB   LYS  10          HB2       LYS  10 -15.871   2.336   4.003
   91   2HB   LYS  10          HB1       LYS  10 -15.795   0.845   4.929
   92   1HG   LYS  10          HG2       LYS  10 -13.497   2.214   5.626
   93   2HG   LYS  10          HG1       LYS  10 -14.744   3.453   5.536
   94   1HD   LYS  10          HD2       LYS  10 -15.714   2.736   7.419
   95   2HD   LYS  10          HD1       LYS  10 -15.679   1.056   6.878
   96   1HE   LYS  10          HE2       LYS  10 -13.117   1.282   7.440
   97   2HE   LYS  10          HE1       LYS  10 -13.687   2.583   8.484
   98   1HZ   LYS  10          HZ1       LYS  10 -14.258  -0.300   8.636
   99   2HZ   LYS  10          HZ2       LYS  10 -15.354   0.808   9.293
  100   3HZ   LYS  10          HZ3       LYS  10 -13.762   0.757   9.860
  101    H    GLN  11           HN       GLN  11 -14.382  -1.093   4.804
  102    HA   GLN  11           HA       GLN  11 -11.886  -0.891   6.170
  103   1HB   GLN  11          HB2       GLN  11 -12.416  -2.895   7.241
  104   2HB   GLN  11          HB1       GLN  11 -13.970  -2.138   6.989
  105   1HG   GLN  11          HG2       GLN  11 -14.632  -3.689   5.447
  106   2HG   GLN  11          HG1       GLN  11 -12.990  -4.066   4.944
  107   1HE2  GLN  11          HE21      GLN  11 -12.631  -4.205   8.173
  108   2HE2  GLN  11          HE22      GLN  11 -13.069  -5.849   8.452
  109    H    TRP  12           HN       TRP  12 -12.362  -1.385   3.083
  110    HA   TRP  12           HA       TRP  12 -10.111  -3.256   2.767
  111   1HB   TRP  12          HB2       TRP  12 -12.385  -3.778   1.704
  112   2HB   TRP  12          HB1       TRP  12 -12.069  -2.489   0.607
  113    HD1  TRP  12           HD1      TRP  12 -11.364  -6.022   1.150
  114    HE1  TRP  12           HE1      TRP  12  -9.658  -6.836  -0.577
  115    HE3  TRP  12           HE3      TRP  12 -10.089  -1.587  -0.609
  116    HZ2  TRP  12           HZ2      TRP  12  -7.967  -5.674  -2.516
  117    HZ3  TRP  12           HZ3      TRP  12  -8.399  -1.399  -2.445
  118    HH2  TRP  12           HH2      TRP  12  -7.352  -3.455  -3.380
  119    H    LEU  13           HN       LEU  13 -11.419  -0.084   1.795
  120    HA   LEU  13           HA       LEU  13  -8.874   0.475   0.463
  121   1HB   LEU  13          HB2       LEU  13 -10.881   1.012  -0.816
  122   2HB   LEU  13          HB1       LEU  13 -11.472   2.022   0.491
  123    HG   LEU  13           HG       LEU  13  -8.824   2.833  -0.400
  124   1HD1  LEU  13          HD11      LEU  13  -9.056   3.035  -2.600
  125   2HD1  LEU  13          HD12      LEU  13 -10.680   3.705  -2.441
  126   3HD1  LEU  13          HD13      LEU  13 -10.445   1.957  -2.472
  127   1HD2  LEU  13          HD21      LEU  13 -11.363   3.991   0.454
  128   2HD2  LEU  13          HD22      LEU  13 -10.557   4.915  -0.813
  129   3HD2  LEU  13          HD23      LEU  13  -9.713   4.565   0.695
  130    H    SER  14           HN       SER  14 -10.270   0.786   3.474
  131    HA   SER  14           HA       SER  14  -9.011   3.326   4.072
  132   1HB   SER  14          HB2       SER  14 -11.223   2.115   5.151
  133   2HB   SER  14          HB1       SER  14  -9.990   1.726   6.341
  134    HG   SER  14           HG       SER  14  -9.902   3.755   6.918
  135    H    LEU  15           HN       LEU  15  -8.716  -0.069   4.897
  136    HA   LEU  15           HA       LEU  15  -6.280   0.348   6.334
  137   1HB   LEU  15          HB2       LEU  15  -7.623  -2.218   5.509
  138   2HB   LEU  15          HB1       LEU  15  -6.365  -2.026   6.711
  139    HG   LEU  15           HG       LEU  15  -8.234  -2.194   8.043
  140   1HD1  LEU  15          HD11      LEU  15  -7.056  -0.070   8.525
  141   2HD1  LEU  15          HD12      LEU  15  -8.778   0.000   8.909
  142   3HD1  LEU  15          HD13      LEU  15  -8.171   0.754   7.433
  143   1HD2  LEU  15          HD21      LEU  15 -10.167  -0.475   6.963
  144   2HD2  LEU  15          HD22      LEU  15 -10.192  -2.240   7.021
  145   3HD2  LEU  15          HD23      LEU  15  -9.501  -1.409   5.618
  146    H    ARG  16           HN       ARG  16  -7.201  -1.590   3.526
  147    HA   ARG  16           HA       ARG  16  -4.706  -2.334   2.676
  148   1HB   ARG  16          HB2       ARG  16  -7.184  -1.704   1.166
  149   2HB   ARG  16          HB1       ARG  16  -5.728  -2.093   0.291
  150   1HG   ARG  16          HG2       ARG  16  -7.210  -3.823   2.245
  151   2HG   ARG  16          HG1       ARG  16  -7.014  -4.082   0.511
  152   1HD   ARG  16          HD2       ARG  16  -4.487  -4.106   1.036
  153   2HD   ARG  16          HD1       ARG  16  -4.996  -4.362   2.706
  154    HE   ARG  16           HE       ARG  16  -6.341  -6.296   1.514
  155   1HH1  ARG  16          1HH1      ARG  16  -3.028  -5.298   1.020
  156   2HH1  ARG  16          2HH1      ARG  16  -2.498  -6.874   0.540
  157   1HH2  ARG  16          1HH2      ARG  16  -5.637  -8.367   0.891
  158   2HH2  ARG  16          2HH2      ARG  16  -3.976  -8.615   0.467
  159    H    ASN  17           HN       ASN  17  -6.147   0.755   2.504
  160    HA   ASN  17           HA       ASN  17  -4.586   1.973   0.555
  161   1HB   ASN  17          HB2       ASN  17  -6.507   2.723   2.551
  162   2HB   ASN  17          HB1       ASN  17  -5.274   3.917   2.410
  163   1HD2  ASN  17          HD21      ASN  17  -7.331   5.041   1.745
  164   2HD2  ASN  17          HD22      ASN  17  -7.661   5.057   0.058
  165    HA   PRO  18           HA       PRO  18  -1.681   3.927   3.800
  166   1HB   PRO  18          HB2       PRO  18  -1.983   3.002   6.389
  167   2HB   PRO  18          HB1       PRO  18  -2.533   4.565   5.783
  168   1HG   PRO  18          HG2       PRO  18  -4.038   2.012   6.048
  169   2HG   PRO  18          HG1       PRO  18  -4.559   3.665   6.425
  170   1HD   PRO  18          HD2       PRO  18  -5.348   2.525   4.182
  171   2HD   PRO  18          HD1       PRO  18  -4.821   4.214   4.172
  172    H    ILE  19           HN       ILE  19  -2.807   0.730   3.910
  173    HA   ILE  19           HA       ILE  19  -0.412  -0.416   4.960
  174    HB   ILE  19           HB       ILE  19  -2.736  -1.714   3.574
  175   1HG1  ILE  19          HG12      ILE  19  -1.945  -1.353   6.459
  176   2HG1  ILE  19          HG11      ILE  19  -3.372  -0.724   5.670
  177   1HG2  ILE  19          HG21      ILE  19  -0.400  -2.967   5.015
  178   2HG2  ILE  19          HG22      ILE  19  -0.774  -3.106   3.297
  179   3HG2  ILE  19          HG23      ILE  19  -1.847  -3.831   4.494
  180   1HD1  ILE  19          HD11      ILE  19  -3.218  -3.026   7.162
  181   2HD1  ILE  19          HD12      ILE  19  -3.223  -3.611   5.497
  182   3HD1  ILE  19          HD13      ILE  19  -4.527  -2.573   6.070
  183    H    LEU  20           HN       LEU  20  -1.615   0.204   1.764
  184    HA   LEU  20           HA       LEU  20   0.389  -1.320   0.413
  185   1HB   LEU  20          HB2       LEU  20  -0.369  -0.364  -1.606
  186   2HB   LEU  20          HB1       LEU  20  -1.792  -0.646  -0.628
  187    HG   LEU  20           HG       LEU  20  -0.885   2.012  -0.149
  188   1HD1  LEU  20          HD11      LEU  20  -0.676   2.994  -2.196
  189   2HD1  LEU  20          HD12      LEU  20  -1.624   1.749  -3.009
  190   3HD1  LEU  20          HD13      LEU  20   0.050   1.428  -2.557
  191   1HD2  LEU  20          HD21      LEU  20  -3.140   0.952   0.070
  192   2HD2  LEU  20          HD22      LEU  20  -3.294   1.113  -1.681
  193   3HD2  LEU  20          HD23      LEU  20  -3.106   2.551  -0.674
  194    H    VAL  21           HN       VAL  21  -0.115   1.913   1.510
  195    HA   VAL  21           HA       VAL  21   2.076   3.252   0.499
  196    HB   VAL  21           HB       VAL  21   0.428   3.340   2.954
  197   1HG1  VAL  21          HG11      VAL  21   2.654   5.271   2.486
  198   2HG1  VAL  21          HG12      VAL  21   2.827   3.807   3.460
  199   3HG1  VAL  21          HG13      VAL  21   1.666   5.054   3.935
  200   1HG2  VAL  21          HG21      VAL  21  -0.476   4.224   0.890
  201   2HG2  VAL  21          HG22      VAL  21   0.899   5.326   0.739
  202   3HG2  VAL  21          HG23      VAL  21  -0.245   5.516   2.072
  203    H    PHE  22           HN       PHE  22   1.492   1.538   3.507
  204    HA   PHE  22           HA       PHE  22   3.947   1.683   4.754
  205   1HB   PHE  22          HB2       PHE  22   2.490   0.749   6.172
  206   2HB   PHE  22          HB1       PHE  22   1.506   0.123   4.870
  207    HD1  PHE  22           HD1      PHE  22   1.332  -2.023   4.595
  208    HD2  PHE  22           HD2      PHE  22   4.758  -0.424   6.426
  209    HE1  PHE  22           HE1      PHE  22   2.169  -4.311   4.954
  210    HE2  PHE  22           HE2      PHE  22   5.638  -2.681   6.823
  211    HZ   PHE  22           HZ       PHE  22   4.342  -4.648   6.068
  212    H    LEU  23           HN       LEU  23   2.787  -0.250   2.126
  213    HA   LEU  23           HA       LEU  23   5.187  -1.992   2.178
  214   1HB   LEU  23          HB2       LEU  23   2.947  -1.743   0.185
  215   2HB   LEU  23          HB1       LEU  23   4.341  -2.773  -0.079
  216    HG   LEU  23           HG       LEU  23   3.482  -3.616   2.378
  217   1HD1  LEU  23          HD11      LEU  23   1.482  -2.010   1.480
  218   2HD1  LEU  23          HD12      LEU  23   1.295  -3.309   2.670
  219   3HD1  LEU  23          HD13      LEU  23   0.932  -3.611   0.967
  220   1HD2  LEU  23          HD21      LEU  23   3.636  -4.598  -0.290
  221   2HD2  LEU  23          HD22      LEU  23   2.103  -5.126   0.403
  222   3HD2  LEU  23          HD23      LEU  23   3.619  -5.512   1.218
  223    H    LYS  24           HN       LYS  24   3.946   0.739   0.546
  224    HA   LYS  24           HA       LYS  24   5.791   0.931  -1.551
  225   1HB   LYS  24          HB2       LYS  24   3.566   2.337  -0.476
  226   2HB   LYS  24          HB1       LYS  24   4.821   3.490  -0.801
  227   1HG   LYS  24          HG2       LYS  24   4.118   3.457  -2.912
  228   2HG   LYS  24          HG1       LYS  24   4.769   1.819  -3.000
  229   1HD   LYS  24          HD2       LYS  24   2.461   1.257  -1.825
  230   2HD   LYS  24          HD1       LYS  24   1.968   2.724  -2.681
  231   1HE   LYS  24          HE2       LYS  24   1.541   1.227  -4.334
  232   2HE   LYS  24          HE1       LYS  24   3.249   1.497  -4.674
  233   1HZ   LYS  24          HZ1       LYS  24   3.787  -0.568  -4.032
  234   2HZ   LYS  24          HZ2       LYS  24   2.154  -0.913  -4.306
  235   3HZ   LYS  24          HZ3       LYS  24   2.697  -0.584  -2.738
  236    H    THR  25           HN       THR  25   5.635   2.260   1.649
  237    HA   THR  25           HA       THR  25   7.976   3.807   1.514
  238    HB   THR  25           HB       THR  25   6.345   4.419   3.130
  239    HG1  THR  25           HG1      THR  25   8.260   3.142   4.750
  240   1HG2  THR  25          HG21      THR  25   5.481   1.981   3.297
  241   2HG2  THR  25          HG22      THR  25   5.321   3.073   4.676
  242   3HG2  THR  25          HG23      THR  25   6.613   1.874   4.648
  243    H    ARG  26           HN       ARG  26   7.189   0.579   2.776
  244    HA   ARG  26           HA       ARG  26   9.697  -0.016   3.880
  245   1HB   ARG  26          HB2       ARG  26   7.559  -1.695   2.594
  246   2HB   ARG  26          HB1       ARG  26   9.007  -2.420   3.279
  247   1HG   ARG  26          HG2       ARG  26   6.781  -0.996   4.676
  248   2HG   ARG  26          HG1       ARG  26   7.408  -2.609   4.957
  249   1HD   ARG  26          HD2       ARG  26   9.567  -1.474   5.660
  250   2HD   ARG  26          HD1       ARG  26   8.641   0.026   5.672
  251    HE   ARG  26           HE       ARG  26   8.184  -2.290   7.433
  252   1HH1  ARG  26          1HH1      ARG  26   7.721   1.099   6.698
  253   2HH1  ARG  26          2HH1      ARG  26   7.002   1.454   8.230
  254   1HH2  ARG  26          1HH2      ARG  26   7.233  -1.816   9.439
  255   2HH2  ARG  26          2HH2      ARG  26   6.723  -0.197   9.785
  256    H    VAL  27           HN       VAL  27   8.400  -0.305   0.667
  257    HA   VAL  27           HA       VAL  27  10.680  -1.487  -0.574
  258    HB   VAL  27           HB       VAL  27   8.017  -0.445  -1.325
  259   1HG1  VAL  27          HG11      VAL  27  10.302  -0.607  -3.241
  260   2HG1  VAL  27          HG12      VAL  27   9.173   0.716  -2.959
  261   3HG1  VAL  27          HG13      VAL  27   8.622  -0.756  -3.759
  262   1HG2  VAL  27          HG21      VAL  27   7.660  -2.583  -2.165
  263   2HG2  VAL  27          HG22      VAL  27   8.691  -2.854  -0.760
  264   3HG2  VAL  27          HG23      VAL  27   9.384  -2.890  -2.382
  265    H    LEU  28           HN       LEU  28   9.655   1.670   0.272
  266    HA   LEU  28           HA       LEU  28  11.167   3.106  -1.649
  267   1HB   LEU  28          HB2       LEU  28   9.840   4.797  -1.028
  268   2HB   LEU  28          HB1       LEU  28   8.943   3.614  -0.147
  269    HG   LEU  28           HG       LEU  28  10.148   4.151   1.882
  270   1HD1  LEU  28          HD11      LEU  28  11.360   6.607   1.346
  271   2HD1  LEU  28          HD12      LEU  28  11.916   5.528   0.066
  272   3HD1  LEU  28          HD13      LEU  28  12.158   5.089   1.758
  273   1HD2  LEU  28          HD21      LEU  28   8.424   5.531   2.159
  274   2HD2  LEU  28          HD22      LEU  28   8.407   5.948   0.445
  275   3HD2  LEU  28          HD23      LEU  28   9.451   6.832   1.557
  276    H    LYS  29           HN       LYS  29  11.173   2.556   1.782
  277    HA   LYS  29           HA       LYS  29  13.642   3.828   2.266
  278   1HB   LYS  29          HB2       LYS  29  13.521   3.015   4.500
  279   2HB   LYS  29          HB1       LYS  29  11.881   3.410   4.019
  280   1HG   LYS  29          HG2       LYS  29  11.643   1.406   5.136
  281   2HG   LYS  29          HG1       LYS  29  11.676   0.906   3.449
  282   1HD   LYS  29          HD2       LYS  29  13.340  -0.482   3.975
  283   2HD   LYS  29          HD1       LYS  29  14.352   0.932   4.267
  284   1HE   LYS  29          HE2       LYS  29  13.444   0.976   6.606
  285   2HE   LYS  29          HE1       LYS  29  12.683  -0.578   6.267
  286   1HZ   LYS  29          HZ1       LYS  29  15.409  -0.670   5.537
  287   2HZ   LYS  29          HZ2       LYS  29  14.587  -1.598   6.687
  288   3HZ   LYS  29          HZ3       LYS  29  15.277  -0.119   7.131
  289    H    ARG  30           HN       ARG  30  12.698   0.802   1.115
  290    HA   ARG  30           HA       ARG  30  15.183  -0.533   1.554
  291   1HB   ARG  30          HB2       ARG  30  12.575  -1.099   0.275
  292   2HB   ARG  30          HB1       ARG  30  13.928  -2.077  -0.220
  293   1HG   ARG  30          HG2       ARG  30  13.796  -1.824   2.633
  294   2HG   ARG  30          HG1       ARG  30  12.274  -2.409   1.980
  295   1HD   ARG  30          HD2       ARG  30  14.437  -3.767   0.689
  296   2HD   ARG  30          HD1       ARG  30  14.647  -3.871   2.437
  297    HE   ARG  30           HE       ARG  30  12.040  -4.518   2.074
  298   1HH1  ARG  30          1HH1      ARG  30  15.024  -5.702   0.707
  299   2HH1  ARG  30          2HH1      ARG  30  14.422  -7.308   0.468
  300   1HH2  ARG  30          1HH2      ARG  30  11.248  -6.629   1.766
  301   2HH2  ARG  30          2HH2      ARG  30  12.278  -7.835   1.071
  302    H    TRP  31           HN       TRP  31  13.527   1.323  -0.826
  303    HA   TRP  31           HA       TRP  31  15.220   0.885  -3.019
  304   1HB   TRP  31          HB2       TRP  31  12.781   2.141  -2.392
  305   2HB   TRP  31          HB1       TRP  31  13.805   3.336  -3.080
  306    HD1  TRP  31           HD1      TRP  31  11.994   0.287  -3.901
  307    HE1  TRP  31           HE1      TRP  31  12.140  -0.133  -6.429
  308    HE3  TRP  31           HE3      TRP  31  15.330   3.688  -4.798
  309    HZ2  TRP  31           HZ2      TRP  31  13.612   0.972  -8.587
  310    HZ3  TRP  31           HZ3      TRP  31  16.189   4.078  -7.132
  311    HH2  TRP  31           HH2      TRP  31  15.330   2.717  -8.996
  312    H    ARG  32           HN       ARG  32  14.780   3.225  -0.393
  313    HA   ARG  32           HA       ARG  32  16.730   5.123  -1.053
  314   1HB   ARG  32          HB2       ARG  32  15.725   3.993   1.529
  315   2HB   ARG  32          HB1       ARG  32  16.636   5.504   1.414
  316   1HG   ARG  32          HG2       ARG  32  14.050   5.082  -0.054
  317   2HG   ARG  32          HG1       ARG  32  14.102   5.662   1.590
  318   1HD   ARG  32          HD2       ARG  32  15.634   6.902  -0.643
  319   2HD   ARG  32          HD1       ARG  32  13.985   7.375  -0.264
  320    HE   ARG  32           HE       ARG  32  14.777   8.131   1.899
  321   1HH1  ARG  32          1HH1      ARG  32  17.247   7.505  -0.501
  322   2HH1  ARG  32          2HH1      ARG  32  18.417   8.521   0.268
  323   1HH2  ARG  32          1HH2      ARG  32  16.322   9.461   2.900
  324   2HH2  ARG  32          2HH2      ARG  32  17.895   9.628   2.195
  325    H    LEU  33           HN       LEU  33  16.706   2.239   0.848
  326    HA   LEU  33           HA       LEU  33  19.315   2.062   1.752
  327   1HB   LEU  33          HB2       LEU  33  16.924   0.364   1.325
  328   2HB   LEU  33          HB1       LEU  33  18.388  -0.408   1.770
  329    HG   LEU  33           HG       LEU  33  16.484   0.639   3.409
  330   1HD1  LEU  33          HD11      LEU  33  17.820  -1.100   4.225
  331   2HD1  LEU  33          HD12      LEU  33  18.258   0.283   5.227
  332   3HD1  LEU  33          HD13      LEU  33  19.312  -0.217   3.904
  333   1HD2  LEU  33          HD21      LEU  33  17.266   2.550   4.473
  334   2HD2  LEU  33          HD22      LEU  33  17.504   2.855   2.749
  335   3HD2  LEU  33          HD23      LEU  33  18.873   2.388   3.759
  336    H    PHE  34           HN       PHE  34  17.580   0.847  -0.930
  337    HA   PHE  34           HA       PHE  34  19.727  -0.713  -2.016
  338   1HB   PHE  34          HB2       PHE  34  16.938  -0.253  -2.558
  339   2HB   PHE  34          HB1       PHE  34  17.884  -0.484  -4.001
  340    HD1  PHE  34           HD1      PHE  34  18.516  -1.794  -0.710
  341    HD2  PHE  34           HD2      PHE  34  17.196  -2.633  -4.638
  342    HE1  PHE  34           HE1      PHE  34  18.617  -4.192  -0.218
  343    HE2  PHE  34           HE2      PHE  34  17.276  -5.031  -4.175
  344    HZ   PHE  34           HZ       PHE  34  17.991  -5.843  -1.951
  345    H    SER  35           HN       SER  35  18.665   2.413  -2.073
  346    HA   SER  35           HA       SER  35  20.133   3.047  -4.575
  347   1HB   SER  35          HB2       SER  35  17.760   4.138  -3.532
  348   2HB   SER  35          HB1       SER  35  18.981   5.391  -3.351
  349    HG   SER  35           HG       SER  35  17.898   4.281  -5.644
  350    H    LYS  36           HN       LYS  36  20.257   3.572  -1.112
  351    HA   LYS  36           HA       LYS  36  22.388   5.503  -1.360
  352   1HB   LYS  36          HB2       LYS  36  22.118   5.924   0.857
  353   2HB   LYS  36          HB1       LYS  36  20.553   5.215   0.513
  354   1HG   LYS  36          HG2       LYS  36  21.230   3.115   1.452
  355   2HG   LYS  36          HG1       LYS  36  22.884   3.695   1.655
  356   1HD   LYS  36          HD2       LYS  36  21.631   3.755   3.764
  357   2HD   LYS  36          HD1       LYS  36  22.124   5.369   3.248
  358   1HE   LYS  36          HE2       LYS  36  19.821   5.588   2.210
  359   2HE   LYS  36          HE1       LYS  36  19.392   4.119   3.084
  360   1HZ   LYS  36          HZ1       LYS  36  18.799   5.582   4.660
  361   2HZ   LYS  36          HZ2       LYS  36  19.801   6.813   4.075
  362   3HZ   LYS  36          HZ3       LYS  36  20.447   5.583   5.041
  363    H    HIS  37           HN       HIS  37  22.126   2.119  -1.039
  364    HA   HIS  37           HA       HIS  37  24.766   1.659  -0.049
  365   1HB   HIS  37          HB2       HIS  37  22.436   0.081  -0.676
  366   2HB   HIS  37          HB1       HIS  37  23.874  -0.661  -1.349
  367    HD1  HIS  37           HD1      HIS  37  24.958  -2.241   0.210
  368    HD2  HIS  37           HD2      HIS  37  22.980   0.810   2.220
  369    HE1  HIS  37           HE1      HIS  37  25.262  -2.741   2.656
  370    HE2  HIS  37           HE2      HIS  37  23.981  -0.932   3.853
  371    H    GLU  38           HN       GLU  38  23.223   1.283  -3.227
  372    HA   GLU  38           HA       GLU  38  25.727   1.928  -4.524
  373   1HB   GLU  38          HB2       GLU  38  25.743  -0.088  -5.927
  374   2HB   GLU  38          HB1       GLU  38  25.949  -0.477  -4.225
  375   1HG   GLU  38          HG2       GLU  38  23.298  -0.736  -4.396
  376   2HG   GLU  38          HG1       GLU  38  23.726  -1.109  -6.065
  Start of MODEL   18
    1   1H    VAL   1          HT1       VAL   1 -30.208   2.308   1.789
    2   2H    VAL   1          HT2       VAL   1 -29.006   2.397   3.010
    3   3H    VAL   1          HT3       VAL   1 -30.625   2.009   3.423
    4    HA   VAL   1           HA       VAL   1 -30.519  -0.045   2.418
    5    HB   VAL   1           HB       VAL   1 -28.419  -0.777   1.234
    6   1HG1  VAL   1          HG11      VAL   1 -30.513  -0.137   0.071
    7   2HG1  VAL   1          HG12      VAL   1 -29.060   0.172  -0.882
    8   3HG1  VAL   1          HG13      VAL   1 -29.887   1.506  -0.078
    9   1HG2  VAL   1          HG21      VAL   1 -27.844   2.176   1.386
   10   2HG2  VAL   1          HG22      VAL   1 -27.058   1.086   0.243
   11   3HG2  VAL   1          HG23      VAL   1 -26.845   0.848   1.977
   12    H    MET   2           HN       MET   2 -28.906  -1.920   2.939
   13    HA   MET   2           HA       MET   2 -28.230  -1.666   5.689
   14   1HB   MET   2          HB2       MET   2 -28.397  -3.799   3.653
   15   2HB   MET   2          HB1       MET   2 -27.263  -4.071   4.954
   16   1HG   MET   2          HG2       MET   2 -29.090  -3.664   6.574
   17   2HG   MET   2          HG1       MET   2 -30.200  -3.533   5.210
   18   1HE   MET   2          HE1       MET   2 -27.302  -5.450   6.406
   19   2HE   MET   2          HE2       MET   2 -27.437  -6.956   5.499
   20   3HE   MET   2          HE3       MET   2 -28.074  -6.855   7.140
   21    HA   PRO   3           HA       PRO   3 -23.877  -0.924   5.127
   22   1HB   PRO   3          HB2       PRO   3 -23.048  -1.228   7.604
   23   2HB   PRO   3          HB1       PRO   3 -24.410  -0.146   7.321
   24   1HG   PRO   3          HG2       PRO   3 -24.458  -3.020   8.171
   25   2HG   PRO   3          HG1       PRO   3 -25.250  -1.630   8.949
   26   1HD   PRO   3          HD2       PRO   3 -26.501  -3.288   7.133
   27   2HD   PRO   3          HD1       PRO   3 -26.966  -1.596   7.412
   28    H    LYS   4           HN       LYS   4 -21.895  -2.439   6.700
   29    HA   LYS   4           HA       LYS   4 -20.664  -4.339   6.694
   30   1HB   LYS   4          HB2       LYS   4 -23.051  -5.347   7.006
   31   2HB   LYS   4          HB1       LYS   4 -22.855  -5.858   5.336
   32   1HG   LYS   4          HG2       LYS   4 -21.256  -7.392   5.843
   33   2HG   LYS   4          HG1       LYS   4 -20.648  -6.468   7.218
   34   1HD   LYS   4          HD2       LYS   4 -23.193  -7.112   8.014
   35   2HD   LYS   4          HD1       LYS   4 -22.705  -8.544   7.108
   36   1HE   LYS   4          HE2       LYS   4 -20.506  -7.798   8.711
   37   2HE   LYS   4          HE1       LYS   4 -21.937  -7.722   9.738
   38   1HZ   LYS   4          HZ1       LYS   4 -20.654 -10.020   8.516
   39   2HZ   LYS   4          HZ2       LYS   4 -22.345 -10.033   8.486
   40   3HZ   LYS   4          HZ3       LYS   4 -21.528  -9.906   9.962
   41    H    GLN   5           HN       GLN   5 -22.309  -3.342   3.767
   42    HA   GLN   5           HA       GLN   5 -20.306  -4.683   2.147
   43   1HB   GLN   5          HB2       GLN   5 -22.020  -4.875   0.696
   44   2HB   GLN   5          HB1       GLN   5 -23.031  -3.967   1.801
   45   1HG   GLN   5          HG2       GLN   5 -23.221  -2.754  -0.107
   46   2HG   GLN   5          HG1       GLN   5 -21.945  -1.885   0.705
   47   1HE2  GLN   5          HE21      GLN   5 -19.937  -3.839   0.036
   48   2HE2  GLN   5          HE22      GLN   5 -19.688  -3.695  -1.647
   49    H    ILE   6           HN       ILE   6 -21.213  -1.612   3.357
   50    HA   ILE   6           HA       ILE   6 -19.365  -0.176   1.692
   51    HB   ILE   6           HB       ILE   6 -20.036   1.723   3.322
   52   1HG1  ILE   6          HG12      ILE   6 -22.282   1.556   4.220
   53   2HG1  ILE   6          HG11      ILE   6 -22.425  -0.097   3.681
   54   1HG2  ILE   6          HG21      ILE   6 -21.883   2.274   1.854
   55   2HG2  ILE   6          HG22      ILE   6 -21.948   0.594   1.315
   56   3HG2  ILE   6          HG23      ILE   6 -20.530   1.581   0.957
   57   1HD1  ILE   6          HD11      ILE   6 -21.241  -0.885   5.435
   58   2HD1  ILE   6          HD12      ILE   6 -21.737   0.638   6.169
   59   3HD1  ILE   6          HD13      ILE   6 -20.138   0.494   5.439
   60    H    VAL   7           HN       VAL   7 -19.626  -1.649   4.801
   61    HA   VAL   7           HA       VAL   7 -17.402  -0.352   6.042
   62    HB   VAL   7           HB       VAL   7 -19.479  -1.649   7.081
   63   1HG1  VAL   7          HG11      VAL   7 -18.940  -3.888   7.812
   64   2HG1  VAL   7          HG12      VAL   7 -17.390  -3.821   6.973
   65   3HG1  VAL   7          HG13      VAL   7 -18.894  -3.808   6.051
   66   1HG2  VAL   7          HG21      VAL   7 -18.259  -1.821   9.137
   67   2HG2  VAL   7          HG22      VAL   7 -17.755  -0.381   8.255
   68   3HG2  VAL   7          HG23      VAL   7 -16.729  -1.814   8.261
   69    H    TYR   8           HN       TYR   8 -18.142  -3.272   4.328
   70    HA   TYR   8           HA       TYR   8 -15.694  -4.668   4.463
   71   1HB   TYR   8          HB2       TYR   8 -18.158  -5.032   3.223
   72   2HB   TYR   8          HB1       TYR   8 -17.037  -4.836   1.880
   73    HD1  TYR   8           HD1      TYR   8 -16.619  -6.966   1.041
   74    HD2  TYR   8           HD2      TYR   8 -16.581  -6.328   5.227
   75    HE1  TYR   8           HE1      TYR   8 -15.780  -9.200   1.371
   76    HE2  TYR   8           HE2      TYR   8 -15.748  -8.507   5.575
   77    HH   TYR   8           HH       TYR   8 -15.618 -10.903   3.065
   78    H    TRP   9           HN       TRP   9 -17.125  -2.364   2.219
   79    HA   TRP   9           HA       TRP   9 -14.994  -2.075   0.399
   80   1HB   TRP   9          HB2       TRP   9 -17.451  -0.639   1.155
   81   2HB   TRP   9          HB1       TRP   9 -16.165   0.420   0.578
   82    HD1  TRP   9           HD1      TRP   9 -18.886  -1.626  -0.647
   83    HE1  TRP   9           HE1      TRP   9 -18.611  -1.912  -3.221
   84    HE3  TRP   9           HE3      TRP   9 -14.226   0.006  -1.087
   85    HZ2  TRP   9           HZ2      TRP   9 -16.647  -1.480  -5.159
   86    HZ3  TRP   9           HZ3      TRP   9 -13.150   0.081  -3.309
   87    HH2  TRP   9           HH2      TRP   9 -14.371  -0.665  -5.304
   88    H    LYS  10           HN       LYS  10 -16.136   0.002   2.873
   89    HA   LYS  10           HA       LYS  10 -14.089   1.802   3.150
   90   1HB   LYS  10          HB2       LYS  10 -16.144   2.168   4.287
   91   2HB   LYS  10          HB1       LYS  10 -16.011   0.650   5.161
   92   1HG   LYS  10          HG2       LYS  10 -13.750   2.013   5.904
   93   2HG   LYS  10          HG1       LYS  10 -14.981   3.270   5.814
   94   1HD   LYS  10          HD2       LYS  10 -16.243   2.341   7.497
   95   2HD   LYS  10          HD1       LYS  10 -15.644   0.709   7.182
   96   1HE   LYS  10          HE2       LYS  10 -13.369   2.018   7.944
   97   2HE   LYS  10          HE1       LYS  10 -14.592   2.799   8.945
   98   1HZ   LYS  10          HZ1       LYS  10 -14.768  -0.088   8.826
   99   2HZ   LYS  10          HZ2       LYS  10 -14.896   0.953  10.154
  100   3HZ   LYS  10          HZ3       LYS  10 -13.371   0.505   9.575
  101    H    GLN  11           HN       GLN  11 -14.442  -1.284   4.887
  102    HA   GLN  11           HA       GLN  11 -11.924  -0.936   6.220
  103   1HB   GLN  11          HB2       GLN  11 -12.346  -3.013   7.255
  104   2HB   GLN  11          HB1       GLN  11 -13.921  -2.260   7.100
  105   1HG   GLN  11          HG2       GLN  11 -14.432  -3.631   5.189
  106   2HG   GLN  11          HG1       GLN  11 -12.815  -4.305   5.199
  107   1HE2  GLN  11          HE21      GLN  11 -13.429  -4.108   8.400
  108   2HE2  GLN  11          HE22      GLN  11 -14.185  -5.638   8.649
  109    H    TRP  12           HN       TRP  12 -12.487  -1.423   3.144
  110    HA   TRP  12           HA       TRP  12 -10.206  -3.245   2.740
  111   1HB   TRP  12          HB2       TRP  12 -12.479  -3.787   1.718
  112   2HB   TRP  12          HB1       TRP  12 -12.233  -2.456   0.655
  113    HD1  TRP  12           HD1      TRP  12 -11.411  -5.981   1.066
  114    HE1  TRP  12           HE1      TRP  12  -9.740  -6.693  -0.739
  115    HE3  TRP  12           HE3      TRP  12 -10.324  -1.461  -0.602
  116    HZ2  TRP  12           HZ2      TRP  12  -8.151  -5.422  -2.700
  117    HZ3  TRP  12           HZ3      TRP  12  -8.709  -1.167  -2.486
  118    HH2  TRP  12           HH2      TRP  12  -7.634  -3.162  -3.516
  119    H    LEU  13           HN       LEU  13 -11.561  -0.074   1.861
  120    HA   LEU  13           HA       LEU  13  -9.077   0.516   0.441
  121   1HB   LEU  13          HB2       LEU  13 -10.213   2.039  -0.781
  122   2HB   LEU  13          HB1       LEU  13 -11.592   1.082  -0.289
  123    HG   LEU  13           HG       LEU  13 -12.263   3.307  -0.001
  124   1HD1  LEU  13          HD11      LEU  13 -13.051   3.183   2.082
  125   2HD1  LEU  13          HD12      LEU  13 -11.441   3.099   2.794
  126   3HD1  LEU  13          HD13      LEU  13 -12.197   1.643   2.149
  127   1HD2  LEU  13          HD21      LEU  13 -10.084   4.197   1.758
  128   2HD2  LEU  13          HD22      LEU  13 -10.945   5.060   0.484
  129   3HD2  LEU  13          HD23      LEU  13  -9.643   3.945   0.069
  130    H    SER  14           HN       SER  14 -10.459   0.885   3.494
  131    HA   SER  14           HA       SER  14  -9.074   3.331   4.100
  132   1HB   SER  14          HB2       SER  14 -11.259   2.102   5.233
  133   2HB   SER  14          HB1       SER  14  -9.987   1.728   6.384
  134    HG   SER  14           HG       SER  14  -9.930   3.750   6.973
  135    H    LEU  15           HN       LEU  15  -8.772  -0.078   4.872
  136    HA   LEU  15           HA       LEU  15  -6.302   0.323   6.252
  137   1HB   LEU  15          HB2       LEU  15  -7.658  -2.233   5.423
  138   2HB   LEU  15          HB1       LEU  15  -6.374  -2.055   6.600
  139    HG   LEU  15           HG       LEU  15  -8.224  -2.247   7.965
  140   1HD1  LEU  15          HD11      LEU  15  -7.015  -0.145   8.469
  141   2HD1  LEU  15          HD12      LEU  15  -8.730  -0.059   8.879
  142   3HD1  LEU  15          HD13      LEU  15  -8.135   0.713   7.406
  143   1HD2  LEU  15          HD21      LEU  15  -9.526  -1.423   5.579
  144   2HD2  LEU  15          HD22      LEU  15 -10.148  -0.471   6.937
  145   3HD2  LEU  15          HD23      LEU  15 -10.211  -2.234   6.995
  146    H    ARG  16           HN       ARG  16  -7.280  -1.561   3.425
  147    HA   ARG  16           HA       ARG  16  -4.804  -2.316   2.519
  148   1HB   ARG  16          HB2       ARG  16  -7.284  -1.591   1.052
  149   2HB   ARG  16          HB1       ARG  16  -5.841  -1.954   0.143
  150   1HG   ARG  16          HG2       ARG  16  -7.353  -3.761   2.005
  151   2HG   ARG  16          HG1       ARG  16  -7.129  -3.939   0.265
  152   1HD   ARG  16          HD2       ARG  16  -4.638  -4.093   0.763
  153   2HD   ARG  16          HD1       ARG  16  -5.101  -4.280   2.455
  154    HE   ARG  16           HE       ARG  16  -6.426  -6.114   0.682
  155   1HH1  ARG  16          1HH1      ARG  16  -3.565  -5.551   2.601
  156   2HH1  ARG  16          2HH1      ARG  16  -3.193  -7.235   2.765
  157   1HH2  ARG  16          1HH2      ARG  16  -5.939  -8.328   0.898
  158   2HH2  ARG  16          2HH2      ARG  16  -4.541  -8.811   1.798
  159    H    ASN  17           HN       ASN  17  -6.242   0.782   2.361
  160    HA   ASN  17           HA       ASN  17  -4.637   2.066   0.510
  161   1HB   ASN  17          HB2       ASN  17  -6.516   2.733   2.583
  162   2HB   ASN  17          HB1       ASN  17  -5.264   3.906   2.500
  163   1HD2  ASN  17          HD21      ASN  17  -7.420   5.017   1.960
  164   2HD2  ASN  17          HD22      ASN  17  -7.726   5.197   0.278
  165    HA   PRO  18           HA       PRO  18  -1.761   3.742   3.972
  166   1HB   PRO  18          HB2       PRO  18  -2.053   2.478   6.419
  167   2HB   PRO  18          HB1       PRO  18  -2.622   4.102   6.020
  168   1HG   PRO  18          HG2       PRO  18  -4.091   1.517   5.954
  169   2HG   PRO  18          HG1       PRO  18  -4.640   3.106   6.515
  170   1HD   PRO  18          HD2       PRO  18  -5.389   2.216   4.145
  171   2HD   PRO  18          HD1       PRO  18  -4.906   3.907   4.342
  172    H    ILE  19           HN       ILE  19  -2.848   0.519   3.765
  173    HA   ILE  19           HA       ILE  19  -0.392  -0.713   4.634
  174    HB   ILE  19           HB       ILE  19  -2.684  -1.906   3.090
  175   1HG1  ILE  19          HG12      ILE  19  -1.986  -1.824   6.020
  176   2HG1  ILE  19          HG11      ILE  19  -3.424  -1.186   5.252
  177   1HG2  ILE  19          HG21      ILE  19  -1.526  -3.788   2.868
  178   2HG2  ILE  19          HG22      ILE  19  -1.186  -3.823   4.597
  179   3HG2  ILE  19          HG23      ILE  19  -0.107  -2.960   3.505
  180   1HD1  ILE  19          HD11      ILE  19  -3.346  -3.929   4.649
  181   2HD1  ILE  19          HD12      ILE  19  -4.470  -3.074   5.704
  182   3HD1  ILE  19          HD13      ILE  19  -2.987  -3.763   6.367
  183    H    LEU  20           HN       LEU  20  -1.667   0.314   1.606
  184    HA   LEU  20           HA       LEU  20   0.329  -1.005   0.028
  185   1HB   LEU  20          HB2       LEU  20  -1.440   1.312  -0.786
  186   2HB   LEU  20          HB1       LEU  20  -0.525   0.280  -1.864
  187    HG   LEU  20           HG       LEU  20  -3.152  -0.136  -0.638
  188   1HD1  LEU  20          HD11      LEU  20  -1.703  -0.879  -3.133
  189   2HD1  LEU  20          HD12      LEU  20  -3.220  -0.004  -2.929
  190   3HD1  LEU  20          HD13      LEU  20  -3.170  -1.750  -2.686
  191   1HD2  LEU  20          HD21      LEU  20  -1.158  -2.392  -0.758
  192   2HD2  LEU  20          HD22      LEU  20  -2.903  -2.611  -0.618
  193   3HD2  LEU  20          HD23      LEU  20  -2.011  -1.794   0.666
  194    H    VAL  21           HN       VAL  21  -0.241   2.111   1.436
  195    HA   VAL  21           HA       VAL  21   1.942   3.508   0.368
  196    HB   VAL  21           HB       VAL  21   0.258   3.562   2.809
  197   1HG1  VAL  21          HG11      VAL  21   2.535   5.453   2.351
  198   2HG1  VAL  21          HG12      VAL  21   2.556   4.077   3.459
  199   3HG1  VAL  21          HG13      VAL  21   1.433   5.417   3.731
  200   1HG2  VAL  21          HG21      VAL  21   0.686   5.550   0.589
  201   2HG2  VAL  21          HG22      VAL  21  -0.450   5.736   1.929
  202   3HG2  VAL  21          HG23      VAL  21  -0.664   4.425   0.762
  203    H    PHE  22           HN       PHE  22   1.315   1.795   3.359
  204    HA   PHE  22           HA       PHE  22   3.750   1.927   4.652
  205   1HB   PHE  22          HB2       PHE  22   2.235   0.968   6.023
  206   2HB   PHE  22          HB1       PHE  22   1.306   0.343   4.685
  207    HD1  PHE  22           HD1      PHE  22   1.224  -1.791   4.298
  208    HD2  PHE  22           HD2      PHE  22   4.471  -0.168   6.408
  209    HE1  PHE  22           HE1      PHE  22   2.098  -4.068   4.630
  210    HE2  PHE  22           HE2      PHE  22   5.387  -2.417   6.787
  211    HZ   PHE  22           HZ       PHE  22   4.202  -4.386   5.873
  212    H    LEU  23           HN       LEU  23   2.721   0.053   1.905
  213    HA   LEU  23           HA       LEU  23   5.175  -1.563   2.123
  214   1HB   LEU  23          HB2       LEU  23   3.964  -3.220   1.241
  215   2HB   LEU  23          HB1       LEU  23   2.556  -2.162   1.319
  216    HG   LEU  23           HG       LEU  23   4.292  -1.843  -1.027
  217   1HD1  LEU  23          HD11      LEU  23   3.912  -3.829  -2.027
  218   2HD1  LEU  23          HD12      LEU  23   2.299  -3.970  -1.330
  219   3HD1  LEU  23          HD13      LEU  23   3.713  -4.418  -0.377
  220   1HD2  LEU  23          HD21      LEU  23   2.459  -0.906  -1.858
  221   2HD2  LEU  23          HD22      LEU  23   2.004  -0.847  -0.147
  222   3HD2  LEU  23          HD23      LEU  23   1.396  -2.151  -1.182
  223    H    LYS  24           HN       LYS  24   4.060   1.255   0.716
  224    HA   LYS  24           HA       LYS  24   5.575   1.196  -1.670
  225   1HB   LYS  24          HB2       LYS  24   3.880   2.668  -2.038
  226   2HB   LYS  24          HB1       LYS  24   3.510   2.744  -0.364
  227   1HG   LYS  24          HG2       LYS  24   5.894   4.192  -1.032
  228   2HG   LYS  24          HG1       LYS  24   4.445   4.804  -1.820
  229   1HD   LYS  24          HD2       LYS  24   3.479   5.415   0.151
  230   2HD   LYS  24          HD1       LYS  24   4.263   4.107   1.043
  231   1HE   LYS  24          HE2       LYS  24   6.344   5.306   1.081
  232   2HE   LYS  24          HE1       LYS  24   5.695   6.555   0.019
  233   1HZ   LYS  24          HZ1       LYS  24   4.880   5.987   2.815
  234   2HZ   LYS  24          HZ2       LYS  24   4.062   7.063   1.798
  235   3HZ   LYS  24          HZ3       LYS  24   5.666   7.370   2.239
  236    H    THR  25           HN       THR  25   5.603   2.537   1.546
  237    HA   THR  25           HA       THR  25   7.989   4.019   1.286
  238    HB   THR  25           HB       THR  25   6.348   4.639   2.958
  239    HG1  THR  25           HG1      THR  25   7.847   5.223   4.299
  240   1HG2  THR  25          HG21      THR  25   5.572   2.294   3.443
  241   2HG2  THR  25          HG22      THR  25   5.766   3.353   4.839
  242   3HG2  THR  25          HG23      THR  25   6.989   2.135   4.480
  243    H    ARG  26           HN       ARG  26   7.221   0.837   2.748
  244    HA   ARG  26           HA       ARG  26   9.741   0.221   3.739
  245   1HB   ARG  26          HB2       ARG  26   7.574  -1.436   2.486
  246   2HB   ARG  26          HB1       ARG  26   9.041  -2.182   3.112
  247   1HG   ARG  26          HG2       ARG  26   6.872  -0.757   4.604
  248   2HG   ARG  26          HG1       ARG  26   7.499  -2.381   4.848
  249   1HD   ARG  26          HD2       ARG  26   9.710  -1.197   5.435
  250   2HD   ARG  26          HD1       ARG  26   8.713   0.249   5.601
  251    HE   ARG  26           HE       ARG  26   8.854  -1.976   7.409
  252   1HH1  ARG  26          1HH1      ARG  26   6.842   0.634   6.261
  253   2HH1  ARG  26          2HH1      ARG  26   5.896   0.709   7.710
  254   1HH2  ARG  26          1HH2      ARG  26   7.612  -1.879   9.316
  255   2HH2  ARG  26          2HH2      ARG  26   6.334  -0.717   9.445
  256    H    VAL  27           HN       VAL  27   8.434  -0.052   0.527
  257    HA   VAL  27           HA       VAL  27  10.682  -1.263  -0.735
  258    HB   VAL  27           HB       VAL  27   8.044  -0.150  -1.460
  259   1HG1  VAL  27          HG11      VAL  27  10.308  -0.301  -3.413
  260   2HG1  VAL  27          HG12      VAL  27   9.245   1.058  -3.051
  261   3HG1  VAL  27          HG13      VAL  27   8.614  -0.353  -3.900
  262   1HG2  VAL  27          HG21      VAL  27   8.304  -2.509  -1.011
  263   2HG2  VAL  27          HG22      VAL  27   9.552  -2.639  -2.252
  264   3HG2  VAL  27          HG23      VAL  27   7.888  -2.268  -2.709
  265    H    LEU  28           HN       LEU  28   9.759   1.906   0.135
  266    HA   LEU  28           HA       LEU  28  11.312   3.342  -1.751
  267   1HB   LEU  28          HB2       LEU  28  10.022   5.051  -1.101
  268   2HB   LEU  28          HB1       LEU  28   9.080   3.855  -0.287
  269    HG   LEU  28           HG       LEU  28  10.268   4.311   1.797
  270   1HD1  LEU  28          HD11      LEU  28  12.016   5.801   0.036
  271   2HD1  LEU  28          HD12      LEU  28  12.285   5.233   1.683
  272   3HD1  LEU  28          HD13      LEU  28  11.469   6.771   1.404
  273   1HD2  LEU  28          HD21      LEU  28   8.327   5.847   0.583
  274   2HD2  LEU  28          HD22      LEU  28   9.496   7.038   1.154
  275   3HD2  LEU  28          HD23      LEU  28   8.777   5.895   2.288
  276    H    LYS  29           HN       LYS  29  11.301   2.709   1.657
  277    HA   LYS  29           HA       LYS  29  13.787   3.926   2.209
  278   1HB   LYS  29          HB2       LYS  29  13.594   3.090   4.419
  279   2HB   LYS  29          HB1       LYS  29  11.958   3.472   3.910
  280   1HG   LYS  29          HG2       LYS  29  11.470   1.155   3.531
  281   2HG   LYS  29          HG1       LYS  29  13.153   0.710   3.833
  282   1HD   LYS  29          HD2       LYS  29  12.434   2.123   6.098
  283   2HD   LYS  29          HD1       LYS  29  10.983   1.194   5.710
  284   1HE   LYS  29          HE2       LYS  29  12.772  -0.741   5.392
  285   2HE   LYS  29          HE1       LYS  29  13.686   0.262   6.518
  286   1HZ   LYS  29          HZ1       LYS  29  10.907  -0.260   7.209
  287   2HZ   LYS  29          HZ2       LYS  29  12.274  -0.186   8.202
  288   3HZ   LYS  29          HZ3       LYS  29  11.959  -1.583   7.300
  289    H    ARG  30           HN       ARG  30  12.764   0.957   1.001
  290    HA   ARG  30           HA       ARG  30  15.188  -0.476   1.454
  291   1HB   ARG  30          HB2       ARG  30  12.586  -0.917   0.119
  292   2HB   ARG  30          HB1       ARG  30  13.909  -1.939  -0.369
  293   1HG   ARG  30          HG2       ARG  30  13.715  -1.715   2.493
  294   2HG   ARG  30          HG1       ARG  30  12.208  -2.269   1.781
  295   1HD   ARG  30          HD2       ARG  30  14.861  -3.499   1.087
  296   2HD   ARG  30          HD1       ARG  30  13.894  -4.061   2.450
  297    HE   ARG  30           HE       ARG  30  12.445  -3.964  -0.029
  298   1HH1  ARG  30          1HH1      ARG  30  14.556  -5.890   1.973
  299   2HH1  ARG  30          2HH1      ARG  30  14.042  -7.395   1.286
  300   1HH2  ARG  30          1HH2      ARG  30  11.767  -5.941  -0.935
  301   2HH2  ARG  30          2HH2      ARG  30  12.459  -7.423  -0.365
  302    H    TRP  31           HN       TRP  31  13.658   1.506  -0.890
  303    HA   TRP  31           HA       TRP  31  15.318   1.062  -3.100
  304   1HB   TRP  31          HB2       TRP  31  12.946   2.393  -2.432
  305   2HB   TRP  31          HB1       TRP  31  14.019   3.584  -3.052
  306    HD1  TRP  31           HD1      TRP  31  12.078   0.670  -4.030
  307    HE1  TRP  31           HE1      TRP  31  12.226   0.359  -6.575
  308    HE3  TRP  31           HE3      TRP  31  15.591   3.934  -4.751
  309    HZ2  TRP  31           HZ2      TRP  31  13.773   1.482  -8.671
  310    HZ3  TRP  31           HZ3      TRP  31  16.488   4.385  -7.059
  311    HH2  TRP  31           HH2      TRP  31  15.578   3.155  -8.989
  312    H    ARG  32           HN       ARG  32  15.002   3.369  -0.386
  313    HA   ARG  32           HA       ARG  32  17.092   5.122  -1.070
  314   1HB   ARG  32          HB2       ARG  32  15.995   4.109   1.518
  315   2HB   ARG  32          HB1       ARG  32  17.093   5.489   1.410
  316   1HG   ARG  32          HG2       ARG  32  15.456   6.668   0.052
  317   2HG   ARG  32          HG1       ARG  32  14.374   5.293   0.140
  318   1HD   ARG  32          HD2       ARG  32  13.624   6.819   1.763
  319   2HD   ARG  32          HD1       ARG  32  14.439   5.513   2.617
  320    HE   ARG  32           HE       ARG  32  16.395   7.345   2.315
  321   1HH1  ARG  32          1HH1      ARG  32  13.142   7.543   3.562
  322   2HH1  ARG  32          2HH1      ARG  32  13.508   8.827   4.664
  323   1HH2  ARG  32          1HH2      ARG  32  16.879   9.035   3.765
  324   2HH2  ARG  32          2HH2      ARG  32  15.629   9.674   4.779
  325    H    LEU  33           HN       LEU  33  16.890   2.354   0.998
  326    HA   LEU  33           HA       LEU  33  19.462   1.947   1.834
  327   1HB   LEU  33          HB2       LEU  33  16.956   0.424   1.403
  328   2HB   LEU  33          HB1       LEU  33  18.367  -0.456   1.838
  329    HG   LEU  33           HG       LEU  33  16.557   0.723   3.506
  330   1HD1  LEU  33          HD11      LEU  33  18.356  -1.147   3.830
  331   2HD1  LEU  33          HD12      LEU  33  17.757  -0.244   5.221
  332   3HD1  LEU  33          HD13      LEU  33  19.312   0.173   4.503
  333   1HD2  LEU  33          HD21      LEU  33  17.454   2.588   4.528
  334   2HD2  LEU  33          HD22      LEU  33  17.789   2.853   2.815
  335   3HD2  LEU  33          HD23      LEU  33  19.067   2.278   3.884
  336    H    PHE  34           HN       PHE  34  17.687   0.851  -0.876
  337    HA   PHE  34           HA       PHE  34  19.680  -0.870  -1.944
  338   1HB   PHE  34          HB2       PHE  34  17.035   0.017  -2.642
  339   2HB   PHE  34          HB1       PHE  34  18.037  -0.273  -4.033
  340    HD1  PHE  34           HD1      PHE  34  18.215  -1.844  -0.796
  341    HD2  PHE  34           HD2      PHE  34  17.110  -2.255  -4.856
  342    HE1  PHE  34           HE1      PHE  34  17.932  -4.250  -0.462
  343    HE2  PHE  34           HE2      PHE  34  16.808  -4.660  -4.551
  344    HZ   PHE  34           HZ       PHE  34  17.215  -5.692  -2.341
  345    H    SER  35           HN       SER  35  18.940   2.371  -1.917
  346    HA   SER  35           HA       SER  35  20.727   2.974  -4.202
  347   1HB   SER  35          HB2       SER  35  18.438   4.290  -3.322
  348   2HB   SER  35          HB1       SER  35  19.764   5.346  -2.838
  349    HG   SER  35           HG       SER  35  18.746   5.316  -5.148
  350    H    LYS  36           HN       LYS  36  20.735   3.040  -0.708
  351    HA   LYS  36           HA       LYS  36  23.068   4.755  -0.599
  352   1HB   LYS  36          HB2       LYS  36  22.011   3.046   1.641
  353   2HB   LYS  36          HB1       LYS  36  23.026   4.475   1.769
  354   1HG   LYS  36          HG2       LYS  36  21.020   5.691   0.681
  355   2HG   LYS  36          HG1       LYS  36  20.118   4.264   1.193
  356   1HD   LYS  36          HD2       LYS  36  21.858   5.779   3.100
  357   2HD   LYS  36          HD1       LYS  36  20.178   6.241   2.802
  358   1HE   LYS  36          HE2       LYS  36  19.370   4.500   3.959
  359   2HE   LYS  36          HE1       LYS  36  20.559   3.386   3.281
  360   1HZ   LYS  36          HZ1       LYS  36  22.084   3.885   4.926
  361   2HZ   LYS  36          HZ2       LYS  36  20.627   3.913   5.784
  362   3HZ   LYS  36          HZ3       LYS  36  21.361   5.364   5.317
  363    H    HIS  37           HN       HIS  37  22.295   1.403  -0.336
  364    HA   HIS  37           HA       HIS  37  24.884   0.472   0.342
  365   1HB   HIS  37          HB2       HIS  37  22.305  -0.673  -0.171
  366   2HB   HIS  37          HB1       HIS  37  23.517  -1.559  -1.075
  367    HD1  HIS  37           HD1      HIS  37  24.454  -3.455   0.203
  368    HD2  HIS  37           HD2      HIS  37  23.272  -0.340   2.686
  369    HE1  HIS  37           HE1      HIS  37  24.914  -4.252   2.545
  370    HE2  HIS  37           HE2      HIS  37  24.121  -2.381   4.035
  371    H    GLU  38           HN       GLU  38  23.213   0.962  -2.717
  372    HA   GLU  38           HA       GLU  38  23.869   0.718  -4.889
  373   1HB   GLU  38          HB2       GLU  38  26.093   1.856  -5.352
  374   2HB   GLU  38          HB1       GLU  38  24.876   2.817  -4.527
  375   1HG   GLU  38          HG2       GLU  38  25.982   2.466  -2.409
  376   2HG   GLU  38          HG1       GLU  38  27.161   1.401  -3.174
  Start of MODEL   19
    1   1H    VAL   1          HT1       VAL   1 -29.902   2.815   1.829
    2   2H    VAL   1          HT2       VAL   1 -28.951   3.001   3.246
    3   3H    VAL   1          HT3       VAL   1 -30.596   2.525   3.370
    4    HA   VAL   1           HA       VAL   1 -30.216   0.445   2.631
    5    HB   VAL   1           HB       VAL   1 -28.003  -0.189   1.566
    6   1HG1  VAL   1          HG11      VAL   1 -30.335   0.951   0.465
    7   2HG1  VAL   1          HG12      VAL   1 -29.193  -0.148  -0.307
    8   3HG1  VAL   1          HG13      VAL   1 -28.971   1.596  -0.447
    9   1HG2  VAL   1          HG21      VAL   1 -27.719   2.795   1.619
   10   2HG2  VAL   1          HG22      VAL   1 -26.931   1.826   0.374
   11   3HG2  VAL   1          HG23      VAL   1 -26.548   1.557   2.074
   12    H    MET   2           HN       MET   2 -28.738  -1.306   3.451
   13    HA   MET   2           HA       MET   2 -27.940  -0.678   6.118
   14   1HB   MET   2          HB2       MET   2 -28.345  -3.089   4.450
   15   2HB   MET   2          HB1       MET   2 -27.215  -3.237   5.772
   16   1HG   MET   2          HG2       MET   2 -30.078  -2.369   5.985
   17   2HG   MET   2          HG1       MET   2 -29.441  -3.954   6.421
   18   1HE   MET   2          HE1       MET   2 -30.182  -3.761   9.372
   19   2HE   MET   2          HE2       MET   2 -31.167  -2.895   8.194
   20   3HE   MET   2          HE3       MET   2 -30.603  -2.071   9.648
   21    HA   PRO   3           HA       PRO   3 -23.560  -0.536   5.357
   22   1HB   PRO   3          HB2       PRO   3 -22.565  -1.130   7.723
   23   2HB   PRO   3          HB1       PRO   3 -23.814   0.110   7.637
   24   1HG   PRO   3          HG2       PRO   3 -24.121  -2.800   8.290
   25   2HG   PRO   3          HG1       PRO   3 -24.685  -1.395   9.225
   26   1HD   PRO   3          HD2       PRO   3 -26.259  -2.762   7.424
   27   2HD   PRO   3          HD1       PRO   3 -26.499  -1.054   7.849
   28    H    LYS   4           HN       LYS   4 -21.635  -2.394   6.658
   29    HA   LYS   4           HA       LYS   4 -20.646  -4.418   6.414
   30   1HB   LYS   4          HB2       LYS   4 -23.108  -5.190   6.737
   31   2HB   LYS   4          HB1       LYS   4 -23.050  -5.514   5.011
   32   1HG   LYS   4          HG2       LYS   4 -20.859  -6.809   5.646
   33   2HG   LYS   4          HG1       LYS   4 -21.609  -6.854   7.243
   34   1HD   LYS   4          HD2       LYS   4 -22.630  -8.703   6.482
   35   2HD   LYS   4          HD1       LYS   4 -23.691  -7.574   5.637
   36   1HE   LYS   4          HE2       LYS   4 -22.809  -8.054   3.615
   37   2HE   LYS   4          HE1       LYS   4 -21.175  -8.233   4.254
   38   1HZ   LYS   4          HZ1       LYS   4 -22.381 -10.364   5.315
   39   2HZ   LYS   4          HZ2       LYS   4 -21.554 -10.392   3.840
   40   3HZ   LYS   4          HZ3       LYS   4 -23.237 -10.231   3.861
   41    H    GLN   5           HN       GLN   5 -22.299  -2.970   3.695
   42    HA   GLN   5           HA       GLN   5 -20.472  -4.289   1.851
   43   1HB   GLN   5          HB2       GLN   5 -22.218  -4.234   0.445
   44   2HB   GLN   5          HB1       GLN   5 -23.158  -3.461   1.700
   45   1HG   GLN   5          HG2       GLN   5 -23.324  -2.194  -0.350
   46   2HG   GLN   5          HG1       GLN   5 -22.489  -1.287   0.858
   47   1HE2  GLN   5          HE21      GLN   5 -21.733  -3.438  -1.782
   48   2HE2  GLN   5          HE22      GLN   5 -20.379  -2.531  -2.283
   49    H    ILE   6           HN       ILE   6 -21.147  -1.271   3.296
   50    HA   ILE   6           HA       ILE   6 -19.236   0.150   1.690
   51    HB   ILE   6           HB       ILE   6 -19.780   1.987   3.435
   52   1HG1  ILE   6          HG12      ILE   6 -22.027   1.897   4.346
   53   2HG1  ILE   6          HG11      ILE   6 -22.269   0.289   3.714
   54   1HG2  ILE   6          HG21      ILE   6 -21.606   2.729   2.022
   55   2HG2  ILE   6          HG22      ILE   6 -21.773   1.089   1.389
   56   3HG2  ILE   6          HG23      ILE   6 -20.302   2.013   1.070
   57   1HD1  ILE   6          HD11      ILE   6 -21.524   0.837   6.233
   58   2HD1  ILE   6          HD12      ILE   6 -19.940   0.647   5.481
   59   3HD1  ILE   6          HD13      ILE   6 -21.118  -0.666   5.407
   60    H    VAL   7           HN       VAL   7 -19.559  -1.504   4.690
   61    HA   VAL   7           HA       VAL   7 -17.278  -0.412   6.014
   62    HB   VAL   7           HB       VAL   7 -19.427  -1.661   6.957
   63   1HG1  VAL   7          HG11      VAL   7 -19.008  -3.966   7.547
   64   2HG1  VAL   7          HG12      VAL   7 -17.446  -3.923   6.729
   65   3HG1  VAL   7          HG13      VAL   7 -18.935  -3.778   5.795
   66   1HG2  VAL   7          HG21      VAL   7 -16.766  -2.170   8.218
   67   2HG2  VAL   7          HG22      VAL   7 -18.316  -1.872   9.005
   68   3HG2  VAL   7          HG23      VAL   7 -17.502  -0.571   8.137
   69    H    TYR   8           HN       TYR   8 -18.153  -3.178   4.111
   70    HA   TYR   8           HA       TYR   8 -15.770  -4.691   4.200
   71   1HB   TYR   8          HB2       TYR   8 -18.230  -4.924   2.956
   72   2HB   TYR   8          HB1       TYR   8 -17.126  -4.661   1.610
   73    HD1  TYR   8           HD1      TYR   8 -16.756  -6.734   0.623
   74    HD2  TYR   8           HD2      TYR   8 -16.661  -6.388   4.842
   75    HE1  TYR   8           HE1      TYR   8 -15.959  -9.002   0.788
   76    HE2  TYR   8           HE2      TYR   8 -15.867  -8.601   5.030
   77    HH   TYR   8           HH       TYR   8 -14.639 -10.399   2.455
   78    H    TRP   9           HN       TRP   9 -17.052  -2.172   2.099
   79    HA   TRP   9           HA       TRP   9 -14.857  -1.942   0.323
   80   1HB   TRP   9          HB2       TRP   9 -17.294  -0.470   1.028
   81   2HB   TRP   9          HB1       TRP   9 -15.959   0.589   0.571
   82    HD1  TRP   9           HD1      TRP   9 -18.579  -1.490  -0.856
   83    HE1  TRP   9           HE1      TRP   9 -18.213  -1.609  -3.435
   84    HE3  TRP   9           HE3      TRP   9 -14.008   0.382  -1.032
   85    HZ2  TRP   9           HZ2      TRP   9 -16.206  -0.972  -5.273
   86    HZ3  TRP   9           HZ3      TRP   9 -12.852   0.638  -3.210
   87    HH2  TRP   9           HH2      TRP   9 -13.968  -0.048  -5.286
   88    H    LYS  10           HN       LYS  10 -16.003   0.051   2.860
   89    HA   LYS  10           HA       LYS  10 -13.910   1.774   3.259
   90   1HB   LYS  10          HB2       LYS  10 -15.963   2.151   4.392
   91   2HB   LYS  10          HB1       LYS  10 -15.894   0.584   5.183
   92   1HG   LYS  10          HG2       LYS  10 -13.598   1.833   6.026
   93   2HG   LYS  10          HG1       LYS  10 -14.791   3.128   5.991
   94   1HD   LYS  10          HD2       LYS  10 -15.745   0.609   7.156
   95   2HD   LYS  10          HD1       LYS  10 -14.442   1.386   8.058
   96   1HE   LYS  10          HE2       LYS  10 -16.847   2.928   7.140
   97   2HE   LYS  10          HE1       LYS  10 -16.868   2.006   8.643
   98   1HZ   LYS  10          HZ1       LYS  10 -14.608   3.367   8.941
   99   2HZ   LYS  10          HZ2       LYS  10 -16.107   3.939   9.474
  100   3HZ   LYS  10          HZ3       LYS  10 -15.475   4.473   7.999
  101    H    GLN  11           HN       GLN  11 -14.385  -1.382   4.855
  102    HA   GLN  11           HA       GLN  11 -11.865  -1.186   6.217
  103   1HB   GLN  11          HB2       GLN  11 -12.344  -3.323   7.106
  104   2HB   GLN  11          HB1       GLN  11 -13.897  -2.517   6.999
  105   1HG   GLN  11          HG2       GLN  11 -14.438  -3.736   4.993
  106   2HG   GLN  11          HG1       GLN  11 -12.839  -4.455   4.962
  107   1HE2  GLN  11          HE21      GLN  11 -13.457  -4.475   8.165
  108   2HE2  GLN  11          HE22      GLN  11 -14.260  -5.995   8.301
  109    H    TRP  12           HN       TRP  12 -12.423  -1.496   3.111
  110    HA   TRP  12           HA       TRP  12 -10.148  -3.303   2.620
  111   1HB   TRP  12          HB2       TRP  12 -12.422  -3.803   1.580
  112   2HB   TRP  12          HB1       TRP  12 -12.178  -2.427   0.575
  113    HD1  TRP  12           HD1      TRP  12 -11.356  -5.967   0.831
  114    HE1  TRP  12           HE1      TRP  12  -9.684  -6.600  -1.003
  115    HE3  TRP  12           HE3      TRP  12 -10.266  -1.379  -0.638
  116    HZ2  TRP  12           HZ2      TRP  12  -8.093  -5.246  -2.905
  117    HZ3  TRP  12           HZ3      TRP  12  -8.650  -1.004  -2.507
  118    HH2  TRP  12           HH2      TRP  12  -7.575  -2.952  -3.623
  119    H    LEU  13           HN       LEU  13 -11.510  -0.100   1.880
  120    HA   LEU  13           HA       LEU  13  -9.027   0.567   0.492
  121   1HB   LEU  13          HB2       LEU  13 -11.216   1.140  -0.562
  122   2HB   LEU  13          HB1       LEU  13 -11.554   2.202   0.792
  123    HG   LEU  13           HG       LEU  13  -9.063   3.046  -0.142
  124   1HD1  LEU  13          HD11      LEU  13  -9.566   1.636  -2.168
  125   2HD1  LEU  13          HD12      LEU  13  -9.250   3.342  -2.481
  126   3HD1  LEU  13          HD13      LEU  13 -10.906   2.733  -2.498
  127   1HD2  LEU  13          HD21      LEU  13 -10.134   5.075  -0.490
  128   2HD2  LEU  13          HD22      LEU  13 -11.171   4.283   0.696
  129   3HD2  LEU  13          HD23      LEU  13 -11.637   4.309  -1.005
  130    H    SER  14           HN       SER  14 -10.341   0.709   3.574
  131    HA   SER  14           HA       SER  14  -9.033   3.191   4.275
  132   1HB   SER  14          HB2       SER  14 -11.192   1.896   5.377
  133   2HB   SER  14          HB1       SER  14  -9.904   1.457   6.487
  134    HG   SER  14           HG       SER  14 -10.420   4.121   5.677
  135    H    LEU  15           HN       LEU  15  -8.704  -0.246   4.889
  136    HA   LEU  15           HA       LEU  15  -6.214   0.098   6.249
  137   1HB   LEU  15          HB2       LEU  15  -7.554  -2.425   5.302
  138   2HB   LEU  15          HB1       LEU  15  -6.264  -2.292   6.477
  139    HG   LEU  15           HG       LEU  15  -8.100  -2.581   7.843
  140   1HD1  LEU  15          HD11      LEU  15  -8.052   0.407   7.449
  141   2HD1  LEU  15          HD12      LEU  15  -6.913  -0.496   8.452
  142   3HD1  LEU  15          HD13      LEU  15  -8.625  -0.454   8.880
  143   1HD2  LEU  15          HD21      LEU  15  -9.436  -1.664   5.516
  144   2HD2  LEU  15          HD22      LEU  15 -10.050  -0.768   6.914
  145   3HD2  LEU  15          HD23      LEU  15 -10.103  -2.532   6.907
  146    H    ARG  16           HN       ARG  16  -7.204  -1.662   3.347
  147    HA   ARG  16           HA       ARG  16  -4.726  -2.316   2.369
  148   1HB   ARG  16          HB2       ARG  16  -7.257  -1.606   0.981
  149   2HB   ARG  16          HB1       ARG  16  -5.829  -1.933   0.038
  150   1HG   ARG  16          HG2       ARG  16  -7.273  -3.787   1.905
  151   2HG   ARG  16          HG1       ARG  16  -7.091  -3.937   0.156
  152   1HD   ARG  16          HD2       ARG  16  -4.538  -3.951   0.732
  153   2HD   ARG  16          HD1       ARG  16  -5.107  -4.435   2.326
  154    HE   ARG  16           HE       ARG  16  -5.691  -5.929  -0.151
  155   1HH1  ARG  16          1HH1      ARG  16  -4.967  -5.861   3.274
  156   2HH1  ARG  16          2HH1      ARG  16  -4.987  -7.583   3.430
  157   1HH2  ARG  16          1HH2      ARG  16  -5.713  -8.187   0.069
  158   2HH2  ARG  16          2HH2      ARG  16  -5.409  -8.902   1.617
  159    H    ASN  17           HN       ASN  17  -6.203   0.760   2.428
  160    HA   ASN  17           HA       ASN  17  -4.711   2.110   0.518
  161   1HB   ASN  17          HB2       ASN  17  -6.566   2.714   2.620
  162   2HB   ASN  17          HB1       ASN  17  -5.345   3.922   2.524
  163   1HD2  ASN  17          HD21      ASN  17  -7.475   5.032   2.013
  164   2HD2  ASN  17          HD22      ASN  17  -7.834   5.188   0.338
  165    HA   PRO  18           HA       PRO  18  -1.710   3.875   3.759
  166   1HB   PRO  18          HB2       PRO  18  -1.905   2.833   6.307
  167   2HB   PRO  18          HB1       PRO  18  -2.517   4.408   5.795
  168   1HG   PRO  18          HG2       PRO  18  -3.944   1.800   5.976
  169   2HG   PRO  18          HG1       PRO  18  -4.490   3.411   6.477
  170   1HD   PRO  18          HD2       PRO  18  -5.344   2.399   4.198
  171   2HD   PRO  18          HD1       PRO  18  -4.843   4.095   4.271
  172    H    ILE  19           HN       ILE  19  -2.816   0.665   3.770
  173    HA   ILE  19           HA       ILE  19  -0.377  -0.520   4.700
  174    HB   ILE  19           HB       ILE  19  -2.738  -1.756   3.305
  175   1HG1  ILE  19          HG12      ILE  19  -1.881  -1.537   6.184
  176   2HG1  ILE  19          HG11      ILE  19  -3.334  -0.890   5.461
  177   1HG2  ILE  19          HG21      ILE  19  -1.514  -3.592   3.016
  178   2HG2  ILE  19          HG22      ILE  19  -1.343  -3.710   4.766
  179   3HG2  ILE  19          HG23      ILE  19  -0.133  -2.849   3.820
  180   1HD1  ILE  19          HD11      ILE  19  -3.621  -3.541   4.947
  181   2HD1  ILE  19          HD12      ILE  19  -4.315  -2.693   6.329
  182   3HD1  ILE  19          HD13      ILE  19  -2.788  -3.560   6.502
  183    H    LEU  20           HN       LEU  20  -1.622   0.349   1.593
  184    HA   LEU  20           HA       LEU  20   0.368  -1.162   0.152
  185   1HB   LEU  20          HB2       LEU  20  -0.469  -0.210  -1.838
  186   2HB   LEU  20          HB1       LEU  20  -1.858  -0.539  -0.829
  187    HG   LEU  20           HG       LEU  20  -1.000   2.146  -0.363
  188   1HD1  LEU  20          HD11      LEU  20  -0.984   3.146  -2.435
  189   2HD1  LEU  20          HD12      LEU  20  -1.798   1.788  -3.213
  190   3HD1  LEU  20          HD13      LEU  20  -0.098   1.657  -2.764
  191   1HD2  LEU  20          HD21      LEU  20  -3.218   1.089  -0.024
  192   2HD2  LEU  20          HD22      LEU  20  -3.448   1.134  -1.773
  193   3HD2  LEU  20          HD23      LEU  20  -3.262   2.637  -0.866
  194    H    VAL  21           HN       VAL  21  -0.180   2.075   1.269
  195    HA   VAL  21           HA       VAL  21   2.017   3.421   0.216
  196    HB   VAL  21           HB       VAL  21   0.324   3.585   2.644
  197   1HG1  VAL  21          HG11      VAL  21   2.610   5.431   2.087
  198   2HG1  VAL  21          HG12      VAL  21   2.625   4.114   3.263
  199   3HG1  VAL  21          HG13      VAL  21   1.510   5.472   3.468
  200   1HG2  VAL  21          HG21      VAL  21  -0.572   4.354   0.531
  201   2HG2  VAL  21          HG22      VAL  21   0.780   5.478   0.347
  202   3HG2  VAL  21          HG23      VAL  21  -0.383   5.701   1.657
  203    H    PHE  22           HN       PHE  22   1.403   1.833   3.280
  204    HA   PHE  22           HA       PHE  22   3.828   2.070   4.567
  205   1HB   PHE  22          HB2       PHE  22   2.299   1.195   5.980
  206   2HB   PHE  22          HB1       PHE  22   1.402   0.462   4.673
  207    HD1  PHE  22           HD1      PHE  22   1.236  -1.656   4.606
  208    HD2  PHE  22           HD2      PHE  22   4.628   0.083   6.359
  209    HE1  PHE  22           HE1      PHE  22   2.050  -3.912   5.196
  210    HE2  PHE  22           HE2      PHE  22   5.497  -2.129   6.961
  211    HZ   PHE  22           HZ       PHE  22   4.204  -4.147   6.359
  212    H    LEU  23           HN       LEU  23   2.750   0.015   2.028
  213    HA   LEU  23           HA       LEU  23   5.072  -1.784   2.071
  214   1HB   LEU  23          HB2       LEU  23   2.764  -1.379   0.186
  215   2HB   LEU  23          HB1       LEU  23   4.153  -2.316  -0.322
  216    HG   LEU  23           HG       LEU  23   2.009  -3.421   0.756
  217   1HD1  LEU  23          HD11      LEU  23   3.863  -5.070   1.817
  218   2HD1  LEU  23          HD12      LEU  23   4.869  -4.111   0.730
  219   3HD1  LEU  23          HD13      LEU  23   3.483  -4.998   0.096
  220   1HD2  LEU  23          HD21      LEU  23   3.614  -3.430   3.202
  221   2HD2  LEU  23          HD22      LEU  23   1.863  -3.398   2.986
  222   3HD2  LEU  23          HD23      LEU  23   2.802  -1.909   2.828
  223    H    LYS  24           HN       LYS  24   3.966   0.979   0.455
  224    HA   LYS  24           HA       LYS  24   5.873   1.154  -1.594
  225   1HB   LYS  24          HB2       LYS  24   3.611   2.555  -0.605
  226   2HB   LYS  24          HB1       LYS  24   4.856   3.715  -0.917
  227   1HG   LYS  24          HG2       LYS  24   4.268   3.629  -3.057
  228   2HG   LYS  24          HG1       LYS  24   4.844   1.960  -3.079
  229   1HD   LYS  24          HD2       LYS  24   2.725   1.462  -3.628
  230   2HD   LYS  24          HD1       LYS  24   2.446   1.645  -1.890
  231   1HE   LYS  24          HE2       LYS  24   1.055   3.337  -2.281
  232   2HE   LYS  24          HE1       LYS  24   2.339   4.223  -3.101
  233   1HZ   LYS  24          HZ1       LYS  24   1.513   3.720  -5.105
  234   2HZ   LYS  24          HZ2       LYS  24   0.075   3.396  -4.276
  235   3HZ   LYS  24          HZ3       LYS  24   1.121   2.130  -4.679
  236    H    THR  25           HN       THR  25   5.589   2.587   1.563
  237    HA   THR  25           HA       THR  25   7.938   4.121   1.462
  238    HB   THR  25           HB       THR  25   6.306   4.761   3.058
  239    HG1  THR  25           HG1      THR  25   8.563   4.719   3.803
  240   1HG2  THR  25          HG21      THR  25   6.493   2.197   4.561
  241   2HG2  THR  25          HG22      THR  25   5.369   2.358   3.208
  242   3HG2  THR  25          HG23      THR  25   5.238   3.436   4.602
  243    H    ARG  26           HN       ARG  26   7.146   0.912   2.780
  244    HA   ARG  26           HA       ARG  26   9.654   0.350   3.908
  245   1HB   ARG  26          HB2       ARG  26   7.521  -1.363   2.661
  246   2HB   ARG  26          HB1       ARG  26   8.971  -2.069   3.365
  247   1HG   ARG  26          HG2       ARG  26   6.732  -0.624   4.720
  248   2HG   ARG  26          HG1       ARG  26   7.391  -2.214   5.060
  249   1HD   ARG  26          HD2       ARG  26   9.559  -0.871   5.617
  250   2HD   ARG  26          HD1       ARG  26   8.438   0.480   5.787
  251    HE   ARG  26           HE       ARG  26   7.571  -1.803   7.255
  252   1HH1  ARG  26          1HH1      ARG  26   9.804   0.878   7.342
  253   2HH1  ARG  26          2HH1      ARG  26   9.888   0.913   9.071
  254   1HH2  ARG  26          1HH2      ARG  26   7.681  -1.757   9.530
  255   2HH2  ARG  26          2HH2      ARG  26   8.683  -0.581  10.313
  256    H    VAL  27           HN       VAL  27   8.366  -0.021   0.698
  257    HA   VAL  27           HA       VAL  27  10.637  -1.235  -0.521
  258    HB   VAL  27           HB       VAL  27   7.998  -0.167  -1.295
  259   1HG1  VAL  27          HG11      VAL  27   9.202   1.012  -2.902
  260   2HG1  VAL  27          HG12      VAL  27   8.592  -0.423  -3.723
  261   3HG1  VAL  27          HG13      VAL  27  10.280  -0.345  -3.220
  262   1HG2  VAL  27          HG21      VAL  27   9.534  -2.661  -2.001
  263   2HG2  VAL  27          HG22      VAL  27   7.878  -2.316  -2.501
  264   3HG2  VAL  27          HG23      VAL  27   8.261  -2.509  -0.789
  265    H    LEU  28           HN       LEU  28   9.668   1.950   0.271
  266    HA   LEU  28           HA       LEU  28  11.214   3.353  -1.649
  267   1HB   LEU  28          HB2       LEU  28   9.908   5.067  -1.038
  268   2HB   LEU  28          HB1       LEU  28   8.982   3.887  -0.187
  269    HG   LEU  28           HG       LEU  28  10.151   4.410   1.875
  270   1HD1  LEU  28          HD11      LEU  28  11.370   6.849   1.429
  271   2HD1  LEU  28          HD12      LEU  28  11.915   5.848   0.082
  272   3HD1  LEU  28          HD13      LEU  28  12.175   5.311   1.742
  273   1HD2  LEU  28          HD21      LEU  28   9.398   7.122   1.131
  274   2HD2  LEU  28          HD22      LEU  28   8.679   6.030   2.314
  275   3HD2  LEU  28          HD23      LEU  28   8.223   5.912   0.615
  276    H    LYS  29           HN       LYS  29  11.224   2.785   1.766
  277    HA   LYS  29           HA       LYS  29  13.705   4.042   2.278
  278   1HB   LYS  29          HB2       LYS  29  13.530   3.230   4.516
  279   2HB   LYS  29          HB1       LYS  29  11.911   3.680   4.006
  280   1HG   LYS  29          HG2       LYS  29  11.362   1.347   3.612
  281   2HG   LYS  29          HG1       LYS  29  13.004   0.873   4.056
  282   1HD   LYS  29          HD2       LYS  29  12.237   2.366   6.212
  283   2HD   LYS  29          HD1       LYS  29  10.724   1.587   5.748
  284   1HE   LYS  29          HE2       LYS  29  11.445  -0.463   6.350
  285   2HE   LYS  29          HE1       LYS  29  13.085  -0.167   5.774
  286   1HZ   LYS  29          HZ1       LYS  29  12.477  -0.359   8.337
  287   2HZ   LYS  29          HZ2       LYS  29  12.248   1.305   8.144
  288   3HZ   LYS  29          HZ3       LYS  29  13.745   0.610   7.774
  289    H    ARG  30           HN       ARG  30  12.688   1.031   1.163
  290    HA   ARG  30           HA       ARG  30  15.126  -0.373   1.655
  291   1HB   ARG  30          HB2       ARG  30  12.521  -0.883   0.348
  292   2HB   ARG  30          HB1       ARG  30  13.853  -1.911  -0.101
  293   1HG   ARG  30          HG2       ARG  30  13.661  -1.583   2.749
  294   2HG   ARG  30          HG1       ARG  30  12.151  -2.165   2.063
  295   1HD   ARG  30          HD2       ARG  30  14.640  -3.465   1.122
  296   2HD   ARG  30          HD1       ARG  30  14.144  -3.803   2.779
  297    HE   ARG  30           HE       ARG  30  11.888  -4.180   1.274
  298   1HH1  ARG  30          1HH1      ARG  30  15.119  -5.501   1.282
  299   2HH1  ARG  30          2HH1      ARG  30  14.627  -7.039   0.658
  300   1HH2  ARG  30          1HH2      ARG  30  11.239  -6.205   0.453
  301   2HH2  ARG  30          2HH2      ARG  30  12.425  -7.439   0.188
  302    H    TRP  31           HN       TRP  31  13.552   1.516  -0.741
  303    HA   TRP  31           HA       TRP  31  15.187   1.013  -2.948
  304   1HB   TRP  31          HB2       TRP  31  12.844   2.390  -2.291
  305   2HB   TRP  31          HB1       TRP  31  13.928   3.557  -2.939
  306    HD1  TRP  31           HD1      TRP  31  11.938   0.657  -3.857
  307    HE1  TRP  31           HE1      TRP  31  12.072   0.297  -6.396
  308    HE3  TRP  31           HE3      TRP  31  15.501   3.849  -4.651
  309    HZ2  TRP  31           HZ2      TRP  31  13.628   1.355  -8.518
  310    HZ3  TRP  31           HZ3      TRP  31  16.398   4.241  -6.970
  311    HH2  TRP  31           HH2      TRP  31  15.460   2.991  -8.874
  312    H    ARG  32           HN       ARG  32  14.952   3.377  -0.278
  313    HA   ARG  32           HA       ARG  32  17.052   5.101  -1.029
  314   1HB   ARG  32          HB2       ARG  32  16.011   4.113   1.588
  315   2HB   ARG  32          HB1       ARG  32  17.114   5.486   1.447
  316   1HG   ARG  32          HG2       ARG  32  15.450   6.675   0.137
  317   2HG   ARG  32          HG1       ARG  32  14.362   5.308   0.244
  318   1HD   ARG  32          HD2       ARG  32  13.564   6.564   1.954
  319   2HD   ARG  32          HD1       ARG  32  14.753   5.586   2.803
  320    HE   ARG  32           HE       ARG  32  16.179   7.759   2.132
  321   1HH1  ARG  32          1HH1      ARG  32  13.058   7.405   3.656
  322   2HH1  ARG  32          2HH1      ARG  32  13.189   8.881   4.551
  323   1HH2  ARG  32          1HH2      ARG  32  16.348   9.704   3.308
  324   2HH2  ARG  32          2HH2      ARG  32  15.055  10.186   4.354
  325    H    LEU  33           HN       LEU  33  16.838   2.263   0.926
  326    HA   LEU  33           HA       LEU  33  19.456   1.895   1.759
  327   1HB   LEU  33          HB2       LEU  33  16.926   0.385   1.445
  328   2HB   LEU  33          HB1       LEU  33  18.335  -0.474   1.909
  329    HG   LEU  33           HG       LEU  33  16.551   0.789   3.538
  330   1HD1  LEU  33          HD11      LEU  33  17.681  -0.249   5.195
  331   2HD1  LEU  33          HD12      LEU  33  19.228   0.437   4.701
  332   3HD1  LEU  33          HD13      LEU  33  18.580  -0.971   3.860
  333   1HD2  LEU  33          HD21      LEU  33  17.630   2.911   2.761
  334   2HD2  LEU  33          HD22      LEU  33  19.067   2.404   3.651
  335   3HD2  LEU  33          HD23      LEU  33  17.549   2.682   4.510
  336    H    PHE  34           HN       PHE  34  17.562   0.799  -0.868
  337    HA   PHE  34           HA       PHE  34  19.523  -0.985  -1.953
  338   1HB   PHE  34          HB2       PHE  34  16.811  -0.206  -2.516
  339   2HB   PHE  34          HB1       PHE  34  17.734  -0.532  -3.953
  340    HD1  PHE  34           HD1      PHE  34  16.836  -2.586  -4.624
  341    HD2  PHE  34           HD2      PHE  34  18.158  -1.928  -0.664
  342    HE1  PHE  34           HE1      PHE  34  16.638  -4.981  -4.181
  343    HE2  PHE  34           HE2      PHE  34  17.973  -4.322  -0.188
  344    HZ   PHE  34           HZ       PHE  34  17.202  -5.881  -1.948
  345    H    SER  35           HN       SER  35  18.781   2.241  -1.998
  346    HA   SER  35           HA       SER  35  20.345   2.762  -4.464
  347   1HB   SER  35          HB2       SER  35  18.132   4.113  -3.399
  348   2HB   SER  35          HB1       SER  35  19.500   5.187  -3.131
  349    HG   SER  35           HG       SER  35  18.699   4.032  -5.592
  350    H    LYS  36           HN       LYS  36  20.509   3.192  -0.987
  351    HA   LYS  36           HA       LYS  36  22.828   4.861  -1.072
  352   1HB   LYS  36          HB2       LYS  36  22.874   4.704   1.282
  353   2HB   LYS  36          HB1       LYS  36  21.186   4.746   0.821
  354   1HG   LYS  36          HG2       LYS  36  21.252   3.151   2.486
  355   2HG   LYS  36          HG1       LYS  36  21.282   2.188   1.014
  356   1HD   LYS  36          HD2       LYS  36  23.966   2.774   1.638
  357   2HD   LYS  36          HD1       LYS  36  23.191   2.310   3.152
  358   1HE   LYS  36          HE2       LYS  36  22.572   0.628   0.808
  359   2HE   LYS  36          HE1       LYS  36  24.230   0.548   1.402
  360   1HZ   LYS  36          HZ1       LYS  36  23.319  -1.010   2.735
  361   2HZ   LYS  36          HZ2       LYS  36  21.762  -0.353   2.657
  362   3HZ   LYS  36          HZ3       LYS  36  22.916   0.332   3.685
  363    H    HIS  37           HN       HIS  37  22.278   1.544  -1.334
  364    HA   HIS  37           HA       HIS  37  24.889   0.680  -0.537
  365   1HB   HIS  37          HB2       HIS  37  23.670  -1.150  -0.256
  366   2HB   HIS  37          HB1       HIS  37  22.324  -0.510  -1.129
  367    HD1  HIS  37           HD1      HIS  37  25.141  -2.900  -1.428
  368    HD2  HIS  37           HD2      HIS  37  22.217  -1.208  -3.838
  369    HE1  HIS  37           HE1      HIS  37  25.087  -4.321  -3.504
  370    HE2  HIS  37           HE2      HIS  37  23.233  -3.344  -4.906
  371    H    GLU  38           HN       GLU  38  23.091   0.542  -3.570
  372    HA   GLU  38           HA       GLU  38  23.784   0.320  -5.742
  373   1HB   GLU  38          HB2       GLU  38  25.422   2.198  -6.380
  374   2HB   GLU  38          HB1       GLU  38  23.856   2.650  -5.724
  375   1HG   GLU  38          HG2       GLU  38  24.854   3.036  -3.547
  376   2HG   GLU  38          HG1       GLU  38  26.426   2.528  -4.164
  Start of MODEL   20
    1   1H    VAL   1          HT1       VAL   1 -30.581   1.724   3.847
    2   2H    VAL   1          HT2       VAL   1 -29.866   1.225   5.326
    3   3H    VAL   1          HT3       VAL   1 -31.236   0.395   4.709
    4    HA   VAL   1           HA       VAL   1 -30.088  -0.657   3.116
    5    HB   VAL   1           HB       VAL   1 -27.737   0.089   2.479
    6   1HG1  VAL   1          HG11      VAL   1 -29.527   2.297   1.702
    7   2HG1  VAL   1          HG12      VAL   1 -30.142   0.670   1.412
    8   3HG1  VAL   1          HG13      VAL   1 -28.608   1.172   0.702
    9   1HG2  VAL   1          HG21      VAL   1 -27.110   2.370   2.924
   10   2HG2  VAL   1          HG22      VAL   1 -27.418   1.553   4.456
   11   3HG2  VAL   1          HG23      VAL   1 -28.620   2.657   3.789
   12    H    MET   2           HN       MET   2 -28.655  -2.385   3.381
   13    HA   MET   2           HA       MET   2 -27.906  -2.924   6.080
   14   1HB   MET   2          HB2       MET   2 -28.072  -4.380   3.508
   15   2HB   MET   2          HB1       MET   2 -26.925  -4.987   4.677
   16   1HG   MET   2          HG2       MET   2 -29.860  -4.576   5.140
   17   2HG   MET   2          HG1       MET   2 -29.064  -6.122   4.856
   18   1HE   MET   2          HE1       MET   2 -30.154  -4.489   8.704
   19   2HE   MET   2          HE2       MET   2 -30.735  -4.165   7.071
   20   3HE   MET   2          HE3       MET   2 -29.446  -3.178   7.760
   21    HA   PRO   3           HA       PRO   3 -23.617  -1.829   5.550
   22   1HB   PRO   3          HB2       PRO   3 -22.726  -2.491   7.933
   23   2HB   PRO   3          HB1       PRO   3 -24.135  -1.434   7.848
   24   1HG   PRO   3          HG2       PRO   3 -24.050  -4.404   8.235
   25   2HG   PRO   3          HG1       PRO   3 -24.891  -3.190   9.226
   26   1HD   PRO   3          HD2       PRO   3 -26.083  -4.606   7.171
   27   2HD   PRO   3          HD1       PRO   3 -26.639  -3.018   7.737
   28    H    LYS   4           HN       LYS   4 -21.549  -3.500   6.826
   29    HA   LYS   4           HA       LYS   4 -20.256  -5.332   6.504
   30   1HB   LYS   4          HB2       LYS   4 -22.573  -6.479   6.703
   31   2HB   LYS   4          HB1       LYS   4 -22.448  -6.669   4.961
   32   1HG   LYS   4          HG2       LYS   4 -20.292  -7.609   6.825
   33   2HG   LYS   4          HG1       LYS   4 -21.679  -8.614   6.402
   34   1HD   LYS   4          HD2       LYS   4 -20.650  -7.559   3.989
   35   2HD   LYS   4          HD1       LYS   4 -19.275  -8.148   4.926
   36   1HE   LYS   4          HE2       LYS   4 -19.962 -10.317   4.830
   37   2HE   LYS   4          HE1       LYS   4 -21.671  -9.887   4.781
   38   1HZ   LYS   4          HZ1       LYS   4 -20.315 -10.774   2.673
   39   2HZ   LYS   4          HZ2       LYS   4 -20.110  -9.110   2.462
   40   3HZ   LYS   4          HZ3       LYS   4 -21.667  -9.765   2.550
   41    H    GLN   5           HN       GLN   5 -22.017  -3.985   3.789
   42    HA   GLN   5           HA       GLN   5 -19.990  -4.948   1.945
   43   1HB   GLN   5          HB2       GLN   5 -21.730  -4.995   0.514
   44   2HB   GLN   5          HB1       GLN   5 -22.753  -4.323   1.766
   45   1HG   GLN   5          HG2       GLN   5 -23.051  -2.843   0.074
   46   2HG   GLN   5          HG1       GLN   5 -21.803  -2.043   0.992
   47   1HE2  GLN   5          HE21      GLN   5 -19.717  -3.768  -0.013
   48   2HE2  GLN   5          HE22      GLN   5 -19.515  -3.345  -1.654
   49    H    ILE   6           HN       ILE   6 -21.010  -2.149   3.636
   50    HA   ILE   6           HA       ILE   6 -19.275  -0.386   2.178
   51    HB   ILE   6           HB       ILE   6 -19.962   1.194   4.119
   52   1HG1  ILE   6          HG12      ILE   6 -22.184   0.793   5.010
   53   2HG1  ILE   6          HG11      ILE   6 -22.271  -0.758   4.215
   54   1HG2  ILE   6          HG21      ILE   6 -20.504   1.414   1.770
   55   2HG2  ILE   6          HG22      ILE   6 -21.858   1.905   2.793
   56   3HG2  ILE   6          HG23      ILE   6 -21.879   0.331   1.990
   57   1HD1  ILE   6          HD11      ILE   6 -19.972  -0.359   6.009
   58   2HD1  ILE   6          HD12      ILE   6 -21.020  -1.764   5.804
   59   3HD1  ILE   6          HD13      ILE   6 -21.557  -0.398   6.780
   60    H    VAL   7           HN       VAL   7 -19.370  -2.313   5.045
   61    HA   VAL   7           HA       VAL   7 -17.141  -1.126   6.383
   62    HB   VAL   7           HB       VAL   7 -19.143  -2.627   7.289
   63   1HG1  VAL   7          HG11      VAL   7 -18.531  -4.598   5.950
   64   2HG1  VAL   7          HG12      VAL   7 -18.509  -4.926   7.683
   65   3HG1  VAL   7          HG13      VAL   7 -16.995  -4.686   6.811
   66   1HG2  VAL   7          HG21      VAL   7 -16.435  -3.062   8.460
   67   2HG2  VAL   7          HG22      VAL   7 -17.981  -2.844   9.281
   68   3HG2  VAL   7          HG23      VAL   7 -17.214  -1.482   8.468
   69    H    TYR   8           HN       TYR   8 -17.852  -3.801   4.300
   70    HA   TYR   8           HA       TYR   8 -15.371  -5.122   4.161
   71   1HB   TYR   8          HB2       TYR   8 -17.894  -5.136   2.740
   72   2HB   TYR   8          HB1       TYR   8 -16.548  -5.201   1.606
   73    HD1  TYR   8           HD1      TYR   8 -14.550  -6.649   3.100
   74    HD2  TYR   8           HD2      TYR   8 -18.722  -7.318   2.843
   75    HE1  TYR   8           HE1      TYR   8 -14.197  -8.908   3.682
   76    HE2  TYR   8           HE2      TYR   8 -18.388  -9.635   3.412
   77    HH   TYR   8           HH       TYR   8 -15.403 -11.159   3.334
   78    H    TRP   9           HN       TRP   9 -16.938  -2.557   2.328
   79    HA   TRP   9           HA       TRP   9 -14.881  -1.913   0.510
   80   1HB   TRP   9          HB2       TRP   9 -17.359  -0.712   1.554
   81   2HB   TRP   9          HB1       TRP   9 -16.125   0.481   1.141
   82    HD1  TRP   9           HD1      TRP   9 -18.803  -1.433  -0.360
   83    HE1  TRP   9           HE1      TRP   9 -18.585  -1.267  -2.951
   84    HE3  TRP   9           HE3      TRP   9 -14.220   0.438  -0.609
   85    HZ2  TRP   9           HZ2      TRP   9 -16.692  -0.434  -4.825
   86    HZ3  TRP   9           HZ3      TRP   9 -13.206   0.932  -2.807
   87    HH2  TRP   9           HH2      TRP   9 -14.452   0.485  -4.876
   88    H    LYS  10           HN       LYS  10 -16.014  -0.333   3.329
   89    HA   LYS  10           HA       LYS  10 -14.043   1.485   3.885
   90   1HB   LYS  10          HB2       LYS  10 -15.767   1.746   5.359
   91   2HB   LYS  10          HB1       LYS  10 -16.069   0.028   5.456
   92   1HG   LYS  10          HG2       LYS  10 -15.324   1.250   7.569
   93   2HG   LYS  10          HG1       LYS  10 -14.547  -0.283   7.175
   94   1HD   LYS  10          HD2       LYS  10 -12.551   0.669   6.956
   95   2HD   LYS  10          HD1       LYS  10 -13.195   1.993   5.984
   96   1HE   LYS  10          HE2       LYS  10 -13.097   1.777   8.988
   97   2HE   LYS  10          HE1       LYS  10 -12.275   2.954   7.964
   98   1HZ   LYS  10          HZ1       LYS  10 -14.733   3.495   7.273
   99   2HZ   LYS  10          HZ2       LYS  10 -14.044   4.181   8.655
  100   3HZ   LYS  10          HZ3       LYS  10 -15.078   2.852   8.800
  101    H    GLN  11           HN       GLN  11 -14.158  -1.842   5.128
  102    HA   GLN  11           HA       GLN  11 -11.557  -1.627   6.295
  103   1HB   GLN  11          HB2       GLN  11 -11.827  -3.885   6.961
  104   2HB   GLN  11          HB1       GLN  11 -13.419  -3.162   7.085
  105   1HG   GLN  11          HG2       GLN  11 -14.080  -4.177   5.000
  106   2HG   GLN  11          HG1       GLN  11 -12.462  -4.809   4.761
  107   1HE2  GLN  11          HE21      GLN  11 -12.805  -5.192   7.982
  108   2HE2  GLN  11          HE22      GLN  11 -13.528  -6.758   8.018
  109    H    TRP  12           HN       TRP  12 -12.319  -1.636   3.222
  110    HA   TRP  12           HA       TRP  12  -9.995  -3.241   2.376
  111   1HB   TRP  12          HB2       TRP  12 -12.309  -3.771   1.448
  112   2HB   TRP  12          HB1       TRP  12 -12.223  -2.282   0.590
  113    HD1  TRP  12           HD1      TRP  12 -11.181  -5.767   0.389
  114    HE1  TRP  12           HE1      TRP  12  -9.617  -6.088  -1.614
  115    HE3  TRP  12           HE3      TRP  12 -10.474  -0.984  -0.632
  116    HZ2  TRP  12           HZ2      TRP  12  -8.256  -4.435  -3.457
  117    HZ3  TRP  12           HZ3      TRP  12  -9.028  -0.306  -2.552
  118    HH2  TRP  12           HH2      TRP  12  -7.928  -2.048  -3.948
  119    H    LEU  13           HN       LEU  13 -11.574  -0.064   2.103
  120    HA   LEU  13           HA       LEU  13  -9.238   0.880   0.619
  121   1HB   LEU  13          HB2       LEU  13 -10.539   2.499  -0.276
  122   2HB   LEU  13          HB1       LEU  13 -11.827   1.394   0.151
  123    HG   LEU  13           HG       LEU  13 -12.600   3.488   0.834
  124   1HD1  LEU  13          HD11      LEU  13 -11.528   2.961   3.494
  125   2HD1  LEU  13          HD12      LEU  13 -12.228   1.549   2.709
  126   3HD1  LEU  13          HD13      LEU  13 -13.194   3.003   2.924
  127   1HD2  LEU  13          HD21      LEU  13 -11.351   5.246   1.461
  128   2HD2  LEU  13          HD22      LEU  13 -10.027   4.297   0.787
  129   3HD2  LEU  13          HD23      LEU  13 -10.331   4.277   2.524
  130    H    SER  14           HN       SER  14 -10.381   0.691   3.777
  131    HA   SER  14           HA       SER  14  -9.085   3.107   4.653
  132   1HB   SER  14          HB2       SER  14 -11.105   1.576   5.743
  133   2HB   SER  14          HB1       SER  14  -9.718   1.121   6.720
  134    HG   SER  14           HG       SER  14 -10.087   2.914   7.740
  135    H    LEU  15           HN       LEU  15  -8.569  -0.361   4.891
  136    HA   LEU  15           HA       LEU  15  -6.017  -0.029   6.118
  137   1HB   LEU  15          HB2       LEU  15  -7.291  -2.505   4.978
  138   2HB   LEU  15          HB1       LEU  15  -5.927  -2.431   6.072
  139    HG   LEU  15           HG       LEU  15  -7.645  -2.971   7.513
  140   1HD1  LEU  15          HD11      LEU  15  -8.188  -1.004   8.820
  141   2HD1  LEU  15          HD12      LEU  15  -7.762   0.041   7.462
  142   3HD1  LEU  15          HD13      LEU  15  -6.512  -0.906   8.275
  143   1HD2  LEU  15          HD21      LEU  15  -9.185  -1.868   5.402
  144   2HD2  LEU  15          HD22      LEU  15  -9.737  -1.172   6.934
  145   3HD2  LEU  15          HD23      LEU  15  -9.708  -2.925   6.721
  146    H    ARG  16           HN       ARG  16  -7.109  -1.517   3.104
  147    HA   ARG  16           HA       ARG  16  -4.679  -1.945   1.915
  148   1HB   ARG  16          HB2       ARG  16  -7.317  -1.205   0.763
  149   2HB   ARG  16          HB1       ARG  16  -5.939  -1.356  -0.294
  150   1HG   ARG  16          HG2       ARG  16  -7.182  -3.474   1.431
  151   2HG   ARG  16          HG1       ARG  16  -7.110  -3.418  -0.330
  152   1HD   ARG  16          HD2       ARG  16  -4.531  -3.380   0.065
  153   2HD   ARG  16          HD1       ARG  16  -4.957  -4.040   1.643
  154    HE   ARG  16           HE       ARG  16  -4.953  -5.427  -0.837
  155   1HH1  ARG  16          1HH1      ARG  16  -6.631  -5.217   2.215
  156   2HH1  ARG  16          2HH1      ARG  16  -7.184  -6.857   2.167
  157   1HH2  ARG  16          1HH2      ARG  16  -5.674  -7.585  -0.900
  158   2HH2  ARG  16          2HH2      ARG  16  -6.640  -8.202   0.399
  159    H    ASN  17           HN       ASN  17  -6.271   1.040   2.386
  160    HA   ASN  17           HA       ASN  17  -4.929   2.641   0.560
  161   1HB   ASN  17          HB2       ASN  17  -6.694   2.945   2.809
  162   2HB   ASN  17          HB1       ASN  17  -5.537   4.215   2.768
  163   1HD2  ASN  17          HD21      ASN  17  -7.774   5.226   2.481
  164   2HD2  ASN  17          HD22      ASN  17  -8.221   5.533   0.848
  165    HA   PRO  18           HA       PRO  18  -1.770   4.204   3.737
  166   1HB   PRO  18          HB2       PRO  18  -1.799   2.990   6.217
  167   2HB   PRO  18          HB1       PRO  18  -2.447   4.590   5.848
  168   1HG   PRO  18          HG2       PRO  18  -3.851   1.968   5.949
  169   2HG   PRO  18          HG1       PRO  18  -4.372   3.542   6.581
  170   1HD   PRO  18          HD2       PRO  18  -5.361   2.665   4.302
  171   2HD   PRO  18          HD1       PRO  18  -4.866   4.357   4.449
  172    H    ILE  19           HN       ILE  19  -2.822   0.978   3.576
  173    HA   ILE  19           HA       ILE  19  -0.331  -0.220   4.306
  174    HB   ILE  19           HB       ILE  19  -2.749  -1.372   2.941
  175   1HG1  ILE  19          HG12      ILE  19  -1.704  -1.383   5.764
  176   2HG1  ILE  19          HG11      ILE  19  -3.231  -0.751   5.197
  177   1HG2  ILE  19          HG21      ILE  19  -0.105  -2.471   3.160
  178   2HG2  ILE  19          HG22      ILE  19  -1.535  -3.161   2.396
  179   3HG2  ILE  19          HG23      ILE  19  -1.233  -3.436   4.110
  180   1HD1  ILE  19          HD11      ILE  19  -4.045  -2.983   4.768
  181   2HD1  ILE  19          HD12      ILE  19  -3.482  -2.850   6.434
  182   3HD1  ILE  19          HD13      ILE  19  -2.484  -3.664   5.228
  183    H    LEU  20           HN       LEU  20  -1.720   0.886   1.335
  184    HA   LEU  20           HA       LEU  20   0.198  -0.489  -0.319
  185   1HB   LEU  20          HB2       LEU  20  -0.675   0.689  -2.174
  186   2HB   LEU  20          HB1       LEU  20  -2.041   0.262  -1.167
  187    HG   LEU  20           HG       LEU  20  -1.145   2.874  -0.433
  188   1HD1  LEU  20          HD11      LEU  20  -0.298   3.535  -2.426
  189   2HD1  LEU  20          HD12      LEU  20  -2.006   3.758  -2.802
  190   3HD1  LEU  20          HD13      LEU  20  -1.171   2.297  -3.329
  191   1HD2  LEU  20          HD21      LEU  20  -3.369   1.781  -0.174
  192   2HD2  LEU  20          HD22      LEU  20  -3.634   2.068  -1.896
  193   3HD2  LEU  20          HD23      LEU  20  -3.408   3.431  -0.797
  194    H    VAL  21           HN       VAL  21  -0.261   2.643   1.096
  195    HA   VAL  21           HA       VAL  21   1.933   4.036   0.107
  196    HB   VAL  21           HB       VAL  21   0.286   4.015   2.577
  197   1HG1  VAL  21          HG11      VAL  21   1.523   5.816   3.537
  198   2HG1  VAL  21          HG12      VAL  21   2.627   5.835   2.158
  199   3HG1  VAL  21          HG13      VAL  21   2.588   4.438   3.238
  200   1HG2  VAL  21          HG21      VAL  21   0.758   6.090   0.445
  201   2HG2  VAL  21          HG22      VAL  21  -0.371   6.235   1.796
  202   3HG2  VAL  21          HG23      VAL  21  -0.620   4.991   0.563
  203    H    PHE  22           HN       PHE  22   1.397   2.202   3.045
  204    HA   PHE  22           HA       PHE  22   3.894   2.295   4.236
  205   1HB   PHE  22          HB2       PHE  22   2.398   1.372   5.657
  206   2HB   PHE  22          HB1       PHE  22   1.426   0.752   4.349
  207    HD1  PHE  22           HD1      PHE  22   4.696   0.183   5.881
  208    HD2  PHE  22           HD2      PHE  22   1.211  -1.360   4.123
  209    HE1  PHE  22           HE1      PHE  22   5.538  -2.086   6.287
  210    HE2  PHE  22           HE2      PHE  22   1.995  -3.665   4.521
  211    HZ   PHE  22           HZ       PHE  22   4.180  -4.026   5.586
  212    H    LEU  23           HN       LEU  23   2.629   0.468   1.618
  213    HA   LEU  23           HA       LEU  23   4.856  -1.425   1.420
  214   1HB   LEU  23          HB2       LEU  23   2.477  -0.779  -0.291
  215   2HB   LEU  23          HB1       LEU  23   3.797  -1.703  -0.973
  216    HG   LEU  23           HG       LEU  23   1.684  -2.834   0.162
  217   1HD1  LEU  23          HD11      LEU  23   3.028  -4.388  -0.768
  218   2HD1  LEU  23          HD12      LEU  23   3.553  -4.639   0.897
  219   3HD1  LEU  23          HD13      LEU  23   4.499  -3.613  -0.182
  220   1HD2  LEU  23          HD21      LEU  23   2.746  -1.561   2.293
  221   2HD2  LEU  23          HD22      LEU  23   3.467  -3.167   2.451
  222   3HD2  LEU  23          HD23      LEU  23   1.711  -2.990   2.389
  223    H    LYS  24           HN       LYS  24   3.867   1.529   0.150
  224    HA   LYS  24           HA       LYS  24   5.689   1.778  -1.982
  225   1HB   LYS  24          HB2       LYS  24   3.471   3.144  -0.835
  226   2HB   LYS  24          HB1       LYS  24   4.724   4.303  -1.136
  227   1HG   LYS  24          HG2       LYS  24   4.003   4.339  -3.238
  228   2HG   LYS  24          HG1       LYS  24   4.646   2.701  -3.385
  229   1HD   LYS  24          HD2       LYS  24   2.370   2.081  -2.224
  230   2HD   LYS  24          HD1       LYS  24   1.850   3.601  -2.961
  231   1HE   LYS  24          HE2       LYS  24   3.363   1.785  -4.719
  232   2HE   LYS  24          HE1       LYS  24   1.778   1.202  -4.211
  233   1HZ   LYS  24          HZ1       LYS  24   1.115   2.395  -5.983
  234   2HZ   LYS  24          HZ2       LYS  24   2.466   3.413  -5.964
  235   3HZ   LYS  24          HZ3       LYS  24   1.182   3.696  -4.902
  236    H    THR  25           HN       THR  25   5.523   3.014   1.261
  237    HA   THR  25           HA       THR  25   7.932   4.494   1.135
  238    HB   THR  25           HB       THR  25   6.306   5.238   2.696
  239    HG1  THR  25           HG1      THR  25   7.478   5.266   4.559
  240   1HG2  THR  25          HG21      THR  25   5.067   3.999   4.119
  241   2HG2  THR  25          HG22      THR  25   6.351   2.822   4.390
  242   3HG2  THR  25          HG23      THR  25   5.389   2.753   2.911
  243    H    ARG  26           HN       ARG  26   6.973   1.365   2.559
  244    HA   ARG  26           HA       ARG  26   9.428   0.707   3.726
  245   1HB   ARG  26          HB2       ARG  26   7.239  -0.924   2.478
  246   2HB   ARG  26          HB1       ARG  26   8.643  -1.689   3.213
  247   1HG   ARG  26          HG2       ARG  26   6.465  -0.111   4.523
  248   2HG   ARG  26          HG1       ARG  26   7.039  -1.727   4.893
  249   1HD   ARG  26          HD2       ARG  26   9.243  -0.580   5.526
  250   2HD   ARG  26          HD1       ARG  26   8.302   0.912   5.517
  251    HE   ARG  26           HE       ARG  26   7.301  -1.289   7.144
  252   1HH1  ARG  26          1HH1      ARG  26   8.997   1.767   7.025
  253   2HH1  ARG  26          2HH1      ARG  26   8.767   2.094   8.709
  254   1HH2  ARG  26          1HH2      ARG  26   7.007  -0.854   9.353
  255   2HH2  ARG  26          2HH2      ARG  26   7.642   0.609  10.029
  256    H    VAL  27           HN       VAL  27   8.229   0.360   0.476
  257    HA   VAL  27           HA       VAL  27  10.491  -1.016  -0.582
  258    HB   VAL  27           HB       VAL  27   7.952   0.163  -1.544
  259   1HG1  VAL  27          HG11      VAL  27   9.303   1.203  -3.120
  260   2HG1  VAL  27          HG12      VAL  27   8.658  -0.230  -3.921
  261   3HG1  VAL  27          HG13      VAL  27  10.320  -0.221  -3.326
  262   1HG2  VAL  27          HG21      VAL  27   7.758  -2.023  -2.661
  263   2HG2  VAL  27          HG22      VAL  27   8.058  -2.172  -0.928
  264   3HG2  VAL  27          HG23      VAL  27   9.369  -2.444  -2.078
  265    H    LEU  28           HN       LEU  28   9.653   2.230   0.067
  266    HA   LEU  28           HA       LEU  28  11.353   3.511  -1.803
  267   1HB   LEU  28          HB2       LEU  28  10.174   5.330  -1.182
  268   2HB   LEU  28          HB1       LEU  28   9.146   4.216  -0.358
  269    HG   LEU  28           HG       LEU  28  10.341   4.610   1.722
  270   1HD1  LEU  28          HD11      LEU  28  12.429   5.363   1.624
  271   2HD1  LEU  28          HD12      LEU  28  11.746   6.960   1.316
  272   3HD1  LEU  28          HD13      LEU  28  12.227   5.931  -0.032
  273   1HD2  LEU  28          HD21      LEU  28   8.947   6.286   2.163
  274   2HD2  LEU  28          HD22      LEU  28   8.565   6.305   0.442
  275   3HD2  LEU  28          HD23      LEU  28   9.807   7.381   1.081
  276    H    LYS  29           HN       LYS  29  11.215   2.938   1.605
  277    HA   LYS  29           HA       LYS  29  13.801   3.895   2.199
  278   1HB   LYS  29          HB2       LYS  29  13.466   3.031   4.414
  279   2HB   LYS  29          HB1       LYS  29  11.951   3.738   3.875
  280   1HG   LYS  29          HG2       LYS  29  11.222   1.418   3.239
  281   2HG   LYS  29          HG1       LYS  29  12.654   0.824   4.080
  282   1HD   LYS  29          HD2       LYS  29  10.393   2.433   5.265
  283   2HD   LYS  29          HD1       LYS  29  10.741   0.728   5.556
  284   1HE   LYS  29          HE2       LYS  29  11.838   1.484   7.361
  285   2HE   LYS  29          HE1       LYS  29  13.115   1.873   6.209
  286   1HZ   LYS  29          HZ1       LYS  29  12.889   3.894   7.157
  287   2HZ   LYS  29          HZ2       LYS  29  11.281   3.644   7.618
  288   3HZ   LYS  29          HZ3       LYS  29  11.647   4.062   6.020
  289    H    ARG  30           HN       ARG  30  12.538   1.067   0.868
  290    HA   ARG  30           HA       ARG  30  14.774  -0.620   1.499
  291   1HB   ARG  30          HB2       ARG  30  13.510  -2.292   0.595
  292   2HB   ARG  30          HB1       ARG  30  12.214  -1.167   0.824
  293   1HG   ARG  30          HG2       ARG  30  11.805  -1.137  -1.341
  294   2HG   ARG  30          HG1       ARG  30  13.459  -0.718  -1.715
  295   1HD   ARG  30          HD2       ARG  30  14.074  -2.885  -2.089
  296   2HD   ARG  30          HD1       ARG  30  12.882  -3.526  -0.960
  297    HE   ARG  30           HE       ARG  30  11.745  -2.345  -3.328
  298   1HH1  ARG  30          1HH1      ARG  30  13.030  -5.260  -1.901
  299   2HH1  ARG  30          2HH1      ARG  30  12.191  -6.312  -2.990
  300   1HH2  ARG  30          1HH2      ARG  30  10.641  -3.731  -4.764
  301   2HH2  ARG  30          2HH2      ARG  30  10.837  -5.446  -4.616
  302    H    TRP  31           HN       TRP  31  13.516   1.450  -0.913
  303    HA   TRP  31           HA       TRP  31  15.280   1.004  -3.025
  304   1HB   TRP  31          HB2       TRP  31  12.984   2.477  -2.421
  305   2HB   TRP  31          HB1       TRP  31  14.167   3.625  -2.906
  306    HD1  TRP  31           HD1      TRP  31  12.077   0.938  -4.171
  307    HE1  TRP  31           HE1      TRP  31  12.367   0.750  -6.717
  308    HE3  TRP  31           HE3      TRP  31  15.882   3.926  -4.490
  309    HZ2  TRP  31           HZ2      TRP  31  14.129   1.849  -8.647
  310    HZ3  TRP  31           HZ3      TRP  31  16.961   4.423  -6.709
  311    HH2  TRP  31           HH2      TRP  31  16.081   3.378  -8.759
  312    H    ARG  32           HN       ARG  32  15.025   3.247  -0.281
  313    HA   ARG  32           HA       ARG  32  17.267   4.859  -0.753
  314   1HB   ARG  32          HB2       ARG  32  15.945   3.817   1.720
  315   2HB   ARG  32          HB1       ARG  32  17.075   5.177   1.715
  316   1HG   ARG  32          HG2       ARG  32  14.548   5.173   0.088
  317   2HG   ARG  32          HG1       ARG  32  14.599   5.722   1.742
  318   1HD   ARG  32          HD2       ARG  32  16.150   6.765  -0.590
  319   2HD   ARG  32          HD1       ARG  32  14.827   7.586   0.236
  320    HE   ARG  32           HE       ARG  32  16.604   7.243   2.219
  321   1HH1  ARG  32          1HH1      ARG  32  16.955   8.512  -1.016
  322   2HH1  ARG  32          2HH1      ARG  32  18.251   9.577  -0.591
  323   1HH2  ARG  32          1HH2      ARG  32  18.310   8.645   2.776
  324   2HH2  ARG  32          2HH2      ARG  32  19.021   9.652   1.560
  325    H    LEU  33           HN       LEU  33  16.709   1.962   1.062
  326    HA   LEU  33           HA       LEU  33  19.218   1.385   2.081
  327   1HB   LEU  33          HB2       LEU  33  16.629   0.067   1.499
  328   2HB   LEU  33          HB1       LEU  33  17.940  -0.919   2.002
  329    HG   LEU  33           HG       LEU  33  16.137   0.375   3.577
  330   1HD1  LEU  33          HD11      LEU  33  17.055  -0.858   5.223
  331   2HD1  LEU  33          HD12      LEU  33  18.672  -0.223   4.923
  332   3HD1  LEU  33          HD13      LEU  33  18.041  -1.532   3.924
  333   1HD2  LEU  33          HD21      LEU  33  17.178   2.139   4.720
  334   2HD2  LEU  33          HD22      LEU  33  17.420   2.447   2.997
  335   3HD2  LEU  33          HD23      LEU  33  18.739   1.794   3.970
  336    H    PHE  34           HN       PHE  34  17.483   0.503  -0.728
  337    HA   PHE  34           HA       PHE  34  19.391  -1.360  -1.746
  338   1HB   PHE  34          HB2       PHE  34  16.806  -0.328  -2.491
  339   2HB   PHE  34          HB1       PHE  34  17.818  -0.680  -3.860
  340    HD1  PHE  34           HD1      PHE  34  17.857  -2.241  -0.616
  341    HD2  PHE  34           HD2      PHE  34  16.793  -2.616  -4.691
  342    HE1  PHE  34           HE1      PHE  34  17.438  -4.627  -0.273
  343    HE2  PHE  34           HE2      PHE  34  16.354  -4.999  -4.377
  344    HZ   PHE  34           HZ       PHE  34  16.671  -6.038  -2.156
  345    H    SER  35           HN       SER  35  18.872   1.916  -1.709
  346    HA   SER  35           HA       SER  35  20.684   2.424  -4.001
  347   1HB   SER  35          HB2       SER  35  18.498   3.895  -3.053
  348   2HB   SER  35          HB1       SER  35  19.912   4.842  -2.603
  349    HG   SER  35           HG       SER  35  19.015   4.073  -5.146
  350    H    LYS  36           HN       LYS  36  20.601   2.618  -0.509
  351    HA   LYS  36           HA       LYS  36  23.068   4.082  -0.348
  352   1HB   LYS  36          HB2       LYS  36  22.684   4.233   1.890
  353   2HB   LYS  36          HB1       LYS  36  21.051   3.865   1.362
  354   1HG   LYS  36          HG2       LYS  36  21.238   1.607   2.054
  355   2HG   LYS  36          HG1       LYS  36  22.979   1.757   2.304
  356   1HD   LYS  36          HD2       LYS  36  21.686   1.794   4.414
  357   2HD   LYS  36          HD1       LYS  36  22.633   3.259   4.155
  358   1HE   LYS  36          HE2       LYS  36  19.840   3.249   3.163
  359   2HE   LYS  36          HE1       LYS  36  20.075   3.308   4.909
  360   1HZ   LYS  36          HZ1       LYS  36  20.883   5.388   4.816
  361   2HZ   LYS  36          HZ2       LYS  36  20.054   5.462   3.344
  362   3HZ   LYS  36          HZ3       LYS  36  21.713   5.136   3.363
  363    H    HIS  37           HN       HIS  37  22.150   0.807  -0.551
  364    HA   HIS  37           HA       HIS  37  24.585  -0.296   0.473
  365   1HB   HIS  37          HB2       HIS  37  22.020  -1.274  -0.421
  366   2HB   HIS  37          HB1       HIS  37  23.319  -2.221  -1.121
  367    HD1  HIS  37           HD1      HIS  37  23.899  -4.173   0.276
  368    HD2  HIS  37           HD2      HIS  37  22.578  -0.967   2.565
  369    HE1  HIS  37           HE1      HIS  37  23.954  -4.980   2.658
  370    HE2  HIS  37           HE2      HIS  37  23.223  -3.000   4.032
  371    H    GLU  38           HN       GLU  38  23.173   0.025  -2.771
  372    HA   GLU  38           HA       GLU  38  24.074  -0.233  -4.851
  373   1HB   GLU  38          HB2       GLU  38  26.079   1.180  -5.236
  374   2HB   GLU  38          HB1       GLU  38  24.802   2.006  -4.354
  375   1HG   GLU  38          HG2       GLU  38  25.980   1.756  -2.287
  376   2HG   GLU  38          HG1       GLU  38  27.196   0.734  -3.052